data_r4cg0sf
# 
_audit.revision_id     1_0 
_audit.creation_date   ? 
_audit.update_record   'Initial release' 
# 
_cell.entry_id      4cg0 
_cell.length_a      53.0400 
_cell.length_b      57.5500 
_cell.length_c      71.3700 
_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   0.9760 
# 
_diffrn_reflns.diffrn_id         1 
_diffrn_reflns.pdbx_d_res_high   1.360 
_diffrn_reflns.pdbx_d_res_low    44.800 
_diffrn_reflns.limit_h_max       36 
_diffrn_reflns.limit_h_min       0 
_diffrn_reflns.limit_k_max       39 
_diffrn_reflns.limit_k_min       0 
_diffrn_reflns.limit_l_max       52 
_diffrn_reflns.limit_l_min       0 
_diffrn_reflns.number            46318 
_diffrn_reflns.pdbx_number_obs   46263 
# 
_entry.id   4cg0 
# 
_exptl_crystal.id   1 
# 
_reflns_scale.group_code   1 
# 
_symmetry.entry_id               4cg0 
_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    2 o   55.625   3.2880   65.174   10.496   65.174   10.496   65.174   10.496   55.625   4.6500   55.625   4.6500 0.000000 0.000000 
1 1 1    0    0    4 o  410.573   4.3818  3480.28  104.882  3480.28  104.882  3480.28  104.882  410.573   6.1968  410.573   6.1968 0.000000 0.000000 
1 1 1    0    0    6 o  584.177   5.8586  7046.67  199.538  7046.67  199.538  7046.67  199.538  584.177   8.2854  584.177   8.2854 0.000000 0.000000 
1 1 1    0    0    8 o  477.155   7.0436  4704.15  195.842  4704.15  195.842  4704.15  195.842  477.155   9.9611  477.155   9.9611 0.000000 0.000000 
1 1 1    0    0   10 o  140.399   2.8779  407.613   23.523  407.613   23.523  407.613   23.523  140.399   4.0699  140.399   4.0699 0.000000 0.000000 
1 1 1    0    0   12 o  373.846   5.9271  2889.44  129.100  2889.44  129.100  2889.44  129.100  373.846   8.3822  373.846   8.3822 0.000000 0.000000 
1 1 1    0    0   14 o   18.360   7.7861   7.0106   14.951   7.0106   14.951   7.0106   14.951   18.360   11.011   18.360   11.011 0.000000 0.000000 
1 1 1    0    0   16 o  573.428   5.8606  6788.15  195.928  6788.15  195.928  6788.15  195.928  573.428   8.2882  573.428   8.2882 0.000000 0.000000 
1 1 1    0    0   18 o   63.312   9.9128   93.922   32.007   93.922   32.007   93.922   32.007   63.312   14.019   63.312   14.019 0.000000 0.000000 
1 1 1    0    0   20 o  454.481   4.9637  4264.35  131.512  4264.35  131.512  4264.35  131.512  454.481   7.0197  454.481   7.0197 0.000000 0.000000 
1 1 1    0    0   22 o  517.151   7.7650  5530.76  233.990  5530.76  233.990  5530.76  233.990  517.151   10.981  517.151   10.981 0.000000 0.000000 
1 1 1    0    0   24 o  370.544   4.4580  2835.73   96.290  2835.73   96.290  2835.73   96.290  370.544   6.3046  370.544   6.3046 0.000000 0.000000 
1 1 1    0    0   26 o   90.124   6.2367  172.542   32.064  172.542   32.064  172.542   32.064   90.124   8.8200   90.124   8.8200 0.000000 0.000000 
1 1 1    0    0   28 o  367.899   4.5259  2796.88   97.056  2796.88   97.056  2796.88   97.056  367.899   6.4006  367.899   6.4006 0.000000 0.000000 
1 1 1    0    0   30 o  113.882   5.4296  271.605   35.690  271.605   35.690  271.605   35.690  113.882   7.6786  113.882   7.6786 0.000000 0.000000 
1 1 1    0    0   32 o   46.083   12.569   60.211   32.039   60.211   32.039   60.211   32.039   46.083   17.775   46.083   17.775 0.000000 0.000000 
1 1 1    0    0   34 o   67.475   10.244  106.576   35.393  106.576   35.393  106.576   35.393   67.475   14.487   67.475   14.487 0.000000 0.000000 
1 1 1    0    0   36 o  128.780   6.9954  350.169   51.833  350.169   51.833  350.169   51.833  128.780   9.8930  128.780   9.8930 0.000000 0.000000 
1 1 1    0    0   38 f   35.671   16.200   8.6184   76.839   8.6184   76.839   8.6184   76.839   35.671   22.911   35.671   22.911 0.000000 0.000000 
1 1 1    0    0   40 o   54.431   13.076   81.557   37.202   81.557   37.202   81.557   37.202   54.431   18.492   54.431   18.492 0.000000 0.000000 
1 1 1    0    0   42 o  119.057   6.0693  301.215   41.645  301.215   41.645  301.215   41.645  119.057   8.5833  119.057   8.5833 0.000000 0.000000 
1 1 1    0    0   44 o   23.532   10.731   3.0589   34.162   3.0589   34.162   3.0589   34.162   23.532   15.176   23.532   15.176 0.000000 0.000000 
1 1 1    0    0   46 o   25.874   11.361   13.638   34.381   13.638   34.381   13.638   34.381   25.874   16.067   25.874   16.067 0.000000 0.000000 
1 1 1    0    0   48 o   19.800   9.4562  -9.7013   31.885  -9.7013   31.885  -9.7013   31.885   19.800   13.373   19.800   13.373 0.000000 0.000000 
1 1 1    0    0   50 o   24.345   11.338   3.4665   41.094   3.4665   41.094   3.4665   41.094   24.345   16.034   24.345   16.034 0.000000 0.000000 
1 1 1    0    1    1 o  151.042   1.7834  471.054   15.702  471.054   15.702  471.054   15.702  151.042   2.5221  151.042   2.5221 0.000000 0.000000 
1 1 1    0    1    2 o  282.751   3.3750  1651.81   55.626  1651.81   55.626  1651.81   55.626  282.751   4.7730  282.751   4.7730 0.000000 0.000000 
1 1 1    0    1    3 o  214.818   2.0675  952.409   25.895  952.409   25.895  952.409   25.895  214.818   2.9239  214.818   2.9239 0.000000 0.000000 
1 1 1    0    1    4 o  518.612   3.7335  5551.90  112.912  5551.90  112.912  5551.90  112.912  518.612   5.2800  518.612   5.2800 0.000000 0.000000 
1 1 1    0    1    5 o  151.791   1.8747  475.665   16.586  475.665   16.586  475.665   16.586  151.791   2.6512  151.791   2.6512 0.000000 0.000000 
1 1 1    0    1    6 o  903.407   6.1479 16859.54  323.892 16859.54  323.892 16859.54  323.892  903.407   8.6944  903.407   8.6944 0.000000 0.000000 
1 1 1    0    1    7 o   99.553   1.9253  204.858   11.161  204.858   11.161  204.858   11.161   99.553   2.7227   99.553   2.7227 0.000000 0.000000 
1 1 1    0    1    8 o  141.160   2.2908  411.621   18.839  411.621   18.839  411.621   18.839  141.160   3.2397  141.160   3.2397 0.000000 0.000000 
1 1 1    0    1    9 f  423.356   3.7080  3699.70   91.532  3699.70   91.532  3699.70   91.532  423.356   5.2438  423.356   5.2438 0.000000 0.000000 
1 1 1    0    1   10 o  226.615   2.2432  1059.94   29.638  1059.94   29.638  1059.94   29.638  226.615   3.1724  226.615   3.1724 0.000000 0.000000 
1 1 1    0    1   11 o  282.663   2.4903  1649.06   41.044  1649.06   41.044  1649.06   41.044  282.663   3.5218  282.663   3.5218 0.000000 0.000000 
1 1 1    0    1   12 o   59.531   3.4836   74.624   11.906   74.624   11.906   74.624   11.906   59.531   4.9265   59.531   4.9265 0.000000 0.000000 
1 1 1    0    1   13 o  127.793   2.2230  337.481   16.547  337.481   16.547  337.481   16.547  127.793   3.1438  127.793   3.1438 0.000000 0.000000 
1 1 1    0    1   14 o  128.786   3.2831  343.525   24.589  343.525   24.589  343.525   24.589  128.786   4.6430  128.786   4.6430 0.000000 0.000000 
1 1 1    0    1   15 o  496.406   3.6781  5085.48  106.470  5085.48  106.470  5085.48  106.470  496.406   5.2016  496.406   5.2016 0.000000 0.000000 
1 1 1    0    1   16 f  268.692   2.6096  1489.92   40.881  1489.92   40.881  1489.92   40.881  268.692   3.6905  268.692   3.6905 0.000000 0.000000 
1 1 1    0    1   17 o  129.748   2.8035  348.215   21.172  348.215   21.172  348.215   21.172  129.748   3.9647  129.748   3.9647 0.000000 0.000000 
1 1 1    0    1   18 o  197.926   2.9386  809.124   33.891  809.124   33.891  809.124   33.891  197.926   4.1558  197.926   4.1558 0.000000 0.000000 
1 1 1    0    1   19 o   88.540   3.7978  163.516   19.448  163.516   19.448  163.516   19.448   88.540   5.3709   88.540   5.3709 0.000000 0.000000 
1 1 1    0    1   20 o   95.933   3.5647  191.434   19.821  191.434   19.821  191.434   19.821   95.933   5.0413   95.933   5.0413 0.000000 0.000000 
1 1 1    0    1   21 f  146.253   2.8184  442.232   24.003  442.232   24.003  442.232   24.003  146.253   3.9858  146.253   3.9858 0.000000 0.000000 
1 1 1    0    1   22 o  134.652   3.4979  375.638   27.388  375.638   27.388  375.638   27.388  134.652   4.9467  134.652   4.9467 0.000000 0.000000 
1 1 1    0    1   23 o   95.500   3.6650  189.879   20.278  189.879   20.278  189.879   20.278   95.500   5.1831   95.500   5.1831 0.000000 0.000000 
1 1 1    0    1   24 o  129.235   3.1996  345.915   24.052  345.915   24.052  345.915   24.052  129.235   4.5250  129.235   4.5250 0.000000 0.000000 
1 1 1    0    1   25 o  216.352   2.7911  966.827   35.196  966.827   35.196  966.827   35.196  216.352   3.9472  216.352   3.9472 0.000000 0.000000 
1 1 1    0    1   26 o   12.239   6.1609 -27.1662   19.170 -27.1662   19.170 -27.1662   19.170   12.239   8.7128   12.239   8.7128 0.000000 0.000000 
1 1 1    0    1   27 o  259.165   3.2325  1388.01   48.831  1388.01   48.831  1388.01   48.831  259.165   4.5715  259.165   4.5715 0.000000 0.000000 
1 1 1    0    1   28 o   76.280   5.8715  124.627   25.339  124.627   25.339  124.627   25.339   76.280   8.3036   76.280   8.3036 0.000000 0.000000 
1 1 1    0    1   29 o  110.049   3.8710  252.079   24.708  252.079   24.708  252.079   24.708  110.049   5.4744  110.049   5.4744 0.000000 0.000000 
1 1 1    0    1   30 o   32.129   10.730   31.615   22.740   31.615   22.740   31.615   22.740   32.129   15.175   32.129   15.175 0.000000 0.000000 
1 1 1    0    1   31 o   54.832   10.079   73.974   27.856   73.974   27.856   73.974   27.856   54.832   14.254   54.832   14.254 0.000000 0.000000 
1 1 1    0    1   32 o   79.752   5.3272  135.218   24.273  135.218   24.273  135.218   24.273   79.752   7.5339   79.752   7.5339 0.000000 0.000000 
1 1 1    0    1   33 o   55.491   8.3561   72.064   23.770   72.064   23.770   72.064   23.770   55.491   11.817   55.491   11.817 0.000000 0.000000 
1 1 1    0    1   34 o  161.098   4.1595  539.042   38.967  539.042   38.967  539.042   38.967  161.098   5.8824  161.098   5.8824 0.000000 0.000000 
1 1 1    0    1   35 o   24.948   10.309   15.903   24.994   15.903   24.994   15.903   24.994   24.948   14.578   24.948   14.578 0.000000 0.000000 
1 1 1    0    1   36 o   92.453   5.4925  181.334   29.138  181.334   29.138  181.334   29.138   92.453   7.7676   92.453   7.7676 0.000000 0.000000 
1 1 1    0    1   37 o   25.342   10.410   17.094   25.261   17.094   25.261   17.094   25.261   25.342   14.722   25.342   14.722 0.000000 0.000000 
1 1 1    0    1   38 o   23.705   10.560   7.3567   30.849   7.3567   30.849   7.3567   30.849   23.705   14.934   23.705   14.934 0.000000 0.000000 
1 1 1    0    1   39 o   20.118   9.4982  -7.7943   30.524  -7.7943   30.524  -7.7943   30.524   20.118   13.433   20.118   13.433 0.000000 0.000000 
1 1 1    0    1   40 o   15.891   7.7649 -17.4939   24.355 -17.4939   24.355 -17.4939   24.355   15.891   10.981   15.891   10.981 0.000000 0.000000 
1 1 1    0    1   41 o   12.051   6.2552 -76.6095   29.314 -76.6095   29.314 -76.6095   29.314   12.051   8.8462   12.051   8.8462 0.000000 0.000000 
1 1 1    0    1   42 o   21.675   9.6739   7.2458   26.025   7.2458   26.025   7.2458   26.025   21.675   13.681   21.675   13.681 0.000000 0.000000 
1 1 1    0    1   43 o   33.021   11.560   36.794   26.806   36.794   26.806   36.794   26.806   33.021   16.349   33.021   16.349 0.000000 0.000000 
1 1 1    0    1   44 o   35.661   11.198   41.607   24.618   41.607   24.618   41.607   24.618   35.661   15.836   35.661   15.836 0.000000 0.000000 
1 1 1    0    1   45 o   13.450   6.8920 -53.3461   29.156 -53.3461   29.156 -53.3461   29.156   13.450   9.7468   13.450   9.7468 0.000000 0.000000 
1 1 1    0    1   46 o   23.695   10.397   14.225   28.746   14.225   28.746   14.225   28.746   23.695   14.704   23.695   14.704 0.000000 0.000000 
1 1 1    0    1   47 o   29.182   10.595   30.590   22.947   30.590   22.947   30.590   22.947   29.182   14.983   29.182   14.983 0.000000 0.000000 
1 1 1    0    1   48 f   34.200   10.724   40.466   22.579   40.466   22.579   40.466   22.579   34.200   15.166   34.200   15.166 0.000000 0.000000 
1 1 1    0    1   49 o   14.856   7.3400 -16.9488   23.409 -16.9488   23.409 -16.9488   23.409   14.856   10.380   14.856   10.380 0.000000 0.000000 
1 1 1    0    1   50 o   70.390   8.0261  122.895   30.383  122.895   30.383  122.895   30.383   70.390   11.351   70.390   11.351 0.000000 0.000000 
1 1 1    0    1   51 o   36.080   13.904   64.675   41.483   64.675   41.483   64.675   41.483   36.080   19.663   36.080   19.663 0.000000 0.000000 
1 1 1    0    2    1 o  211.148   4.0842  922.625   50.216  922.625   50.216  922.625   50.216  211.148   5.7759  211.148   5.7759 0.000000 0.000000 
1 1 1    0    2    2 f  108.837   1.6758  244.667   10.627  244.667   10.627  244.667   10.627  108.837   2.3700  108.837   2.3700 0.000000 0.000000 
1 1 1    0    2    3 o  478.702   4.0333  4731.45  112.582  4731.45  112.582  4731.45  112.582  478.702   5.7040  478.702   5.7040 0.000000 0.000000 
1 1 1    0    2    4 o  320.127   2.5971  2114.90   48.479  2114.90   48.479  2114.90   48.479  320.127   3.6728  320.127   3.6728 0.000000 0.000000 
1 1 1    0    2    5 o  197.810   2.0344  807.595   23.462  807.595   23.462  807.595   23.462  197.810   2.8771  197.810   2.8771 0.000000 0.000000 
1 1 1    0    2    6 o  232.399   2.1968  1114.55   29.766  1114.55   29.766  1114.55   29.766  232.399   3.1067  232.399   3.1067 0.000000 0.000000 
1 1 1    0    2    7 f  159.656   1.9780  526.188   18.407  526.188   18.407  526.188   18.407  159.656   2.7973  159.656   2.7973 0.000000 0.000000 
1 1 1    0    2    8 o  244.690   2.6385  1235.82   37.639  1235.82   37.639  1235.82   37.639  244.690   3.7314  244.690   3.7314 0.000000 0.000000 
1 1 1    0    2    9 o  342.392   3.1982  2419.85   63.847  2419.85   63.847  2419.85   63.847  342.392   4.5230  342.392   4.5230 0.000000 0.000000 
1 1 1    0    2   10 o   87.020   2.2181  156.813   11.225  156.813   11.225  156.813   11.225   87.020   3.1368   87.020   3.1368 0.000000 0.000000 
1 1 1    0    2   11 o  192.734   2.1538  766.829   24.199  766.829   24.199  766.829   24.199  192.734   3.0459  192.734   3.0459 0.000000 0.000000 
1 1 1    0    2   12 o  217.671   2.2603  978.006   28.684  978.006   28.684  978.006   28.684  217.671   3.1966  217.671   3.1966 0.000000 0.000000 
1 1 1    0    2   13 o  405.871   3.6318  3401.05   85.947  3401.05   85.947  3401.05   85.947  405.871   5.1361  405.871   5.1361 0.000000 0.000000 
1 1 1    0    2   14 o   57.833   3.5856   70.587   11.881   70.587   11.881   70.587   11.881   57.833   5.0708   57.833   5.0708 0.000000 0.000000 
1 1 1    0    2   15 o  460.754   3.4746  4380.99   93.356  4380.99   93.356  4380.99   93.356  460.754   4.9138  460.754   4.9138 0.000000 0.000000 
1 1 1    0    2   16 o   96.155   3.2189  191.999   17.961  191.999   17.961  191.999   17.961   96.155   4.5522   96.155   4.5522 0.000000 0.000000 
1 1 1    0    2   17 o  290.479   2.7083  1741.34   45.869  1741.34   45.869  1741.34   45.869  290.479   3.8301  290.479   3.8301 0.000000 0.000000 
1 1 1    0    2   18 o  171.605   2.9329  608.497   29.318  608.497   29.318  608.497   29.318  171.605   4.1478  171.605   4.1478 0.000000 0.000000 
1 1 1    0    2   19 o  431.310   3.9019  3840.05   98.127  3840.05   98.127  3840.05   98.127  431.310   5.5181  431.310   5.5181 0.000000 0.000000 
1 1 1    0    2   20 o   80.699   4.1134  136.456   19.131  136.456   19.131  136.456   19.131   80.699   5.8173   80.699   5.8173 0.000000 0.000000 
1 1 1    0    2   21 o   12.118   6.1171 -29.1440   19.409 -29.1440   19.409 -29.1440   19.409   12.118   8.6509   12.118   8.6509 0.000000 0.000000 
1 1 1    0    2   22 o  283.856   2.7633  1663.18   45.732  1663.18   45.732  1663.18   45.732  283.856   3.9079  283.856   3.9079 0.000000 0.000000 
1 1 1    0    2   23 o  318.441   2.9000  2093.25   53.846  2093.25   53.846  2093.25   53.846  318.441   4.1013  318.441   4.1013 0.000000 0.000000 
1 1 1    0    2   24 o  121.580   3.3877  306.471   23.939  306.471   23.939  306.471   23.939  121.580   4.7909  121.580   4.7909 0.000000 0.000000 
1 1 1    0    2   25 o   20.283   8.8272   6.6209   20.308   6.6209   20.308   6.6209   20.308   20.283   12.483   20.283   12.483 0.000000 0.000000 
1 1 1    0    2   26 f  303.146   2.9427  1897.71   52.011  1897.71   52.011  1897.71   52.011  303.146   4.1617  303.146   4.1617 0.000000 0.000000 
1 1 1    0    2   27 o   73.458   5.9322  115.969   24.561  115.969   24.561  115.969   24.561   73.458   8.3894   73.458   8.3894 0.000000 0.000000 
1 1 1    0    2   28 o  160.494   3.4936  533.414   32.635  533.414   32.635  533.414   32.635  160.494   4.9407  160.494   4.9407 0.000000 0.000000 
1 1 1    0    2   29 o   15.915   7.6111 -10.0177   20.786 -10.0177   20.786 -10.0177   20.786   15.915   10.764   15.915   10.764 0.000000 0.000000 
1 1 1    0    2   30 o  364.509   4.6766  2750.96   99.357  2750.96   99.357  2750.96   99.357  364.509   6.6137  364.509   6.6137 0.000000 0.000000 
1 1 1    0    2   31 o  252.591   4.1474  1321.28   61.031  1321.28   61.031  1321.28   61.031  252.591   5.8653  252.591   5.8653 0.000000 0.000000 
1 1 1    0    2   32 o   77.789   5.8824  129.675   25.920  129.675   25.920  129.675   25.920   77.789   8.3189   77.789   8.3189 0.000000 0.000000 
1 1 1    0    2   33 o   86.390   5.1097  157.779   25.333  157.779   25.333  157.779   25.333   86.390   7.2262   86.390   7.2262 0.000000 0.000000 
1 1 1    0    2   34 o   28.823   10.662   25.451   23.550   25.451   23.550   25.451   23.550   28.823   15.079   28.823   15.079 0.000000 0.000000 
1 1 1    0    2   35 o   16.770   8.1218 -16.1074   25.302 -16.1074   25.302 -16.1074   25.302   16.770   11.486   16.770   11.486 0.000000 0.000000 
1 1 1    0    2   36 o  110.486   4.5265  255.625   28.947  255.625   28.947  255.625   28.947  110.486   6.4014  110.486   6.4014 0.000000 0.000000 
1 1 1    0    2   37 o  157.186   3.6968  513.337   33.809  513.337   33.809  513.337   33.809  157.186   5.2281  157.186   5.2281 0.000000 0.000000 
1 1 1    0    2   38 o  147.200   4.5561  453.272   38.948  453.272   38.948  453.272   38.948  147.200   6.4433  147.200   6.4433 0.000000 0.000000 
1 1 1    0    2   39 o   25.334   10.937   14.109   30.614   14.109   30.614   14.109   30.614   25.334   15.467   25.334   15.467 0.000000 0.000000 
1 1 1    0    2   40 o   49.108   9.7333   62.193   24.129   62.193   24.129   62.193   24.129   49.108   13.765   49.108   13.765 0.000000 0.000000 
1 1 1    0    2   41 o   62.643   7.2977   89.937   24.489   89.937   24.489   89.937   24.489   62.643   10.321   62.643   10.321 0.000000 0.000000 
1 1 1    0    2   42 o   74.288   6.0836  121.601   25.440  121.601   25.440  121.601   25.440   74.288   8.6036   74.288   8.6036 0.000000 0.000000 
1 1 1    0    2   43 o   15.034   7.4374 -21.8843   24.265 -21.8843   24.265 -21.8843   24.265   15.034   10.518   15.034   10.518 0.000000 0.000000 
1 1 1    0    2   44 o   13.518   6.8891 -44.8428   27.238 -44.8428   27.238 -44.8428   27.238   13.518   9.7427   13.518   9.7427 0.000000 0.000000 
1 1 1    0    2   45 o   20.672   9.6110   0.5366   29.340   0.5366   29.340   0.5366   29.340   20.672   13.592   20.672   13.592 0.000000 0.000000 
1 1 1    0    2   46 o   29.374   12.249   30.438   35.870   30.438   35.870   30.438   35.870   29.374   17.323   29.374   17.323 0.000000 0.000000 
1 1 1    0    2   47 f   41.226   10.559   51.647   23.309   51.647   23.309   51.647   23.309   41.226   14.932   41.226   14.932 0.000000 0.000000 
1 1 1    0    2   48 o   20.190   8.9222   9.9298   21.546   9.9298   21.546   9.9298   21.546   20.190   12.618   20.190   12.618 0.000000 0.000000 
1 1 1    0    2   49 o   16.281   7.9106 -10.4059   24.441 -10.4059   24.441 -10.4059   24.441   16.281   11.187   16.281   11.187 0.000000 0.000000 
1 1 1    0    2   50 o   33.573   11.923   45.873   28.694   45.873   28.694   45.873   28.694   33.573   16.861   33.573   16.861 0.000000 0.000000 
1 1 1    0    2   51 o   28.477   12.498   38.335   41.548   38.335   41.548   38.335   41.548   28.477   17.674   28.477   17.674 0.000000 0.000000 
1 1 1    0    3    1 o  315.035   5.1216  2052.56   94.000  2052.56   94.000  2052.56   94.000  315.035   7.2431  315.035   7.2431 0.000000 0.000000 
1 1 1    0    3    2 o  636.351   4.4571  8361.08  165.398  8361.08  165.398  8361.08  165.398  636.351   6.3032  636.351   6.3032 0.000000 0.000000 
1 1 1    0    3    3 o  458.689   3.8967  4343.88  104.221  4343.88  104.221  4343.88  104.221  458.689   5.5108  458.689   5.5108 0.000000 0.000000 
1 1 1    0    3    4 o  410.942   3.1017  3485.41   74.327  3485.41   74.327  3485.41   74.327  410.942   4.3864  410.942   4.3864 0.000000 0.000000 
1 1 1    0    3    5 o  201.519   2.0533  838.113   24.124  838.113   24.124  838.113   24.124  201.519   2.9038  201.519   2.9038 0.000000 0.000000 
1 1 1    0    3    6 o  507.942   3.6806  5323.99  109.022  5323.99  109.022  5323.99  109.022  507.942   5.2052  507.942   5.2052 0.000000 0.000000 
1 1 1    0    3    7 o  426.178   3.7082  3748.47   92.148  3748.47   92.148  3748.47   92.148  426.178   5.2442  426.178   5.2442 0.000000 0.000000 
1 1 1    0    3    8 o  279.872   2.4463  1616.37   39.921  1616.37   39.921  1616.37   39.921  279.872   3.4596  279.872   3.4596 0.000000 0.000000 
1 1 1    0    3    9 o   68.417   2.7453   97.494   10.875   97.494   10.875   97.494   10.875   68.417   3.8825   68.417   3.8825 0.000000 0.000000 
1 1 1    0    3   10 o  115.470   2.0539  275.552   13.814  275.552   13.814  275.552   13.814  115.470   2.9047  115.470   2.9047 0.000000 0.000000 
1 1 1    0    3   11 o  580.148   4.7822  6953.02  161.775  6953.02  161.775  6953.02  161.775  580.148   6.7630  580.148   6.7630 0.000000 0.000000 
1 1 1    0    3   12 o  204.227   2.2163  860.969   26.387  860.969   26.387  860.969   26.387  204.227   3.1343  204.227   3.1343 0.000000 0.000000 
1 1 1    0    3   13 o  622.188   5.0943  7996.59  184.821  7996.59  184.821  7996.59  184.821  622.188   7.2044  622.188   7.2044 0.000000 0.000000 
1 1 1    0    3   14 o   39.693   5.6454   36.198   11.587   36.198   11.587   36.198   11.587   39.693   7.9838   39.693   7.9838 0.000000 0.000000 
1 1 1    0    3   15 o  197.936   2.3632  808.758   27.267  808.758   27.267  808.758   27.267  197.936   3.3421  197.936   3.3421 0.000000 0.000000 
1 1 1    0    3   16 o   42.761   6.9397   43.193   15.073   43.193   15.073   43.193   15.073   42.761   9.8143   42.761   9.8143 0.000000 0.000000 
1 1 1    0    3   17 o  255.379   2.9918  1346.39   44.537  1346.39   44.537  1346.39   44.537  255.379   4.2310  255.379   4.2310 0.000000 0.000000 
1 1 1    0    3   18 o  220.021   2.9224  999.606   37.475  999.606   37.475  999.606   37.475  220.021   4.1329  220.021   4.1329 0.000000 0.000000 
1 1 1    0    3   19 o  389.644   3.6597  3133.89   83.141  3133.89   83.141  3133.89   83.141  389.644   5.1755  389.644   5.1755 0.000000 0.000000 
1 1 1    0    3   20 o   78.549   4.0510  129.330   18.333  129.330   18.333  129.330   18.333   78.549   5.7290   78.549   5.7290 0.000000 0.000000 
1 1 1    0    3   21 o   68.549   5.3683  100.533   20.792  100.533   20.792  100.533   20.792   68.549   7.5919   68.549   7.5919 0.000000 0.000000 
1 1 1    0    3   22 o  220.671   2.6514  1005.44   34.105  1005.44   34.105  1005.44   34.105  220.671   3.7496  220.671   3.7496 0.000000 0.000000 
1 1 1    0    3   23 o   25.146   10.215   16.544   23.901   16.544   23.901   16.544   23.901   25.146   14.446   25.146   14.446 0.000000 0.000000 
1 1 1    0    3   24 o  253.670   2.8133  1328.68   41.602  1328.68   41.602  1328.68   41.602  253.670   3.9785  253.670   3.9785 0.000000 0.000000 
1 1 1    0    3   25 o  161.393   2.9774  538.630   27.985  538.630   27.985  538.630   27.985  161.393   4.2106  161.393   4.2106 0.000000 0.000000 
1 1 1    0    3   26 o  428.659   3.4518  3795.15   86.279  3795.15   86.279  3795.15   86.279  428.659   4.8815  428.659   4.8815 0.000000 0.000000 
1 1 1    0    3   27 o  153.447   3.7428  488.043   33.409  488.043   33.409  488.043   33.409  153.447   5.2931  153.447   5.2931 0.000000 0.000000 
1 1 1    0    3   28 o  116.182   4.0570  280.901   27.340  280.901   27.340  280.901   27.340  116.182   5.7374  116.182   5.7374 0.000000 0.000000 
1 1 1    0    3   29 o   81.956   5.3364  142.508   25.013  142.508   25.013  142.508   25.013   81.956   7.5467   81.956   7.5467 0.000000 0.000000 
1 1 1    0    3   30 o  128.587   4.2430  344.058   31.665  344.058   31.665  344.058   31.665  128.587   6.0004  128.587   6.0004 0.000000 0.000000 
1 1 1    0    3   31 o   54.915   7.8599   69.762   22.295   69.762   22.295   69.762   22.295   54.915   11.116   54.915   11.116 0.000000 0.000000 
1 1 1    0    3   32 o  127.781   4.4113  340.174   32.700  340.174   32.700  340.174   32.700  127.781   6.2386  127.781   6.2386 0.000000 0.000000 
1 1 1    0    3   33 o   15.461   7.5246 -16.0856   22.333 -16.0856   22.333 -16.0856   22.333   15.461   10.641   15.461   10.641 0.000000 0.000000 
1 1 1    0    3   34 o   32.109   10.905   31.861   23.589   31.861   23.589   31.861   23.589   32.109   15.422   32.109   15.422 0.000000 0.000000 
1 1 1    0    3   35 f   96.328   5.1473  195.736   28.541  195.736   28.541  195.736   28.541   96.328   7.2794   96.328   7.2794 0.000000 0.000000 
1 1 1    0    3   36 o  108.778   4.5624  247.953   28.714  247.953   28.714  247.953   28.714  108.778   6.4522  108.778   6.4522 0.000000 0.000000 
1 1 1    0    3   37 o   39.009   11.831   46.120   27.548   46.120   27.548   46.120   27.548   39.009   16.732   39.009   16.732 0.000000 0.000000 
1 1 1    0    3   38 o   19.590   9.3411 -11.8645   30.886 -11.8645   30.886 -11.8645   30.886   19.590   13.210   19.590   13.210 0.000000 0.000000 
1 1 1    0    3   39 o   18.189   8.5575  -5.6690   24.400  -5.6690   24.400  -5.6690   24.400   18.189   12.102   18.189   12.102 0.000000 0.000000 
1 1 1    0    3   40 o   26.235   10.439   20.913   24.268   20.913   24.268   20.913   24.268   26.235   14.763   26.235   14.763 0.000000 0.000000 
1 1 1    0    3   41 o   67.509   6.9017  102.725   25.525  102.725   25.525  102.725   25.525   67.509   9.7604   67.509   9.7604 0.000000 0.000000 
1 1 1    0    3   42 o   12.898   6.5781 -42.9667   25.041 -42.9667   25.041 -42.9667   25.041   12.898   9.3028   12.898   9.3028 0.000000 0.000000 
1 1 1    0    3   43 o   18.314   8.5351  -2.1073   23.357  -2.1073   23.357  -2.1073   23.357   18.314   12.070   18.314   12.070 0.000000 0.000000 
1 1 1    0    3   44 o   20.999   9.5658   4.3629   27.044   4.3629   27.044   4.3629   27.044   20.999   13.528   20.999   13.528 0.000000 0.000000 
1 1 1    0    3   45 o   19.741   9.1024   1.7795   25.526   1.7795   25.526   1.7795   25.526   19.741   12.873   19.741   12.873 0.000000 0.000000 
1 1 1    0    3   46 o   41.788   11.188   54.170   25.584   54.170   25.584   54.170   25.584   41.788   15.823   41.788   15.823 0.000000 0.000000 
1 1 1    0    3   47 o   65.101   6.9927   99.044   24.737   99.044   24.737   99.044   24.737   65.101   9.8892   65.101   9.8892 0.000000 0.000000 
1 1 1    0    3   48 o   21.230   9.6410   8.8994   27.207   8.8994   27.207   8.8994   27.207   21.230   13.634   21.230   13.634 0.000000 0.000000 
1 1 1    0    3   49 f   27.840   10.722   29.734   24.657   29.734   24.657   29.734   24.657   27.840   15.163   27.840   15.163 0.000000 0.000000 
1 1 1    0    3   50 o   37.735   11.959   53.754   28.068   53.754   28.068   53.754   28.068   37.735   16.912   37.735   16.912 0.000000 0.000000 
1 1 1    0    3   51 o   22.606   10.759   8.6375   40.615   8.6375   40.615   8.6375   40.615   22.606   15.216   22.606   15.216 0.000000 0.000000 
1 1 1    0    4    0 o  232.601   3.0204  1117.12   40.948  1117.12   40.948  1117.12   40.948  232.601   4.2715  232.601   4.2715 0.000000 0.000000 
1 1 1    0    4    1 o   14.767   5.2777   6.6070   5.6435   6.6070   5.6435   6.6070   5.6435   14.767   7.4638   14.767   7.4638 0.000000 0.000000 
1 1 1    0    4    2 o  195.563   2.8268  790.004   32.214  790.004   32.214  790.004   32.214  195.563   3.9976  195.563   3.9976 0.000000 0.000000 
1 1 1    0    4    3 o  429.721   3.7043  3812.11   92.818  3812.11   92.818  3812.11   92.818  429.721   5.2387  429.721   5.2387 0.000000 0.000000 
1 1 1    0    4    4 o  273.938   2.3650  1548.50   37.776  1548.50   37.776  1548.50   37.776  273.938   3.3446  273.938   3.3446 0.000000 0.000000 
1 1 1    0    4    5 o   82.776   1.8629  141.740   8.9737  141.740   8.9737  141.740   8.9737   82.776   2.6345   82.776   2.6345 0.000000 0.000000 
1 1 1    0    4    6 f  303.904   2.5389  1905.69   44.992  1905.69   44.992  1905.69   44.992  303.904   3.5906  303.904   3.5906 0.000000 0.000000 
1 1 1    0    4    7 o  113.670   2.7370  267.444   18.099  267.444   18.099  267.444   18.099  113.670   3.8707  113.670   3.8707 0.000000 0.000000 
1 1 1    0    4    8 o  459.706   3.4112  4361.63   91.444  4361.63   91.444  4361.63   91.444  459.706   4.8241  459.706   4.8241 0.000000 0.000000 
1 1 1    0    4    9 o   93.139   2.1188  179.493   11.484  179.493   11.484  179.493   11.484   93.139   2.9965   93.139   2.9965 0.000000 0.000000 
1 1 1    0    4   10 o  468.831   4.0170  4539.12  109.813  4539.12  109.813  4539.12  109.813  468.831   5.6809  468.831   5.6809 0.000000 0.000000 
1 1 1    0    4   11 o  312.952   3.0428  2021.94   55.519  2021.94   55.519  2021.94   55.519  312.952   4.3031  312.952   4.3031 0.000000 0.000000 
1 1 1    0    4   12 o  436.475   3.3074  3932.37   84.182  3932.37   84.182  3932.37   84.182  436.475   4.6774  436.475   4.6774 0.000000 0.000000 
1 1 1    0    4   13 o  234.121   2.3532  1131.33   32.120  1131.33   32.120  1131.33   32.120  234.121   3.3279  234.121   3.3279 0.000000 0.000000 
1 1 1    0    4   14 o   85.423   2.8399  151.519   14.079  151.519   14.079  151.519   14.079   85.423   4.0163   85.423   4.0163 0.000000 0.000000 
1 1 1    0    4   15 o  122.437   2.5389  309.988   18.096  309.988   18.096  309.988   18.096  122.437   3.5905  122.437   3.5905 0.000000 0.000000 
1 1 1    0    4   16 o  294.279   2.6898  1787.15   46.152  1787.15   46.152  1787.15   46.152  294.279   3.8039  294.279   3.8039 0.000000 0.000000 
1 1 1    0    4   17 o  676.638   5.5116  9453.10  217.462  9453.10  217.462  9453.10  217.462  676.638   7.7945  676.638   7.7945 0.000000 0.000000 
1 1 1    0    4   18 o  469.553   3.5652  4550.13   97.619  4550.13   97.619  4550.13   97.619  469.553   5.0419  469.553   5.0419 0.000000 0.000000 
1 1 1    0    4   19 o  319.252   2.8585  2103.42   53.210  2103.42   53.210  2103.42   53.210  319.252   4.0425  319.252   4.0425 0.000000 0.000000 
1 1 1    0    4   20 o  448.573   3.4697  4152.87   90.758  4152.87   90.758  4152.87   90.758  448.573   4.9068  448.573   4.9068 0.000000 0.000000 
1 1 1    0    4   21 o   58.834   5.5292   75.168   18.038   75.168   18.038   75.168   18.038   58.834   7.8194   58.834   7.8194 0.000000 0.000000 
1 1 1    0    4   22 o   64.432   5.1779   88.992   18.811   88.992   18.811   88.992   18.811   64.432   7.3226   64.432   7.3226 0.000000 0.000000 
1 1 1    0    4   23 o  106.780   4.3524  237.740   26.902  237.740   26.902  237.740   26.902  106.780   6.1552  106.780   6.1552 0.000000 0.000000 
1 1 1    0    4   24 o  238.178   3.1333  1171.87   43.496  1171.87   43.496  1171.87   43.496  238.178   4.4312  238.178   4.4312 0.000000 0.000000 
1 1 1    0    4   25 o  260.785   3.1879  1404.91   48.460  1404.91   48.460  1404.91   48.460  260.785   4.5084  260.785   4.5084 0.000000 0.000000 
1 1 1    0    4   26 o  205.542   3.2075  873.421   38.412  873.421   38.412  873.421   38.412  205.542   4.5361  205.542   4.5361 0.000000 0.000000 
1 1 1    0    4   27 o  193.927   2.8897  777.290   32.653  777.290   32.653  777.290   32.653  193.927   4.0866  193.927   4.0866 0.000000 0.000000 
1 1 1    0    4   28 o  190.119   2.9412  747.205   32.581  747.205   32.581  747.205   32.581  190.119   4.1595  190.119   4.1595 0.000000 0.000000 
1 1 1    0    4   29 o   86.893   5.1545  159.497   25.702  159.497   25.702  159.497   25.702   86.893   7.2895   86.893   7.2895 0.000000 0.000000 
1 1 1    0    4   30 o   21.925   9.2512   10.739   20.890   10.739   20.890   10.739   20.890   21.925   13.083   21.925   13.083 0.000000 0.000000 
1 1 1    0    4   31 o   26.927   10.172   21.801   21.796   21.801   21.796   21.801   21.796   26.927   14.386   26.927   14.386 0.000000 0.000000 
1 1 1    0    4   32 o  132.202   4.3327  363.833   33.246  363.833   33.246  363.833   33.246  132.202   6.1273  132.202   6.1273 0.000000 0.000000 
1 1 1    0    4   33 o   21.661   9.4114   8.0765   22.999   8.0765   22.999   8.0765   22.999   21.661   13.310   21.661   13.310 0.000000 0.000000 
1 1 1    0    4   34 o   80.098   5.5458  136.820   25.340  136.820   25.340  136.820   25.340   80.098   7.8429   80.098   7.8429 0.000000 0.000000 
1 1 1    0    4   35 o  117.682   4.2893  289.082   29.264  289.082   29.264  289.082   29.264  117.682   6.0660  117.682   6.0660 0.000000 0.000000 
1 1 1    0    4   36 o   34.265   11.277   36.438   25.040   36.438   25.040   36.438   25.040   34.265   15.948   34.265   15.948 0.000000 0.000000 
1 1 1    0    4   37 o   92.716   5.7660  183.223   30.628  183.223   30.628  183.223   30.628   92.716   8.1544   92.716   8.1544 0.000000 0.000000 
1 1 1    0    4   38 o   14.511   7.2379 -27.7352   24.443 -27.7352   24.443 -27.7352   24.443   14.511   10.236   14.511   10.236 0.000000 0.000000 
1 1 1    0    4   39 o   19.931   9.1031   1.2517   24.711   1.2517   24.711   1.2517   24.711   19.931   12.874   19.931   12.874 0.000000 0.000000 
1 1 1    0    4   40 o   15.501   7.8136 -42.2753   31.232 -42.2753   31.232 -42.2753   31.232   15.501   11.050   15.501   11.050 0.000000 0.000000 
1 1 1    0    4   41 o   28.476   10.798   26.713   24.648   26.713   24.648   26.713   24.648   28.476   15.271   28.476   15.271 0.000000 0.000000 
1 1 1    0    4   42 o   31.832   11.381   34.203   26.250   34.203   26.250   34.203   26.250   31.832   16.096   31.832   16.096 0.000000 0.000000 
1 1 1    0    4   43 o   14.825   7.2942 -18.0583   22.472 -18.0583   22.472 -18.0583   22.472   14.825   10.316   14.825   10.316 0.000000 0.000000 
1 1 1    0    4   44 o   33.475   11.464   38.267   26.124   38.267   26.124   38.267   26.124   33.475   16.213   33.475   16.213 0.000000 0.000000 
1 1 1    0    4   45 o   31.520   11.007   34.388   24.277   34.388   24.277   34.388   24.277   31.520   15.567   31.520   15.567 0.000000 0.000000 
1 1 1    0    4   46 o   15.370   7.5005 -13.3804   22.549 -13.3804   22.549 -13.3804   22.549   15.370   10.607   15.370   10.607 0.000000 0.000000 
1 1 1    0    4   47 o   25.600   10.166   23.040   22.951   23.040   22.951   23.040   22.951   25.600   14.376   25.600   14.376 0.000000 0.000000 
1 1 1    0    4   48 f   27.655   10.755   29.053   25.071   29.053   25.071   29.053   25.071   27.655   15.209   27.655   15.209 0.000000 0.000000 
1 1 1    0    4   49 o   29.390   10.812   33.049   24.115   33.049   24.115   33.049   24.115   29.390   15.291   29.390   15.291 0.000000 0.000000 
1 1 1    0    4   50 o   17.116   8.6023 -31.4051   36.837 -31.4051   36.837 -31.4051   36.837   17.116   12.166   17.116   12.166 0.000000 0.000000 
1 1 1    0    4   51 o   19.237   9.4436 -10.2173   37.102 -10.2173   37.102 -10.2173   37.102   19.237   13.355   19.237   13.355 0.000000 0.000000 
1 1 1    0    5    1 o  417.992   4.4328  3607.92  108.021  3607.92  108.021  3607.92  108.021  417.992   6.2690  417.992   6.2690 0.000000 0.000000 
1 1 1    0    5    2 o  197.652   2.8510  806.835   32.838  806.835   32.838  806.835   32.838  197.652   4.0320  197.652   4.0320 0.000000 0.000000 
1 1 1    0    5    3 f  123.340   1.7652  314.133   12.687  314.133   12.687  314.133   12.687  123.340   2.4963  123.340   2.4963 0.000000 0.000000 
1 1 1    0    5    4 o  625.076   5.0670  8065.25  184.688  8065.25  184.688  8065.25  184.688  625.076   7.1659  625.076   7.1659 0.000000 0.000000 
1 1 1    0    5    5 o   78.439   1.8890  127.335   8.6199  127.335   8.6199  127.335   8.6199   78.439   2.6714   78.439   2.6714 0.000000 0.000000 
1 1 1    0    5    6 o  376.259   2.9249  2921.34   64.174  2921.34   64.174  2921.34   64.174  376.259   4.1364  376.259   4.1364 0.000000 0.000000 
1 1 1    0    5    7 o  222.001   2.5086  1017.40   32.466  1017.40   32.466  1017.40   32.466  222.001   3.5478  222.001   3.5478 0.000000 0.000000 
1 1 1    0    5    8 o  279.986   2.4451  1617.86   39.917  1617.86   39.917  1617.86   39.917  279.986   3.4579  279.986   3.4579 0.000000 0.000000 
1 1 1    0    5    9 o  224.207   2.2169  1037.56   28.978  1037.56   28.978  1037.56   28.978  224.207   3.1351  224.207   3.1351 0.000000 0.000000 
1 1 1    0    5   10 o   94.561   2.5542  185.275   14.041  185.275   14.041  185.275   14.041   94.561   3.6121   94.561   3.6121 0.000000 0.000000 
1 1 1    0    5   11 o   77.550   2.5187  124.848   11.338  124.848   11.338  124.848   11.338   77.550   3.5620   77.550   3.5620 0.000000 0.000000 
1 1 1    0    5   12 o   89.538   2.4699  166.133   12.855  166.133   12.855  166.133   12.855   89.538   3.4930   89.538   3.4930 0.000000 0.000000 
1 1 1    0    5   13 o  256.047   2.4348  1353.04   36.348  1353.04   36.348  1353.04   36.348  256.047   3.4433  256.047   3.4433 0.000000 0.000000 
1 1 1    0    5   14 o   71.559   3.9076  107.522   16.086  107.522   16.086  107.522   16.086   71.559   5.5262   71.559   5.5262 0.000000 0.000000 
1 1 1    0    5   15 o  102.717   2.7519  218.558   16.434  218.558   16.434  218.558   16.434  102.717   3.8918  102.717   3.8918 0.000000 0.000000 
1 1 1    0    5   16 o  387.227   3.1097  3094.24   70.215  3094.24   70.215  3094.24   70.215  387.227   4.3977  387.227   4.3977 0.000000 0.000000 
1 1 1    0    5   17 o   61.360   4.9478   80.676   17.113   80.676   17.113   80.676   17.113   61.360   6.9973   61.360   6.9973 0.000000 0.000000 
1 1 1    0    5   18 f  481.723   3.6313  4789.15  102.008  4789.15  102.008  4789.15  102.008  481.723   5.1355  481.723   5.1355 0.000000 0.000000 
1 1 1    0    5   19 o  280.607   3.1537  1625.56   51.588  1625.56   51.588  1625.56   51.588  280.607   4.4600  280.607   4.4600 0.000000 0.000000 
1 1 1    0    5   20 o  217.373   3.6960  976.628   46.801  976.628   46.801  976.628   46.801  217.373   5.2270  217.373   5.2270 0.000000 0.000000 
1 1 1    0    5   21 o   20.508   8.6207   9.3718   18.018   9.3718   18.018   9.3718   18.018   20.508   12.192   20.508   12.192 0.000000 0.000000 
1 1 1    0    5   22 o  142.551   2.9158  420.303   24.199  420.303   24.199  420.303   24.199  142.551   4.1236  142.551   4.1236 0.000000 0.000000 
1 1 1    0    5   23 o   48.241   8.1755   55.649   19.954   55.649   19.954   55.649   19.954   48.241   11.562   48.241   11.562 0.000000 0.000000 
1 1 1    0    5   24 o   47.035   8.7162   54.219   20.662   54.219   20.662   54.219   20.662   47.035   12.327   47.035   12.327 0.000000 0.000000 
1 1 1    0    5   25 o  252.053   2.7889  1311.96   40.980  1311.96   40.980  1311.96   40.980  252.053   3.9441  252.053   3.9441 0.000000 0.000000 
1 1 1    0    5   26 o   84.216   5.1399  149.904   24.815  149.904   24.815  149.904   24.815   84.216   7.2689   84.216   7.2689 0.000000 0.000000 
1 1 1    0    5   27 o  265.867   2.8434  1459.98   44.071  1459.98   44.071  1459.98   44.071  265.867   4.0211  265.867   4.0211 0.000000 0.000000 
1 1 1    0    5   28 o   63.004   6.0217   86.560   20.991   86.560   20.991   86.560   20.991   63.004   8.5159   63.004   8.5159 0.000000 0.000000 
1 1 1    0    5   29 o  216.675   3.9805  972.151   50.230  972.151   50.230  972.151   50.230  216.675   5.6292  216.675   5.6292 0.000000 0.000000 
1 1 1    0    5   30 f   38.420   10.133   41.325   21.145   41.325   21.145   41.325   21.145   38.420   14.330   38.420   14.330 0.000000 0.000000 
1 1 1    0    5   31 o  236.853   2.9590  1159.55   40.850  1159.55   40.850  1159.55   40.850  236.853   4.1846  236.853   4.1846 0.000000 0.000000 
1 1 1    0    5   32 o   79.653   6.7916  137.360   30.338  137.360   30.338  137.360   30.338   79.653   9.6048   79.653   9.6048 0.000000 0.000000 
1 1 1    0    5   33 o   55.942   8.1061   72.695   23.379   72.695   23.379   72.695   23.379   55.942   11.464   55.942   11.464 0.000000 0.000000 
1 1 1    0    5   34 o  145.182   3.8426  437.763   32.436  437.763   32.436  437.763   32.436  145.182   5.4342  145.182   5.4342 0.000000 0.000000 
1 1 1    0    5   35 o   16.211   7.8142 -12.9882   22.816 -12.9882   22.816 -12.9882   22.816   16.211   11.051   16.211   11.051 0.000000 0.000000 
1 1 1    0    5   36 o   21.819   9.5892   7.2673   24.548   7.2673   24.548   7.2673   24.548   21.819   13.561   21.819   13.561 0.000000 0.000000 
1 1 1    0    5   37 o   24.528   11.036   5.6626   34.646   5.6626   34.646   5.6626   34.646   24.528   15.607   24.528   15.607 0.000000 0.000000 
1 1 1    0    5   38 o   70.329   6.4889  108.856   25.365  108.856   25.365  108.856   25.365   70.329   9.1767   70.329   9.1767 0.000000 0.000000 
1 1 1    0    5   39 o   16.309   7.9006 -14.1810   23.972 -14.1810   23.972 -14.1810   23.972   16.309   11.173   16.309   11.173 0.000000 0.000000 
1 1 1    0    5   40 o   28.325   11.520   24.028   30.456   24.028   30.456   24.028   30.456   28.325   16.291   28.325   16.291 0.000000 0.000000 
1 1 1    0    5   41 o   60.898   7.7914   86.635   24.986   86.635   24.986   86.635   24.986   60.898   11.019   60.898   11.019 0.000000 0.000000 
1 1 1    0    5   42 o   77.236   5.8996  130.719   25.793  130.719   25.793  130.719   25.793   77.236   8.3433   77.236   8.3433 0.000000 0.000000 
1 1 1    0    5   43 o   48.519   9.7493   62.180   23.904   62.180   23.904   62.180   23.904   48.519   13.788   48.519   13.788 0.000000 0.000000 
1 1 1    0    5   44 o   13.685   7.0069 -53.9785   29.819 -53.9785   29.819 -53.9785   29.819   13.685   9.9092   13.685   9.9092 0.000000 0.000000 
1 1 1    0    5   45 o   26.729   10.512   24.267   24.256   24.267   24.256   24.267   24.256   26.729   14.866   26.729   14.866 0.000000 0.000000 
1 1 1    0    5   46 o   15.715   7.6171 -10.8664   22.352 -10.8664   22.352 -10.8664   22.352   15.715   10.772   15.715   10.772 0.000000 0.000000 
1 1 1    0    5   47 o   33.736   11.942   42.566   28.733   42.566   28.733   42.566   28.733   33.736   16.889   33.736   16.889 0.000000 0.000000 
1 1 1    0    5   48 o   45.446   10.846   62.640   25.713   62.640   25.713   62.640   25.713   45.446   15.339   45.446   15.339 0.000000 0.000000 
1 1 1    0    5   49 o   41.900   11.182   57.175   25.599   57.175   25.599   57.175   25.599   41.900   15.814   41.900   15.814 0.000000 0.000000 
1 1 1    0    5   50 o   17.123   8.4482 -16.2764   30.715 -16.2764   30.715 -16.2764   30.715   17.123   11.947   17.123   11.947 0.000000 0.000000 
1 1 1    0    5   51 o   14.516   7.4620 -56.4528   35.695 -56.4528   35.695 -56.4528   35.695   14.516   10.553   14.516   10.553 0.000000 0.000000 
1 1 1    0    5   52 o   41.383   14.447   83.996   41.813   83.996   41.813   83.996   41.813   41.383   20.431   41.383   20.431 0.000000 0.000000 
1 1 1    0    6    0 o  251.907   4.4855  1311.41   65.813  1311.41   65.813  1311.41   65.813  251.907   6.3435  251.907   6.3435 0.000000 0.000000 
1 1 1    0    6    1 o   54.844   2.6567   62.908   8.4071   62.908   8.4071   62.908   8.4071   54.844   3.7571   54.844   3.7571 0.000000 0.000000 
1 1 1    0    6    2 o  633.205   6.2792  8280.65  231.812  8280.65  231.812  8280.65  231.812  633.205   8.8801  633.205   8.8801 0.000000 0.000000 
1 1 1    0    6    3 o  343.570   2.7268  2435.61   54.630  2435.61   54.630  2435.61   54.630  343.570   3.8563  343.570   3.8563 0.000000 0.000000 
1 1 1    0    6    4 o   17.956   4.9320   9.0967   4.9191   9.0967   4.9191   9.0967   4.9191   17.956   6.9748   17.956   6.9748 0.000000 0.000000 
1 1 1    0    6    5 o  218.998   2.1298  989.761   27.194  989.761   27.194  989.761   27.194  218.998   3.0120  218.998   3.0120 0.000000 0.000000 
1 1 1    0    6    6 o   70.794   2.3155  104.041   9.5150  104.041   9.5150  104.041   9.5150   70.794   3.2747   70.794   3.2747 0.000000 0.000000 
1 1 1    0    6    7 o   53.166   2.4803   59.068   7.6150   59.068   7.6150   59.068   7.6150   53.166   3.5077   53.166   3.5077 0.000000 0.000000 
1 1 1    0    6    8 o  363.629   2.8687  2729.12   60.829  2729.12   60.829  2729.12   60.829  363.629   4.0570  363.629   4.0570 0.000000 0.000000 
1 1 1    0    6    9 o  402.308   3.0921  3340.80   72.539  3340.80   72.539  3340.80   72.539  402.308   4.3728  402.308   4.3728 0.000000 0.000000 
1 1 1    0    6   10 o  384.435   4.2460  3053.06   95.157  3053.06   95.157  3053.06   95.157  384.435   6.0047  384.435   6.0047 0.000000 0.000000 
1 1 1    0    6   11 o  237.308   2.3187  1162.33   32.081  1162.33   32.081  1162.33   32.081  237.308   3.2791  237.308   3.2791 0.000000 0.000000 
1 1 1    0    6   12 o  167.780   2.1926  581.230   21.441  581.230   21.441  581.230   21.441  167.780   3.1009  167.780   3.1009 0.000000 0.000000 
1 1 1    0    6   13 o   65.377   3.3604   89.563   12.659   89.563   12.659   89.563   12.659   65.377   4.7523   65.377   4.7523 0.000000 0.000000 
1 1 1    0    6   14 o  155.028   2.7331  496.644   24.679  496.644   24.679  496.644   24.679  155.028   3.8652  155.028   3.8652 0.000000 0.000000 
1 1 1    0    6   15 o  340.052   3.3170  2386.77   65.763  2386.77   65.763  2386.77   65.763  340.052   4.6909  340.052   4.6909 0.000000 0.000000 
1 1 1    0    6   16 o  227.953   3.5141  1073.47   46.674  1073.47   46.674  1073.47   46.674  227.953   4.9697  227.953   4.9697 0.000000 0.000000 
1 1 1    0    6   17 o  131.237   3.0278  356.410   23.121  356.410   23.121  356.410   23.121  131.237   4.2820  131.237   4.2820 0.000000 0.000000 
1 1 1    0    6   18 o  112.882   2.8244  263.828   18.544  263.828   18.544  263.828   18.544  112.882   3.9943  112.882   3.9943 0.000000 0.000000 
1 1 1    0    6   19 o   47.149   6.4705   50.749   15.869   50.749   15.869   50.749   15.869   47.149   9.1507   47.149   9.1507 0.000000 0.000000 
1 1 1    0    6   20 o  562.080   5.8046  6528.95  190.214  6528.95  190.214  6528.95  190.214  562.080   8.2089  562.080   8.2089 0.000000 0.000000 
1 1 1    0    6   21 o  136.179   2.8544  383.596   22.628  383.596   22.628  383.596   22.628  136.179   4.0368  136.179   4.0368 0.000000 0.000000 
1 1 1    0    6   22 o  132.944   3.1040  365.876   24.010  365.876   24.010  365.876   24.010  132.944   4.3898  132.944   4.3898 0.000000 0.000000 
1 1 1    0    6   23 o  179.945   2.8223  669.078   29.590  669.078   29.590  669.078   29.590  179.945   3.9914  179.945   3.9914 0.000000 0.000000 
1 1 1    0    6   24 o  300.567   3.3651  1866.06   58.962  1866.06   58.962  1866.06   58.962  300.567   4.7590  300.567   4.7590 0.000000 0.000000 
1 1 1    0    6   25 o   21.816   9.1233   11.044   19.997   11.044   19.997   11.044   19.997   21.816   12.902   21.816   12.902 0.000000 0.000000 
1 1 1    0    6   26 o  153.341   3.0829  486.578   27.523  486.578   27.523  486.578   27.523  153.341   4.3599  153.341   4.3599 0.000000 0.000000 
1 1 1    0    6   27 o  138.133   3.2162  395.209   25.850  395.209   25.850  395.209   25.850  138.133   4.5485  138.133   4.5485 0.000000 0.000000 
1 1 1    0    6   28 o   37.259   9.9486   39.004   20.257   39.004   20.257   39.004   20.257   37.259   14.069   37.259   14.069 0.000000 0.000000 
1 1 1    0    6   29 o   54.668   10.549   74.558   29.080   74.558   29.080   74.558   29.080   54.668   14.919   54.668   14.919 0.000000 0.000000 
1 1 1    0    6   30 f   19.666   8.6924   4.8002   20.460   4.8002   20.460   4.8002   20.460   19.666   12.293   19.666   12.293 0.000000 0.000000 
1 1 1    0    6   31 o   42.630   9.7704   48.066   21.481   48.066   21.481   48.066   21.481   42.630   13.817   42.630   13.817 0.000000 0.000000 
1 1 1    0    6   32 o  128.941   3.6810  345.303   27.582  345.303   27.582  345.303   27.582  128.941   5.2057  128.941   5.2057 0.000000 0.000000 
1 1 1    0    6   33 o   22.162   9.5574   9.2711   23.324   9.2711   23.324   9.2711   23.324   22.162   13.516   22.162   13.516 0.000000 0.000000 
1 1 1    0    6   34 o   58.934   8.7156   81.226   26.399   81.226   26.399   81.226   26.399   58.934   12.326   58.934   12.326 0.000000 0.000000 
1 1 1    0    6   35 o   32.957   11.145   33.802   24.609   33.802   24.609   33.802   24.609   32.957   15.761   32.957   15.761 0.000000 0.000000 
1 1 1    0    6   36 o   22.212   9.6850   8.5719   24.548   8.5719   24.548   8.5719   24.548   22.212   13.697   22.212   13.697 0.000000 0.000000 
1 1 1    0    6   37 o   18.439   8.8943 -16.1189   29.671 -16.1189   29.671 -16.1189   29.671   18.439   12.578   18.439   12.578 0.000000 0.000000 
1 1 1    0    6   38 o   26.559   10.432   21.411   23.854   21.411   23.854   21.411   23.854   26.559   14.753   26.559   14.753 0.000000 0.000000 
1 1 1    0    6   39 o  102.551   4.6389  222.207   27.488  222.207   27.488  222.207   27.488  102.551   6.5604  102.551   6.5604 0.000000 0.000000 
1 1 1    0    6   40 o   33.254   12.319   36.836   31.467   36.836   31.467   36.836   31.467   33.254   17.421   33.254   17.421 0.000000 0.000000 
1 1 1    0    6   41 o   15.905   7.7469 -15.1950   23.784 -15.1950   23.784 -15.1950   23.784   15.905   10.956   15.905   10.956 0.000000 0.000000 
1 1 1    0    6   42 o  137.759   4.2530  399.598   34.026  399.598   34.026  399.598   34.026  137.759   6.0146  137.759   6.0146 0.000000 0.000000 
1 1 1    0    6   43 o   29.796   10.931   30.285   24.595   30.285   24.595   30.285   24.595   29.796   15.459   29.796   15.459 0.000000 0.000000 
1 1 1    0    6   44 o   29.651   11.584   30.469   29.235   30.469   29.235   30.469   29.235   29.651   16.382   29.651   16.382 0.000000 0.000000 
1 1 1    0    6   45 o   27.679   10.936   26.415   26.388   26.415   26.388   26.415   26.388   27.679   15.466   27.679   15.466 0.000000 0.000000 
1 1 1    0    6   46 o   14.621   7.2384 -19.3059   23.103 -19.3059   23.103 -19.3059   23.103   14.621   10.237   14.621   10.237 0.000000 0.000000 
1 1 1    0    6   47 o   27.655   11.091   28.253   27.687   28.253   27.687   28.253   27.687   27.655   15.686   27.655   15.686 0.000000 0.000000 
1 1 1    0    6   48 o   52.389   9.6001   74.252   25.352   74.252   25.352   74.252   25.352   52.389   13.577   52.389   13.577 0.000000 0.000000 
1 1 1    0    6   49 o   19.389   8.9577   4.8089   24.901   4.8089   24.901   4.8089   24.901   19.389   12.668   19.389   12.668 0.000000 0.000000 
1 1 1    0    6   50 o   20.078   9.4823   2.8924   30.460   2.8924   30.460   2.8924   30.460   20.078   13.410   20.078   13.410 0.000000 0.000000 
1 1 1    0    6   51 o   29.495   12.631   44.267   40.127   44.267   40.127   44.267   40.127   29.495   17.864   29.495   17.864 0.000000 0.000000 
1 1 1    0    7    1 o  225.544   2.4534  1050.00   32.259  1050.00   32.259  1050.00   32.259  225.544   3.4696  225.544   3.4696 0.000000 0.000000 
1 1 1    0    7    2 o  483.428   4.9914  4826.66  140.678  4826.66  140.678  4826.66  140.678  483.428   7.0589  483.428   7.0589 0.000000 0.000000 
1 1 1    0    7    3 o  497.768   5.1218  5117.98  148.635  5117.98  148.635  5117.98  148.635  497.768   7.2433  497.768   7.2433 0.000000 0.000000 
1 1 1    0    7    4 o   40.406   2.7253   34.590   6.2889   34.590   6.2889   34.590   6.2889   40.406   3.8542   40.406   3.8542 0.000000 0.000000 
1 1 1    0    7    5 o  136.027   1.8690  382.082   14.816  382.082   14.816  382.082   14.816  136.027   2.6431  136.027   2.6431 0.000000 0.000000 
1 1 1    0    7    6 o  144.786   2.1885  433.010   18.463  433.010   18.463  433.010   18.463  144.786   3.0950  144.786   3.0950 0.000000 0.000000 
1 1 1    0    7    7 o  230.927   2.2189  1100.66   29.876  1100.66   29.876  1100.66   29.876  230.927   3.1380  230.927   3.1380 0.000000 0.000000 
1 1 1    0    7    8 o  375.821   2.9381  2915.25   64.390  2915.25   64.390  2915.25   64.390  375.821   4.1552  375.821   4.1552 0.000000 0.000000 
1 1 1    0    7    9 o  559.225   4.0071  6456.97  130.677  6456.97  130.677  6456.97  130.677  559.225   5.6669  559.225   5.6669 0.000000 0.000000 
1 1 1    0    7   10 o  139.896   2.9872  404.884   24.325  404.884   24.325  404.884   24.325  139.896   4.2245  139.896   4.2245 0.000000 0.000000 
1 1 1    0    7   11 o   65.228   4.4454   90.236   16.553   90.236   16.553   90.236   16.553   65.228   6.2868   65.228   6.2868 0.000000 0.000000 
1 1 1    0    7   12 o  248.281   2.7871  1272.52   40.339  1272.52   40.339  1272.52   40.339  248.281   3.9415  248.281   3.9415 0.000000 0.000000 
1 1 1    0    7   13 o  517.670   4.3807  5531.44  132.231  5531.44  132.231  5531.44  132.231  517.670   6.1952  517.670   6.1952 0.000000 0.000000 
1 1 1    0    7   14 o  200.176   2.3847  827.175   27.826  827.175   27.826  827.175   27.826  200.176   3.3725  200.176   3.3725 0.000000 0.000000 
1 1 1    0    7   15 o  406.276   3.2038  3406.16   75.901  3406.16   75.901  3406.16   75.901  406.276   4.5309  406.276   4.5309 0.000000 0.000000 
1 1 1    0    7   16 o  874.711   6.9378 15805.63  353.870 15805.63  353.870 15805.63  353.870  874.711   9.8115  874.711   9.8115 0.000000 0.000000 
1 1 1    0    7   17 o  192.998   2.4337  769.016   27.377  769.016   27.377  769.016   27.377  192.998   3.4418  192.998   3.4418 0.000000 0.000000 
1 1 1    0    7   18 o  302.992   2.7424  1894.60   48.448  1894.60   48.448  1894.60   48.448  302.992   3.8783  302.992   3.8783 0.000000 0.000000 
1 1 1    0    7   19 o  233.762   2.5724  1128.00   35.055  1128.00   35.055  1128.00   35.055  233.762   3.6379  233.762   3.6379 0.000000 0.000000 
1 1 1    0    7   20 o  178.139   2.6460  655.496   27.466  655.496   27.466  655.496   27.466  178.139   3.7420  178.139   3.7420 0.000000 0.000000 
1 1 1    0    7   21 o   22.828   8.9227   14.824   17.357   14.824   17.357   14.824   17.357   22.828   12.619   22.828   12.619 0.000000 0.000000 
1 1 1    0    7   22 o  214.900   2.6918  953.697   33.717  953.697   33.717  953.697   33.717  214.900   3.8068  214.900   3.8068 0.000000 0.000000 
1 1 1    0    7   23 o  161.919   2.8847  542.014   27.205  542.014   27.205  542.014   27.205  161.919   4.0795  161.919   4.0795 0.000000 0.000000 
1 1 1    0    7   24 o  130.000   3.9362  350.864   29.723  350.864   29.723  350.864   29.723  130.000   5.5666  130.000   5.5666 0.000000 0.000000 
1 1 1    0    7   25 o   57.586   7.5015   75.272   22.677   75.272   22.677   75.272   22.677   57.586   10.609   57.586   10.609 0.000000 0.000000 
1 1 1    0    7   26 o   94.453   4.0531  186.330   22.142  186.330   22.142  186.330   22.142   94.453   5.7320   94.453   5.7320 0.000000 0.000000 
1 1 1    0    7   27 o  149.136   3.1256  460.385   27.135  460.385   27.135  460.385   27.135  149.136   4.4203  149.136   4.4203 0.000000 0.000000 
1 1 1    0    7   28 o  110.712   3.6467  254.852   23.433  254.852   23.433  254.852   23.433  110.712   5.1571  110.712   5.1571 0.000000 0.000000 
1 1 1    0    7   29 o   15.523   7.4150  -9.1832   19.623  -9.1832   19.623  -9.1832   19.623   15.523   10.486   15.523   10.486 0.000000 0.000000 
1 1 1    0    7   30 o   51.569   9.0245   64.451   23.497   64.451   23.497   64.451   23.497   51.569   12.763   51.569   12.763 0.000000 0.000000 
1 1 1    0    7   31 o   58.787   7.3181   78.067   22.770   78.067   22.770   78.067   22.770   58.787   10.349   58.787   10.349 0.000000 0.000000 
1 1 1    0    7   32 f   94.212   4.5869  186.281   24.932  186.281   24.932  186.281   24.932   94.212   6.4869   94.212   6.4869 0.000000 0.000000 
1 1 1    0    7   33 o  130.437   4.5887  354.821   34.715  354.821   34.715  354.821   34.715  130.437   6.4894  130.437   6.4894 0.000000 0.000000 
1 1 1    0    7   34 o   13.057   6.6078 -35.9839   23.218 -35.9839   23.218 -35.9839   23.218   13.057   9.3449   13.057   9.3449 0.000000 0.000000 
1 1 1    0    7   35 o   36.779   11.119   40.623   24.345   40.623   24.345   40.623   24.345   36.779   15.725   36.779   15.725 0.000000 0.000000 
1 1 1    0    7   36 o   14.574   7.2420 -25.5295   23.766 -25.5295   23.766 -25.5295   23.766   14.574   10.242   14.574   10.242 0.000000 0.000000 
1 1 1    0    7   37 o   28.367   10.687   25.213   23.997   25.213   23.997   25.213   23.997   28.367   15.114   28.367   15.114 0.000000 0.000000 
1 1 1    0    7   38 o   74.052   6.9870  121.496   28.674  121.496   28.674  121.496   28.674   74.052   9.8811   74.052   9.8811 0.000000 0.000000 
1 1 1    0    7   39 o   44.207   10.850   54.894   25.253   54.894   25.253   54.894   25.253   44.207   15.344   44.207   15.344 0.000000 0.000000 
1 1 1    0    7   40 o   47.419   10.550   61.088   25.630   61.088   25.630   61.088   25.630   47.419   14.919   47.419   14.919 0.000000 0.000000 
1 1 1    0    7   41 o   20.405   9.3604   1.7013   26.521   1.7013   26.521   1.7013   26.521   20.405   13.238   20.405   13.238 0.000000 0.000000 
1 1 1    0    7   42 o   35.356   11.225   40.442   24.729   40.442   24.729   40.442   24.729   35.356   15.875   35.356   15.875 0.000000 0.000000 
1 1 1    0    7   43 o   18.454   8.5720  -0.8522   23.264  -0.8522   23.264  -0.8522   23.264   18.454   12.123   18.454   12.123 0.000000 0.000000 
1 1 1    0    7   44 o   54.683   8.9534   74.960   24.846   74.960   24.846   74.960   24.846   54.683   12.662   54.683   12.662 0.000000 0.000000 
1 1 1    0    7   45 f   11.732   6.0348 -47.9279   23.574 -47.9279   23.574 -47.9279   23.574   11.732   8.5346   11.732   8.5346 0.000000 0.000000 
1 1 1    0    7   46 o   19.297   8.7718   4.8743   22.587   4.8743   22.587   4.8743   22.587   19.297   12.405   19.297   12.405 0.000000 0.000000 
1 1 1    0    7   47 o   29.327   10.878   32.073   24.560   32.073   24.560   32.073   24.560   29.327   15.383   29.327   15.383 0.000000 0.000000 
1 1 1    0    7   48 o   28.746   10.862   31.526   24.855   31.526   24.855   31.526   24.855   28.746   15.361   28.746   15.361 0.000000 0.000000 
1 1 1    0    7   49 o   21.427   9.9645   7.4871   31.568   7.4871   31.568   7.4871   31.568   21.427   14.092   21.427   14.092 0.000000 0.000000 
1 1 1    0    7   50 o   21.822   10.165   9.5440   33.068   9.5440   33.068   9.5440   33.068   21.822   14.376   21.822   14.376 0.000000 0.000000 
1 1 1    0    7   51 o   21.105   10.182   2.7558   38.931   2.7558   38.931   2.7558   38.931   21.105   14.400   21.105   14.400 0.000000 0.000000 
1 1 1    0    8    0 o  683.609   6.7197  9653.48  267.823  9653.48  267.823  9653.48  267.823  683.609   9.5031  683.609   9.5031 0.000000 0.000000 
1 1 1    0    8    1 o  324.362   3.0223  2171.79   57.159  2171.79   57.159  2171.79   57.159  324.362   4.2742  324.362   4.2742 0.000000 0.000000 
1 1 1    0    8    2 o  425.301   4.5172  3736.65  112.002  3736.65  112.002  3736.65  112.002  425.301   6.3883  425.301   6.3883 0.000000 0.000000 
1 1 1    0    8    3 o   27.829   5.6800   19.505   7.9981   19.505   7.9981   19.505   7.9981   27.829   8.0327   27.829   8.0327 0.000000 0.000000 
1 1 1    0    8    4 o  112.899   2.1083  263.472   13.862  263.472   13.862  263.472   13.862  112.899   2.9816  112.899   2.9816 0.000000 0.000000 
1 1 1    0    8    5 o  104.853   2.1831  227.376   13.326  227.376   13.326  227.376   13.326  104.853   3.0874  104.853   3.0874 0.000000 0.000000 
1 1 1    0    8    6 o  507.789   5.2143  5329.31  154.366  5329.31  154.366  5329.31  154.366  507.789   7.3741  507.789   7.3741 0.000000 0.000000 
1 1 1    0    8    7 o  230.726   2.2230  1098.73   29.904  1098.73   29.904  1098.73   29.904  230.726   3.1438  230.726   3.1438 0.000000 0.000000 
1 1 1    0    8    8 o  219.486   2.5531  994.613   32.666  994.613   32.666  994.613   32.666  219.486   3.6107  219.486   3.6107 0.000000 0.000000 
1 1 1    0    8    9 o  206.767   2.5363  882.734   30.568  882.734   30.568  882.734   30.568  206.767   3.5868  206.767   3.5868 0.000000 0.000000 
1 1 1    0    8   10 o  317.202   2.6628  2076.45   49.252  2076.45   49.252  2076.45   49.252  317.202   3.7658  317.202   3.7658 0.000000 0.000000 
1 1 1    0    8   11 o  617.726   5.0574  7879.18  182.168  7879.18  182.168  7879.18  182.168  617.726   7.1523  617.726   7.1523 0.000000 0.000000 
1 1 1    0    8   12 o  224.302   2.3473  1038.36   30.695  1038.36   30.695  1038.36   30.695  224.302   3.3196  224.302   3.3196 0.000000 0.000000 
1 1 1    0    8   13 o  199.684   2.3254  823.077   27.068  823.077   27.068  823.077   27.068  199.684   3.2887  199.684   3.2887 0.000000 0.000000 
1 1 1    0    8   14 o  117.357   2.5809  284.901   17.628  284.901   17.628  284.901   17.628  117.357   3.6499  117.357   3.6499 0.000000 0.000000 
1 1 1    0    8   15 o  499.856   4.2999  5157.45  125.326  5157.45  125.326  5157.45  125.326  499.856   6.0810  499.856   6.0810 0.000000 0.000000 
1 1 1    0    8   16 o   47.630   5.4671   50.364   13.988   50.364   13.988   50.364   13.988   47.630   7.7316   47.630   7.7316 0.000000 0.000000 
1 1 1    0    8   17 o  134.927   2.5678  376.327   20.175  376.327   20.175  376.327   20.175  134.927   3.6314  134.927   3.6314 0.000000 0.000000 
1 1 1    0    8   18 o   20.477   8.1738   11.416   14.943   11.416   14.943   11.416   14.943   20.477   11.560   20.477   11.560 0.000000 0.000000 
1 1 1    0    8   19 o  120.851   3.2904  302.668   23.116  302.668   23.116  302.668   23.116  120.851   4.6534  120.851   4.6534 0.000000 0.000000 
1 1 1    0    8   20 o  187.794   2.6047  728.363   28.507  728.363   28.507  728.363   28.507  187.794   3.6837  187.794   3.6837 0.000000 0.000000 
1 1 1    0    8   21 o   48.869   8.0534   56.710   19.960   56.710   19.960   56.710   19.960   48.869   11.389   48.869   11.389 0.000000 0.000000 
1 1 1    0    8   22 o   54.091   6.8670   66.013   19.588   66.013   19.588   66.013   19.588   54.091   9.7114   54.091   9.7114 0.000000 0.000000 
1 1 1    0    8   23 o  187.378   2.8000  725.459   30.572  725.459   30.572  725.459   30.572  187.378   3.9598  187.378   3.9598 0.000000 0.000000 
1 1 1    0    8   24 o  203.930   3.2770  859.770   38.934  859.770   38.934  859.770   38.934  203.930   4.6344  203.930   4.6344 0.000000 0.000000 
1 1 1    0    8   25 o  228.874   3.1785  1082.70   42.395  1082.70   42.395  1082.70   42.395  228.874   4.4950  228.874   4.4950 0.000000 0.000000 
1 1 1    0    8   26 o   14.430   7.0079 -13.3559   19.131 -13.3559   19.131 -13.3559   19.131   14.430   9.9107   14.430   9.9107 0.000000 0.000000 
1 1 1    0    8   27 o   20.055   8.7069   6.7913   19.652   6.7913   19.652   6.7913   19.652   20.055   12.313   20.055   12.313 0.000000 0.000000 
1 1 1    0    8   28 o   16.193   7.7971 -12.8732   22.588 -12.8732   22.588 -12.8732   22.588   16.193   11.027   16.193   11.027 0.000000 0.000000 
1 1 1    0    8   29 o  158.812   3.1068  522.059   28.729  522.059   28.729  522.059   28.729  158.812   4.3937  158.812   4.3937 0.000000 0.000000 
1 1 1    0    8   30 o   34.511   10.785   35.833   22.838   35.833   22.838   35.833   22.838   34.511   15.252   34.511   15.252 0.000000 0.000000 
1 1 1    0    8   31 f   34.458   10.470   35.346   21.568   35.346   21.568   35.346   21.568   34.458   14.807   34.458   14.807 0.000000 0.000000 
1 1 1    0    8   32 o   59.592   7.3680   80.207   23.267   80.207   23.267   80.207   23.267   59.592   10.420   59.592   10.420 0.000000 0.000000 
1 1 1    0    8   33 o   48.190   13.047   66.507   34.628   66.507   34.628   66.507   34.628   48.190   18.452   48.190   18.452 0.000000 0.000000 
1 1 1    0    8   34 o   50.496   9.4065   63.183   23.937   63.183   23.937   63.183   23.937   50.496   13.303   50.496   13.303 0.000000 0.000000 
1 1 1    0    8   35 o   74.734   6.1205  120.880   25.748  120.880   25.748  120.880   25.748   74.734   8.6557   74.734   8.6557 0.000000 0.000000 
1 1 1    0    8   36 o   65.680   9.0173  100.280   30.804  100.280   30.804  100.280   30.804   65.680   12.752   65.680   12.752 0.000000 0.000000 
1 1 1    0    8   37 o   54.246   9.0121   71.455   24.775   71.455   24.775   71.455   24.775   54.246   12.745   54.246   12.745 0.000000 0.000000 
1 1 1    0    8   38 o   38.828   11.652   46.425   26.765   46.425   26.765   46.425   26.765   38.828   16.478   38.828   16.478 0.000000 0.000000 
1 1 1    0    8   39 o   41.393   10.868   49.541   24.382   49.541   24.382   49.541   24.382   41.393   15.370   41.393   15.370 0.000000 0.000000 
1 1 1    0    8   40 o   17.375   8.2786  -8.2573   24.173  -8.2573   24.173  -8.2573   24.173   17.375   11.708   17.375   11.708 0.000000 0.000000 
1 1 1    0    8   41 o   25.377   11.167   13.884   33.392   13.884   33.392   13.884   33.392   25.377   15.792   25.377   15.792 0.000000 0.000000 
1 1 1    0    8   42 o   19.722   8.9601   3.2270   23.530   3.2270   23.530   3.2270   23.530   19.722   12.672   19.722   12.672 0.000000 0.000000 
1 1 1    0    8   43 o   74.325   7.6885  127.131   31.245  127.131   31.245  127.131   31.245   74.325   10.873   74.325   10.873 0.000000 0.000000 
1 1 1    0    8   44 o   19.519   8.8959   3.6158   23.429   3.6158   23.429   3.6158   23.429   19.519   12.581   19.519   12.581 0.000000 0.000000 
1 1 1    0    8   45 o   20.402   9.2430   5.9157   24.826   5.9157   24.826   5.9157   24.826   20.402   13.072   20.402   13.072 0.000000 0.000000 
1 1 1    0    8   46 o   18.175   8.4329   0.8794   22.420   0.8794   22.420   0.8794   22.420   18.175   11.926   18.175   11.926 0.000000 0.000000 
1 1 1    0    8   47 o   28.673   10.726   30.907   24.032   30.907   24.032   30.907   24.032   28.673   15.169   28.673   15.169 0.000000 0.000000 
1 1 1    0    8   48 o   15.872   7.7544 -12.4972   24.261 -12.4972   24.261 -12.4972   24.261   15.872   10.966   15.872   10.966 0.000000 0.000000 
1 1 1    0    8   49 o   20.819   9.7527   5.4061   31.139   5.4061   31.139   5.4061   31.139   20.819   13.792   20.819   13.792 0.000000 0.000000 
1 1 1    0    8   50 o   25.618   11.045   26.743   31.134   26.743   31.134   26.743   31.134   25.618   15.620   25.618   15.620 0.000000 0.000000 
1 1 1    0    8   51 f   21.598   10.369   6.2208   39.344   6.2208   39.344   6.2208   39.344   21.598   14.663   21.598   14.663 0.000000 0.000000 
1 1 1    0    9    1 o  235.850   3.0948  1148.94   42.541  1148.94   42.541  1148.94   42.541  235.850   4.3767  235.850   4.3767 0.000000 0.000000 
1 1 1    0    9    2 o   56.793   3.0792   67.717   10.062   67.717   10.062   67.717   10.062   56.793   4.3547   56.793   4.3547 0.000000 0.000000 
1 1 1    0    9    3 o  279.483   3.4210  1613.37   55.731  1613.37   55.731  1613.37   55.731  279.483   4.8381  279.483   4.8381 0.000000 0.000000 
1 1 1    0    9    4 o  594.549   5.9644  7309.25  206.745  7309.25  206.745  7309.25  206.745  594.549   8.4349  594.549   8.4349 0.000000 0.000000 
1 1 1    0    9    5 o   17.130   5.5954   8.8357   6.1600   8.8357   6.1600   8.8357   6.1600   17.130   7.9131   17.130   7.9131 0.000000 0.000000 
1 1 1    0    9    6 o  206.097   2.1094  876.716   25.345  876.716   25.345  876.716   25.345  206.097   2.9831  206.097   2.9831 0.000000 0.000000 
1 1 1    0    9    7 o   30.943   4.2071   21.814   6.7822   21.814   6.7822   21.814   6.7822   30.943   5.9498   30.943   5.9498 0.000000 0.000000 
1 1 1    0    9    8 o  326.423   2.6814  2198.97   51.038  2198.97   51.038  2198.97   51.038  326.423   3.7921  326.423   3.7921 0.000000 0.000000 
1 1 1    0    9    9 o  169.564   2.4046  593.783   23.761  593.783   23.761  593.783   23.761  169.564   3.4006  169.564   3.4006 0.000000 0.000000 
1 1 1    0    9   10 o   38.074   4.7188   32.529   9.5168   32.529   9.5168   32.529   9.5168   38.074   6.6734   38.074   6.6734 0.000000 0.000000 
1 1 1    0    9   11 o  575.284   4.7628  6831.66  159.768  6831.66  159.768  6831.66  159.768  575.284   6.7356  575.284   6.7356 0.000000 0.000000 
1 1 1    0    9   12 o  850.941   5.8353 14950.55  289.566 14950.55  289.566 14950.55  289.566  850.941   8.2523  850.941   8.2523 0.000000 0.000000 
1 1 1    0    9   13 o  373.174   3.0078  2873.70   65.450  2873.70   65.450  2873.70   65.450  373.174   4.2536  373.174   4.2536 0.000000 0.000000 
1 1 1    0    9   14 o  197.103   2.3815  801.988   27.362  801.988   27.362  801.988   27.362  197.103   3.3680  197.103   3.3680 0.000000 0.000000 
1 1 1    0    9   15 o  228.250   3.4340  1076.22   45.672  1076.22   45.672  1076.22   45.672  228.250   4.8564  228.250   4.8564 0.000000 0.000000 
1 1 1    0    9   16 f   54.150   4.6190   63.098   14.026   63.098   14.026   63.098   14.026   54.150   6.5322   54.150   6.5322 0.000000 0.000000 
1 1 1    0    9   17 o  175.455   2.4571  635.723   25.124  635.723   25.124  635.723   25.124  175.455   3.4749  175.455   3.4749 0.000000 0.000000 
1 1 1    0    9   18 o  175.831   2.5432  638.541   26.058  638.541   26.058  638.541   26.058  175.831   3.5966  175.831   3.5966 0.000000 0.000000 
1 1 1    0    9   19 o   24.528   9.2205   17.897   17.825   17.897   17.825   17.897   17.825   24.528   13.040   24.528   13.040 0.000000 0.000000 
1 1 1    0    9   20 o   75.826   4.2324  120.885   18.451  120.885   18.451  120.885   18.451   75.826   5.9856   75.826   5.9856 0.000000 0.000000 
1 1 1    0    9   21 f  382.949   3.6412  3028.40   81.299  3028.40   81.299  3028.40   81.299  382.949   5.1494  382.949   5.1494 0.000000 0.000000 
1 1 1    0    9   22 o  408.998   3.3008  3453.69   78.722  3453.69   78.722  3453.69   78.722  408.998   4.6681  408.998   4.6681 0.000000 0.000000 
1 1 1    0    9   23 o   31.065   9.9259   29.028   19.340   29.028   19.340   29.028   19.340   31.065   14.037   31.065   14.037 0.000000 0.000000 
1 1 1    0    9   24 o   89.865   4.2146  169.023   21.869  169.023   21.869  169.023   21.869   89.865   5.9604   89.865   5.9604 0.000000 0.000000 
1 1 1    0    9   25 o  234.786   3.3199  1139.52   45.424  1139.52   45.424  1139.52   45.424  234.786   4.6951  234.786   4.6951 0.000000 0.000000 
1 1 1    0    9   26 o   99.959   3.9216  208.304   22.704  208.304   22.704  208.304   22.704   99.959   5.5460   99.959   5.5460 0.000000 0.000000 
1 1 1    0    9   27 o   47.961   8.3680   55.593   20.266   55.593   20.266   55.593   20.266   47.961   11.834   47.961   11.834 0.000000 0.000000 
1 1 1    0    9   28 o   66.148   6.8947   96.454   24.906   96.454   24.906   96.454   24.906   66.148   9.7505   66.148   9.7505 0.000000 0.000000 
1 1 1    0    9   29 o   49.400   8.0022   57.939   20.083   57.939   20.083   57.939   20.083   49.400   11.317   49.400   11.317 0.000000 0.000000 
1 1 1    0    9   30 o   90.069   4.9368  170.930   25.577  170.930   25.577  170.930   25.577   90.069   6.9817   90.069   6.9817 0.000000 0.000000 
1 1 1    0    9   31 o  206.236   2.9323  879.465   35.242  879.465   35.242  879.465   35.242  206.236   4.1469  206.236   4.1469 0.000000 0.000000 
1 1 1    0    9   32 o   31.361   10.681   30.373   22.643   30.373   22.643   30.373   22.643   31.361   15.105   31.361   15.105 0.000000 0.000000 
1 1 1    0    9   33 o   46.088   12.993   62.018   33.797   62.018   33.797   62.018   33.797   46.088   18.374   46.088   18.374 0.000000 0.000000 
1 1 1    0    9   34 o   21.747   9.5419   7.2849   24.205   7.2849   24.205   7.2849   24.205   21.747   13.494   21.747   13.494 0.000000 0.000000 
1 1 1    0    9   35 o   21.822   9.5240   8.1392   23.790   8.1392   23.790   8.1392   23.790   21.822   13.469   21.822   13.469 0.000000 0.000000 
1 1 1    0    9   36 o   86.115   6.3799  160.143   31.241  160.143   31.241  160.143   31.241   86.115   9.0225   86.115   9.0225 0.000000 0.000000 
1 1 1    0    9   37 o   43.236   10.542   51.794   23.938   51.794   23.938   51.794   23.938   43.236   14.909   43.236   14.909 0.000000 0.000000 
1 1 1    0    9   38 o   18.371   8.6935  -7.3396   25.828  -7.3396   25.828  -7.3396   25.828   18.371   12.295   18.371   12.295 0.000000 0.000000 
1 1 1    0    9   39 o   15.004   7.3936 -20.2411   23.335 -20.2411   23.335 -20.2411   23.335   15.004   10.456   15.004   10.456 0.000000 0.000000 
1 1 1    0    9   40 o   49.930   9.9194   65.232   25.006   65.232   25.006   65.232   25.006   49.930   14.028   49.930   14.028 0.000000 0.000000 
1 1 1    0    9   41 o   39.426   12.139   50.238   28.952   50.238   28.952   50.238   28.952   39.426   17.168   39.426   17.168 0.000000 0.000000 
1 1 1    0    9   42 o   37.115   10.871   43.029   23.399   43.029   23.399   43.029   23.399   37.115   15.374   37.115   15.374 0.000000 0.000000 
1 1 1    0    9   43 o   18.850   8.9242  -5.6308   27.273  -5.6308   27.273  -5.6308   27.273   18.850   12.621   18.850   12.621 0.000000 0.000000 
1 1 1    0    9   44 o   17.075   8.0749  -4.5834   22.222  -4.5834   22.222  -4.5834   22.222   17.075   11.420   17.075   11.420 0.000000 0.000000 
1 1 1    0    9   45 o   16.552   7.9095  -6.5953   22.366  -6.5953   22.366  -6.5953   22.366   16.552   11.186   16.552   11.186 0.000000 0.000000 
1 1 1    0    9   46 o   18.202   8.4105   1.7468   21.964   1.7468   21.964   1.7468   21.964   18.202   11.894   18.202   11.894 0.000000 0.000000 
1 1 1    0    9   47 o   17.510   8.3134  -3.2182   23.971  -3.2182   23.971  -3.2182   23.971   17.510   11.757   17.510   11.757 0.000000 0.000000 
1 1 1    0    9   48 o   33.067   12.532   45.738   33.181   45.738   33.181   45.738   33.181   33.067   17.723   33.067   17.723 0.000000 0.000000 
1 1 1    0    9   49 o   28.389   11.709   34.623   32.160   34.623   32.160   34.623   32.160   28.389   16.560   28.389   16.560 0.000000 0.000000 
1 1 1    0    9   50 o   18.556   8.9795  -4.7507   30.790  -4.7507   30.790  -4.7507   30.790   18.556   12.699   18.556   12.699 0.000000 0.000000 
1 1 1    0    9   51 o   18.005   8.7632  -5.8021   30.301  -5.8021   30.301  -5.8021   30.301   18.005   12.393   18.005   12.393 0.000000 0.000000 
1 1 1    0   10    0 o  106.635   2.5100  235.314   15.572  235.314   15.572  235.314   15.572  106.635   3.5496  106.635   3.5496 0.000000 0.000000 
1 1 1    0   10    1 o  133.204   2.5846  366.868   20.047  366.868   20.047  366.868   20.047  133.204   3.6552  133.204   3.6552 0.000000 0.000000 
1 1 1    0   10    2 o  565.003   4.6715  6593.82  153.905  6593.82  153.905  6593.82  153.905  565.003   6.6065  565.003   6.6065 0.000000 0.000000 
1 1 1    0   10    3 o  450.393   6.7154  4199.09  176.242  4199.09  176.242  4199.09  176.242  450.393   9.4970  450.393   9.4970 0.000000 0.000000 
1 1 1    0   10    4 o   71.713   3.3025  107.457   13.680  107.457   13.680  107.457   13.680   71.713   4.6704   71.713   4.6704 0.000000 0.000000 
1 1 1    0   10    5 o  246.873   2.5877  1258.10   37.243  1258.10   37.243  1258.10   37.243  246.873   3.6595  246.873   3.6595 0.000000 0.000000 
1 1 1    0   10    6 o  111.762   2.2907  258.296   14.904  258.296   14.904  258.296   14.904  111.762   3.2395  111.762   3.2395 0.000000 0.000000 
1 1 1    0   10    7 o  152.831   2.0045  482.253   17.855  482.253   17.855  482.253   17.855  152.831   2.8348  152.831   2.8348 0.000000 0.000000 
1 1 1    0   10    8 o  349.522   2.8107  2520.99   57.286  2520.99   57.286  2520.99   57.286  349.522   3.9750  349.522   3.9750 0.000000 0.000000 
1 1 1    0   10    9 o   78.850   2.7780  129.196   12.704  129.196   12.704  129.196   12.704   78.850   3.9287   78.850   3.9287 0.000000 0.000000 
1 1 1    0   10   10 o  433.694   3.2877  3881.22   83.146  3881.22   83.146  3881.22   83.146  433.694   4.6495  433.694   4.6495 0.000000 0.000000 
1 1 1    0   10   11 o  208.928   2.2854  900.954   27.836  900.954   27.836  900.954   27.836  208.928   3.2320  208.928   3.2320 0.000000 0.000000 
1 1 1    0   10   12 o  118.537   2.8956  290.866   19.966  290.866   19.966  290.866   19.966  118.537   4.0950  118.537   4.0950 0.000000 0.000000 
1 1 1    0   10   13 o  363.736   2.9525  2730.12   62.623  2730.12   62.623  2730.12   62.623  363.736   4.1755  363.736   4.1755 0.000000 0.000000 
1 1 1    0   10   14 o   86.694   2.8873  156.062   14.527  156.062   14.527  156.062   14.527   86.694   4.0833   86.694   4.0833 0.000000 0.000000 
1 1 1    0   10   15 f  387.306   3.5571  3096.25   80.327  3096.25   80.327  3096.25   80.327  387.306   5.0304  387.306   5.0304 0.000000 0.000000 
1 1 1    0   10   16 o   27.402   8.2092   21.977   13.290   21.977   13.290   21.977   13.290   27.402   11.610   27.402   11.610 0.000000 0.000000 
1 1 1    0   10   17 o  279.509   2.6518  1612.44   43.215  1612.44   43.215  1612.44   43.215  279.509   3.7502  279.509   3.7502 0.000000 0.000000 
1 1 1    0   10   18 o   51.349   5.7706   58.409   15.976   58.409   15.976   58.409   15.976   51.349   8.1608   51.349   8.1608 0.000000 0.000000 
1 1 1    0   10   19 o  242.828   2.6484  1217.31   37.492  1217.31   37.492  1217.31   37.492  242.828   3.7454  242.828   3.7454 0.000000 0.000000 
1 1 1    0   10   20 o   87.386   3.9449  159.542   19.920  159.542   19.920  159.542   19.920   87.386   5.5789   87.386   5.5789 0.000000 0.000000 
1 1 1    0   10   21 o   35.994   9.8224   36.592   19.562   36.592   19.562   36.592   19.562   35.994   13.891   35.994   13.891 0.000000 0.000000 
1 1 1    0   10   22 o   33.215   9.9562   32.427   19.546   32.427   19.546   32.427   19.546   33.215   14.080   33.215   14.080 0.000000 0.000000 
1 1 1    0   10   23 o  202.525   2.7471  847.371   32.424  847.371   32.424  847.371   32.424  202.525   3.8850  202.525   3.8850 0.000000 0.000000 
1 1 1    0   10   24 o  131.924   3.5467  360.955   27.202  360.955   27.202  360.955   27.202  131.924   5.0159  131.924   5.0159 0.000000 0.000000 
1 1 1    0   10   25 o  114.259   4.3369  272.092   28.713  272.092   28.713  272.092   28.713  114.259   6.1333  114.259   6.1333 0.000000 0.000000 
1 1 1    0   10   26 o   16.205   7.5818  -4.4812   18.724  -4.4812   18.724  -4.4812   18.724   16.205   10.722   16.205   10.722 0.000000 0.000000 
1 1 1    0   10   27 o   63.118   5.8704   86.664   20.575   86.664   20.575   86.664   20.575   63.118   8.3020   63.118   8.3020 0.000000 0.000000 
1 1 1    0   10   28 o   21.982   9.0348   12.280   19.043   12.280   19.043   12.280   19.043   21.982   12.777   21.982   12.777 0.000000 0.000000 
1 1 1    0   10   29 o   94.866   4.1686  188.224   22.863  188.224   22.863  188.224   22.863   94.866   5.8954   94.866   5.8954 0.000000 0.000000 
1 1 1    0   10   30 o  174.372   3.0847  629.183   31.329  629.183   31.329  629.183   31.329  174.372   4.3624  174.372   4.3624 0.000000 0.000000 
1 1 1    0   10   31 o   26.500   10.143   20.939   21.940   20.939   21.940   20.939   21.940   26.500   14.345   26.500   14.345 0.000000 0.000000 
1 1 1    0   10   32 o  117.319   3.9799  286.644   27.092  286.644   27.092  286.644   27.092  117.319   5.6284  117.319   5.6284 0.000000 0.000000 
1 1 1    0   10   33 o   19.333   8.8613  -0.6747   23.700  -0.6747   23.700  -0.6747   23.700   19.333   12.532   19.333   12.532 0.000000 0.000000 
1 1 1    0   10   34 o   23.835   10.562   7.6061   30.394   7.6061   30.394   7.6061   30.394   23.835   14.936   23.835   14.936 0.000000 0.000000 
1 1 1    0   10   35 o   15.346   7.5587 -21.8692   24.309 -21.8692   24.309 -21.8692   24.309   15.346   10.690   15.346   10.690 0.000000 0.000000 
1 1 1    0   10   36 o   76.273   6.0732  126.211   26.137  126.211   26.137  126.211   26.137   76.273   8.5887   76.273   8.5887 0.000000 0.000000 
1 1 1    0   10   37 o   17.264   8.1922  -7.7387   23.213  -7.7387   23.213  -7.7387   23.213   17.264   11.586   17.264   11.586 0.000000 0.000000 
1 1 1    0   10   38 o   48.300   10.026   61.184   24.541   61.184   24.541   61.184   24.541   48.300   14.179   48.300   14.179 0.000000 0.000000 
1 1 1    0   10   39 o   23.720   9.9235   15.158   23.675   15.158   23.675   15.158   23.675   23.720   14.034   23.720   14.034 0.000000 0.000000 
1 1 1    0   10   40 o   17.962   8.5214  -6.9458   25.089  -6.9458   25.089  -6.9458   25.089   17.962   12.051   17.962   12.051 0.000000 0.000000 
1 1 1    0   10   41 o   27.151   11.315   21.907   30.570   21.907   30.570   21.907   30.570   27.151   16.002   27.151   16.002 0.000000 0.000000 
1 1 1    0   10   42 o   86.433   5.1873  161.455   25.718  161.455   25.718  161.455   25.718   86.433   7.3359   86.433   7.3359 0.000000 0.000000 
1 1 1    0   10   43 o   63.475   7.5186   94.138   25.489   94.138   25.489   94.138   25.489   63.475   10.633   63.475   10.633 0.000000 0.000000 
1 1 1    0   10   44 o   75.183   5.8789  125.473   24.975  125.473   24.975  125.473   24.975   75.183   8.3141   75.183   8.3141 0.000000 0.000000 
1 1 1    0   10   45 o   14.976   7.3274 -13.8071   21.872 -13.8071   21.872 -13.8071   21.872   14.976   10.362   14.976   10.362 0.000000 0.000000 
1 1 1    0   10   46 o   27.481   10.780   27.850   25.438   27.850   25.438   27.850   25.438   27.481   15.245   27.481   15.245 0.000000 0.000000 
1 1 1    0   10   47 o   16.362   7.9186  -9.1911   23.958  -9.1911   23.958  -9.1911   23.958   16.362   11.199   16.362   11.199 0.000000 0.000000 
1 1 1    0   10   48 f   21.983   10.846 -15.9448   50.643 -15.9448   50.643 -15.9448   50.643   21.983   15.339   21.983   15.339 0.000000 0.000000 
1 1 1    0   10   49 o   25.076   11.037   23.585   32.643   23.585   32.643   23.585   32.643   25.076   15.609   25.076   15.609 0.000000 0.000000 
1 1 1    0   10   50 o   20.314   9.5598   6.3843   30.482   6.3843   30.482   6.3843   30.482   20.314   13.520   20.314   13.520 0.000000 0.000000 
1 1 1    0   11    1 o  263.383   2.6814  1431.95   41.174  1431.95   41.174  1431.95   41.174  263.383   3.7921  263.383   3.7921 0.000000 0.000000 
1 1 1    0   11    2 o  215.353   2.4444  957.396   30.687  957.396   30.687  957.396   30.687  215.353   3.4569  215.353   3.4569 0.000000 0.000000 
1 1 1    0   11    3 o  212.009   3.0419  928.450   37.582  928.450   37.582  928.450   37.582  212.009   4.3019  212.009   4.3019 0.000000 0.000000 
1 1 1    0   11    4 o  650.706   6.4584  8752.00  245.017  8752.00  245.017  8752.00  245.017  650.706   9.1335  650.706   9.1335 0.000000 0.000000 
1 1 1    0   11    6 o   95.542   2.6539  189.158   14.738  189.158   14.738  189.158   14.738   95.542   3.7532   95.542   3.7532 0.000000 0.000000 
1 1 1    0   11    7 o  371.413   2.9202  2846.50   63.246  2846.50   63.246  2846.50   63.246  371.413   4.1299  371.413   4.1299 0.000000 0.000000 
1 1 1    0   11    8 o  416.439   3.6604  3579.18   88.881  3579.18   88.881  3579.18   88.881  416.439   5.1766  416.439   5.1766 0.000000 0.000000 
1 1 1    0   11    9 o   40.151   4.4202   35.588   9.6045   35.588   9.6045   35.588   9.6045   40.151   6.2511   40.151   6.2511 0.000000 0.000000 
1 1 1    0   11   10 o  143.432   2.2057  424.918   18.433  424.918   18.433  424.918   18.433  143.432   3.1193  143.432   3.1193 0.000000 0.000000 
1 1 1    0   11   11 o   98.606   2.5736  201.366   14.756  201.366   14.756  201.366   14.756   98.606   3.6396   98.606   3.6396 0.000000 0.000000 
1 1 1    0   11   12 o  435.657   3.8461  3917.47   97.699  3917.47   97.699  3917.47   97.699  435.657   5.4392  435.657   5.4392 0.000000 0.000000 
1 1 1    0   11   13 o  394.698   3.1068  3214.83   71.505  3214.83   71.505  3214.83   71.505  394.698   4.3937  394.698   4.3937 0.000000 0.000000 
1 1 1    0   11   14 o  536.179   3.9099  5933.40  122.251  5933.40  122.251  5933.40  122.251  536.179   5.5295  536.179   5.5295 0.000000 0.000000 
1 1 1    0   11   15 o  784.315   5.4265 12702.20  248.195 12702.20  248.195 12702.20  248.195  784.315   7.6742  784.315   7.6742 0.000000 0.000000 
1 1 1    0   11   16 o  224.177   2.8982  1037.77   37.868  1037.77   37.868  1037.77   37.868  224.177   4.0987  224.177   4.0987 0.000000 0.000000 
1 1 1    0   11   17 o   31.657   8.3775   27.882   14.429   27.882   14.429   27.882   14.429   31.657   11.848   31.657   11.848 0.000000 0.000000 
1 1 1    0   11   18 o   30.401   9.7405   27.754   18.630   27.754   18.630   27.754   18.630   30.401   13.775   30.401   13.775 0.000000 0.000000 
1 1 1    0   11   19 o  134.690   2.8466  375.299   22.318  375.299   22.318  375.299   22.318  134.690   4.0256  134.690   4.0256 0.000000 0.000000 
1 1 1    0   11   20 o  192.151   2.6671  762.644   29.866  762.644   29.866  762.644   29.866  192.151   3.7718  192.151   3.7718 0.000000 0.000000 
1 1 1    0   11   21 o  368.338   3.1094  2801.14   66.783  2801.14   66.783  2801.14   66.783  368.338   4.3974  368.338   4.3974 0.000000 0.000000 
1 1 1    0   11   22 o   22.832   9.3343   13.378   20.159   13.378   20.159   13.378   20.159   22.832   13.201   22.832   13.201 0.000000 0.000000 
1 1 1    0   11   23 o  182.504   2.7876  688.419   29.644  688.419   29.644  688.419   29.644  182.504   3.9423  182.504   3.9423 0.000000 0.000000 
1 1 1    0   11   24 o  244.888   3.1238  1239.24   44.587  1239.24   44.587  1239.24   44.587  244.888   4.4177  244.888   4.4177 0.000000 0.000000 
1 1 1    0   11   25 o   41.524   10.871   48.076   24.431   48.076   24.431   48.076   24.431   41.524   15.374   41.524   15.374 0.000000 0.000000 
1 1 1    0   11   26 o  100.343   3.8558  209.874   22.415  209.874   22.415  209.874   22.415  100.343   5.4529  100.343   5.4529 0.000000 0.000000 
1 1 1    0   11   27 o  176.602   3.3958  645.639   34.921  645.639   34.921  645.639   34.921  176.602   4.8023  176.602   4.8023 0.000000 0.000000 
1 1 1    0   11   28 o  218.984   2.8141  991.086   35.918  991.086   35.918  991.086   35.918  218.984   3.9797  218.984   3.9797 0.000000 0.000000 
1 1 1    0   11   29 o  227.556   2.8707  1070.29   38.075  1070.29   38.075  1070.29   38.075  227.556   4.0597  227.556   4.0597 0.000000 0.000000 
1 1 1    0   11   30 o   71.201   5.6370  108.945   22.658  108.945   22.658  108.945   22.658   71.201   7.9719   71.201   7.9719 0.000000 0.000000 
1 1 1    0   11   31 o   34.989   11.360   37.472   25.375   37.472   25.375   37.472   25.375   34.989   16.065   34.989   16.065 0.000000 0.000000 
1 1 1    0   11   32 o   20.868   9.2977   4.5444   23.923   4.5444   23.923   4.5444   23.923   20.868   13.149   20.868   13.149 0.000000 0.000000 
1 1 1    0   11   33 o  145.194   3.5843  437.711   30.271  437.711   30.271  437.711   30.271  145.194   5.0689  145.194   5.0689 0.000000 0.000000 
1 1 1    0   11   34 o   43.643   12.628   56.667   31.685   56.667   31.685   56.667   31.685   43.643   17.859   43.643   17.859 0.000000 0.000000 
1 1 1    0   11   35 o   70.083   8.2684  111.477   30.971  111.477   30.971  111.477   30.971   70.083   11.693   70.083   11.693 0.000000 0.000000 
1 1 1    0   11   36 o   37.600   10.950   42.392   23.779   42.392   23.779   42.392   23.779   37.600   15.485   37.600   15.485 0.000000 0.000000 
1 1 1    0   11   37 f   86.640   5.3018  160.606   26.331  160.606   26.331  160.606   26.331   86.640   7.4979   86.640   7.4979 0.000000 0.000000 
1 1 1    0   11   38 o   24.849   10.083   17.960   23.252   17.960   23.252   17.960   23.252   24.849   14.260   24.849   14.260 0.000000 0.000000 
1 1 1    0   11   39 o   20.559   9.2706   4.6648   24.619   4.6648   24.619   4.6648   24.619   20.559   13.111   20.559   13.111 0.000000 0.000000 
1 1 1    0   11   40 o   26.254   10.503   21.735   24.747   21.735   24.747   21.735   24.747   26.254   14.854   26.254   14.854 0.000000 0.000000 
1 1 1    0   11   41 o   79.907   5.7020  139.249   25.956  139.249   25.956  139.249   25.956   79.907   8.0639   79.907   8.0639 0.000000 0.000000 
1 1 1    0   11   42 o   20.933   9.6976   0.8243   29.480   0.8243   29.480   0.8243   29.480   20.933   13.714   20.933   13.714 0.000000 0.000000 
1 1 1    0   11   43 o   21.655   9.4967   10.490   23.946   10.490   23.946   10.490   23.946   21.655   13.430   21.655   13.430 0.000000 0.000000 
1 1 1    0   11   44 f   19.939   8.9716   6.3116   22.900   6.3116   22.900   6.3116   22.900   19.939   12.688   19.939   12.688 0.000000 0.000000 
1 1 1    0   11   45 o   20.918   9.1852   10.544   22.474   10.544   22.474   10.544   22.474   20.918   12.990   20.918   12.990 0.000000 0.000000 
1 1 1    0   11   46 o   27.161   10.900   27.714   26.763   27.714   26.763   27.714   26.763   27.161   15.415   27.161   15.415 0.000000 0.000000 
1 1 1    0   11   47 o   34.786   11.277   43.671   25.000   43.671   25.000   43.671   25.000   34.786   15.948   34.786   15.948 0.000000 0.000000 
1 1 1    0   11   48 o   20.441   10.266 -33.4165   52.154 -33.4165   52.154 -33.4165   52.154   20.441   14.519   20.441   14.519 0.000000 0.000000 
1 1 1    0   11   49 o   23.653   10.703   18.294   33.158   18.294   33.158   18.294   33.158   23.653   15.136   23.653   15.136 0.000000 0.000000 
1 1 1    0   11   50 o   13.151   6.8482 -87.0210   37.436 -87.0210   37.436 -87.0210   37.436   13.151   9.6849   13.151   9.6849 0.000000 0.000000 
1 1 1    0   12    0 o  164.764   2.7406  560.836   26.306  560.836   26.306  560.836   26.306  164.764   3.8759  164.764   3.8759 0.000000 0.000000 
1 1 1    0   12    1 o   61.179   2.0895   77.736   7.4167   77.736   7.4167   77.736   7.4167   61.179   2.9550   61.179   2.9550 0.000000 0.000000 
1 1 1    0   12    2 o  356.778   3.2523  2627.18   67.656  2627.18   67.656  2627.18   67.656  356.778   4.5994  356.778   4.5994 0.000000 0.000000 
1 1 1    0   12    3 o  460.052   4.8254  4370.47  129.421  4370.47  129.421  4370.47  129.421  460.052   6.8241  460.052   6.8241 0.000000 0.000000 
1 1 1    0   12    4 o  627.853   8.8716  8155.92  324.601  8155.92  324.601  8155.92  324.601  627.853   12.546  627.853   12.546 0.000000 0.000000 
1 1 1    0   12    5 o  260.253   3.3922  1398.61   51.455  1398.61   51.455  1398.61   51.455  260.253   4.7973  260.253   4.7973 0.000000 0.000000 
1 1 1    0   12    6 o  423.852   3.2084  3707.03   79.299  3707.03   79.299  3707.03   79.299  423.852   4.5373  423.852   4.5373 0.000000 0.000000 
1 1 1    0   12    7 o  308.995   2.5886  1970.16   46.640  1970.16   46.640  1970.16   46.640  308.995   3.6608  308.995   3.6608 0.000000 0.000000 
1 1 1    0   12    8 f  361.221   3.3154  2693.02   69.826  2693.02   69.826  2693.02   69.826  361.221   4.6886  361.221   4.6886 0.000000 0.000000 
1 1 1    0   12    9 o  209.284   2.2468  903.996   27.412  903.996   27.412  903.996   27.412  209.284   3.1774  209.284   3.1774 0.000000 0.000000 
1 1 1    0   12   10 o  205.567   2.2593  872.201   27.075  872.201   27.075  872.201   27.075  205.567   3.1951  205.567   3.1951 0.000000 0.000000 
1 1 1    0   12   11 o   70.277   3.2976  103.223   13.381  103.223   13.381  103.223   13.381   70.277   4.6635   70.277   4.6635 0.000000 0.000000 
1 1 1    0   12   12 f  305.297   3.0758  1923.86   54.748  1923.86   54.748  1923.86   54.748  305.297   4.3499  305.297   4.3499 0.000000 0.000000 
1 1 1    0   12   13 o  186.282   2.6161  716.613   28.400  716.613   28.400  716.613   28.400  186.282   3.6997  186.282   3.6997 0.000000 0.000000 
1 1 1    0   12   14 o  128.424   2.7301  341.128   20.409  341.128   20.409  341.128   20.409  128.424   3.8610  128.424   3.8610 0.000000 0.000000 
1 1 1    0   12   15 o  376.217   3.0410  2921.11   66.714  2921.11   66.714  2921.11   66.714  376.217   4.3007  376.217   4.3007 0.000000 0.000000 
1 1 1    0   12   16 o  338.710   3.3500  2368.52   66.154  2368.52   66.154  2368.52   66.154  338.710   4.7376  338.710   4.7376 0.000000 0.000000 
1 1 1    0   12   17 o   33.840   8.4200   31.064   15.082   31.064   15.082   31.064   15.082   33.840   11.908   33.840   11.908 0.000000 0.000000 
1 1 1    0   12   18 o  205.379   2.9256  871.357   35.015  871.357   35.015  871.357   35.015  205.379   4.1374  205.379   4.1374 0.000000 0.000000 
1 1 1    0   12   19 o  155.156   2.6960  497.577   24.365  497.577   24.365  497.577   24.365  155.156   3.8127  155.156   3.8127 0.000000 0.000000 
1 1 1    0   12   20 o  175.316   2.6902  635.076   27.481  635.076   27.481  635.076   27.481  175.316   3.8045  175.316   3.8045 0.000000 0.000000 
1 1 1    0   12   21 o  113.338   3.2839  266.474   21.626  266.474   21.626  266.474   21.626  113.338   4.6441  113.338   4.6441 0.000000 0.000000 
1 1 1    0   12   22 o  107.433   3.8611  240.227   24.053  240.227   24.053  240.227   24.053  107.433   5.4604  107.433   5.4604 0.000000 0.000000 
1 1 1    0   12   23 o  180.232   2.8287  671.458   29.704  671.458   29.704  671.458   29.704  180.232   4.0004  180.232   4.0004 0.000000 0.000000 
1 1 1    0   12   24 o  247.231   3.1236  1263.08   45.011  1263.08   45.011  1263.08   45.011  247.231   4.4174  247.231   4.4174 0.000000 0.000000 
1 1 1    0   12   25 o  240.597   2.7627  1195.89   38.747  1195.89   38.747  1195.89   38.747  240.597   3.9070  240.597   3.9070 0.000000 0.000000 
1 1 1    0   12   26 o   29.972   10.982   27.482   24.803   27.482   24.803   27.482   24.803   29.972   15.531   29.972   15.531 0.000000 0.000000 
1 1 1    0   12   27 o  152.703   3.5725  483.368   31.741  483.368   31.741  483.368   31.741  152.703   5.0523  152.703   5.0523 0.000000 0.000000 
1 1 1    0   12   28 f  135.281   3.2609  379.350   25.663  379.350   25.663  379.350   25.663  135.281   4.6116  135.281   4.6116 0.000000 0.000000 
1 1 1    0   12   29 o  100.764   4.1030  212.032   23.932  212.032   23.932  212.032   23.932  100.764   5.8025  100.764   5.8025 0.000000 0.000000 
1 1 1    0   12   30 o   94.197   4.4076  186.001   23.973  186.001   23.973  186.001   23.973   94.197   6.2332   94.197   6.2332 0.000000 0.000000 
1 1 1    0   12   31 f  167.091   3.6564  578.889   35.559  578.889   35.559  578.889   35.559  167.091   5.1710  167.091   5.1710 0.000000 0.000000 
1 1 1    0   12   32 o   32.432   11.206   32.778   25.052   32.778   25.052   32.778   25.052   32.432   15.848   32.432   15.848 0.000000 0.000000 
1 1 1    0   12   33 o  203.306   3.5266  856.829   41.764  856.829   41.764  856.829   41.764  203.306   4.9874  203.306   4.9874 0.000000 0.000000 
1 1 1    0   12   34 o   29.943   11.626   27.208   29.245   27.208   29.245   27.208   29.245   29.943   16.442   29.943   16.442 0.000000 0.000000 
1 1 1    0   12   35 o  109.067   5.2167  251.393   32.839  251.393   32.839  251.393   32.839  109.067   7.3775  109.067   7.3775 0.000000 0.000000 
1 1 1    0   12   36 o   17.682   8.3563  -6.8381   23.727  -6.8381   23.727  -6.8381   23.727   17.682   11.818   17.682   11.818 0.000000 0.000000 
1 1 1    0   12   37 o   76.307   5.8805  126.618   25.384  126.618   25.384  126.618   25.384   76.307   8.3163   76.307   8.3163 0.000000 0.000000 
1 1 1    0   12   38 o   49.776   9.2245   62.681   23.141   62.681   23.141   62.681   23.141   49.776   13.045   49.776   13.045 0.000000 0.000000 
1 1 1    0   12   39 o   27.201   10.930   23.324   26.955   23.324   26.955   23.324   26.955   27.201   15.457   27.201   15.457 0.000000 0.000000 
1 1 1    0   12   40 o   82.686   5.3102  147.723   25.125  147.723   25.125  147.723   25.125   82.686   7.5098   82.686   7.5098 0.000000 0.000000 
1 1 1    0   12   41 o   15.715   7.6413 -13.5763   22.908 -13.5763   22.908 -13.5763   22.908   15.715   10.806   15.715   10.806 0.000000 0.000000 
1 1 1    0   12   42 o   69.925   13.059  133.398   46.017  133.398   46.017  133.398   46.017   69.925   18.469   69.925   18.469 0.000000 0.000000 
1 1 1    0   12   43 o   24.471   10.069   18.862   23.689   18.862   23.689   18.862   23.689   24.471   14.239   24.471   14.239 0.000000 0.000000 
1 1 1    0   12   44 f   16.304   7.8586  -9.1969   23.068  -9.1969   23.068  -9.1969   23.068   16.304   11.114   16.304   11.114 0.000000 0.000000 
1 1 1    0   12   45 o   48.284   9.3337   62.695   22.727   62.695   22.727   62.695   22.727   48.284   13.200   48.284   13.200 0.000000 0.000000 
1 1 1    0   12   46 o   37.934   11.874   51.614   27.683   51.614   27.683   51.614   27.683   37.934   16.792   37.934   16.792 0.000000 0.000000 
1 1 1    0   12   48 o   21.022   10.100  -0.6592   37.488  -0.6592   37.488  -0.6592   37.488   21.022   14.284   21.022   14.284 0.000000 0.000000 
1 1 1    0   12   49 o   32.339   12.211   46.910   31.398   46.910   31.398   46.910   31.398   32.339   17.270   32.339   17.270 0.000000 0.000000 
1 1 1    0   12   50 o   42.547   12.653   70.963   31.612   70.963   31.612   70.963   31.612   42.547   17.895   42.547   17.895 0.000000 0.000000 
1 1 1    0   13    1 o  335.710   2.6968  2325.47   52.792  2325.47   52.792  2325.47   52.792  335.710   3.8138  335.710   3.8138 0.000000 0.000000 
1 1 1    0   13    2 o  510.892   4.2838  5387.45  127.616  5387.45  127.616  5387.45  127.616  510.892   6.0582  510.892   6.0582 0.000000 0.000000 
1 1 1    0   13    3 o  274.850   3.4479  1559.83   55.236  1559.83   55.236  1559.83   55.236  274.850   4.8760  274.850   4.8760 0.000000 0.000000 
1 1 1    0   13    4 o  573.548   8.2115  6805.17  274.455  6805.17  274.455  6805.17  274.455  573.548   11.613  573.548   11.613 0.000000 0.000000 
1 1 1    0   13    5 o  191.468   3.1268  757.436   34.879  757.436   34.879  757.436   34.879  191.468   4.4220  191.468   4.4220 0.000000 0.000000 
1 1 1    0   13    6 o  168.795   3.1396  588.946   30.863  588.946   30.863  588.946   30.863  168.795   4.4401  168.795   4.4401 0.000000 0.000000 
1 1 1    0   13    7 o  281.858   2.8747  1639.70   47.239  1639.70   47.239  1639.70   47.239  281.858   4.0655  281.858   4.0655 0.000000 0.000000 
1 1 1    0   13    8 o  373.138   4.1652  2874.76   90.603  2874.76   90.603  2874.76   90.603  373.138   5.8905  373.138   5.8905 0.000000 0.000000 
1 1 1    0   13    9 o  134.081   2.1119  371.338   16.498  371.338   16.498  371.338   16.498  134.081   2.9867  134.081   2.9867 0.000000 0.000000 
1 1 1    0   13   10 o  320.340   2.6880  2117.58   50.208  2117.58   50.208  2117.58   50.208  320.340   3.8013  320.340   3.8013 0.000000 0.000000 
1 1 1    0   13   11 o   95.682   2.4636  189.584   13.708  189.584   13.708  189.584   13.708   95.682   3.4840   95.682   3.4840 0.000000 0.000000 
1 1 1    0   13   12 o  138.146   2.2681  394.262   18.254  394.262   18.254  394.262   18.254  138.146   3.2076  138.146   3.2076 0.000000 0.000000 
1 1 1    0   13   13 o  360.684   3.3933  2685.39   71.360  2685.39   71.360  2685.39   71.360  360.684   4.7988  360.684   4.7988 0.000000 0.000000 
1 1 1    0   13   14 o  107.583   2.9442  239.843   18.412  239.843   18.412  239.843   18.412  107.583   4.1637  107.583   4.1637 0.000000 0.000000 
1 1 1    0   13   15 o   21.309   7.8575   13.641   12.758   13.641   12.758   13.641   12.758   21.309   11.112   21.309   11.112 0.000000 0.000000 
1 1 1    0   13   16 o   20.223   8.2134   10.649   15.450   10.649   15.450   10.649   15.450   20.223   11.615   20.223   11.615 0.000000 0.000000 
1 1 1    0   13   17 o  187.319   3.7587  725.964   40.993  725.964   40.993  725.964   40.993  187.319   5.3156  187.319   5.3156 0.000000 0.000000 
1 1 1    0   13   18 o  571.402   4.7915  6745.99  159.646  6745.99  159.646  6745.99  159.646  571.402   6.7762  571.402   6.7762 0.000000 0.000000 
1 1 1    0   13   19 o  195.135   2.9243  786.803   33.251  786.803   33.251  786.803   33.251  195.135   4.1356  195.135   4.1356 0.000000 0.000000 
1 1 1    0   13   20 o   60.100   5.3592   78.136   17.975   78.136   17.975   78.136   17.975   60.100   7.5791   60.100   7.5791 0.000000 0.000000 
1 1 1    0   13   21 o  284.810   2.7814  1675.09   46.186  1675.09   46.186  1675.09   46.186  284.810   3.9335  284.810   3.9335 0.000000 0.000000 
1 1 1    0   13   22 o  123.737   3.1533  317.312   22.691  317.312   22.691  317.312   22.691  123.737   4.4594  123.737   4.4594 0.000000 0.000000 
1 1 1    0   13   23 o  132.556   3.4019  364.245   26.224  364.245   26.224  364.245   26.224  132.556   4.8111  132.556   4.8111 0.000000 0.000000 
1 1 1    0   13   24 o  134.224   3.0484  373.115   23.810  373.115   23.810  373.115   23.810  134.224   4.3111  134.224   4.3111 0.000000 0.000000 
1 1 1    0   13   25 o   75.144   4.6944  119.479   20.206  119.479   20.206  119.479   20.206   75.144   6.6388   75.144   6.6388 0.000000 0.000000 
1 1 1    0   13   26 o   80.371   7.9967  142.026   35.355  142.026   35.355  142.026   35.355   80.371   11.309   80.371   11.309 0.000000 0.000000 
1 1 1    0   13   27 o  216.872   2.8319  972.119   35.795  972.119   35.795  972.119   35.795  216.872   4.0049  216.872   4.0049 0.000000 0.000000 
1 1 1    0   13   28 o  223.132   2.8837  1029.15   37.502  1029.15   37.502  1029.15   37.502  223.132   4.0781  223.132   4.0781 0.000000 0.000000 
1 1 1    0   13   29 o  126.904   3.5063  334.335   25.864  334.335   25.864  334.335   25.864  126.904   4.9587  126.904   4.9587 0.000000 0.000000 
1 1 1    0   13   30 o   19.629   8.7681   3.5409   21.429   3.5409   21.429   3.5409   21.429   19.629   12.400   19.629   12.400 0.000000 0.000000 
1 1 1    0   13   31 f  116.161   4.0244  281.224   27.118  281.224   27.118  281.224   27.118  116.161   5.6914  116.161   5.6914 0.000000 0.000000 
1 1 1    0   13   32 o   19.079   8.7581  -0.8940   23.269  -0.8940   23.269  -0.8940   23.269   19.079   12.386   19.079   12.386 0.000000 0.000000 
1 1 1    0   13   33 o  109.485   4.3698  250.919   27.703  250.919   27.703  250.919   27.703  109.485   6.1799  109.485   6.1799 0.000000 0.000000 
1 1 1    0   13   34 o  129.200   3.8618  347.962   28.985  347.962   28.985  347.962   28.985  129.200   5.4615  129.200   5.4615 0.000000 0.000000 
1 1 1    0   13   35 o   40.986   10.840   48.233   24.166   48.233   24.166   48.233   24.166   40.986   15.330   40.986   15.330 0.000000 0.000000 
1 1 1    0   13   36 o   23.847   9.8981   15.304   23.226   15.304   23.226   15.304   23.226   23.847   13.998   23.847   13.998 0.000000 0.000000 
1 1 1    0   13   37 o   29.619   10.699   28.432   23.336   28.432   23.336   28.432   23.336   29.619   15.131   29.619   15.131 0.000000 0.000000 
1 1 1    0   13   38 o   75.388   5.8191  124.273   24.814  124.273   24.814  124.273   24.814   75.388   8.2295   75.388   8.2295 0.000000 0.000000 
1 1 1    0   13   39 o   67.122   7.2534  102.772   26.429  102.772   26.429  102.772   26.429   67.122   10.258   67.122   10.258 0.000000 0.000000 
1 1 1    0   13   40 o   17.602   8.3157  -5.4686   23.461  -5.4686   23.461  -5.4686   23.461   17.602   11.760   17.602   11.760 0.000000 0.000000 
1 1 1    0   13   41 o   66.702   7.0268  101.763   25.552  101.763   25.552  101.763   25.552   66.702   9.9375   66.702   9.9375 0.000000 0.000000 
1 1 1    0   13   42 f   65.728   9.3924  106.397   31.897  106.397   31.897  106.397   31.897   65.728   13.283   65.728   13.283 0.000000 0.000000 
1 1 1    0   13   43 o   70.442   6.3419  112.074   24.905  112.074   24.905  112.074   24.905   70.442   8.9688   70.442   8.9688 0.000000 0.000000 
1 1 1    0   13   44 o   40.892   10.803   51.697   24.013   51.697   24.013   51.697   24.013   40.892   15.277   40.892   15.277 0.000000 0.000000 
1 1 1    0   13   45 o   26.043   11.383   22.268   34.112   22.268   34.112   22.268   34.112   26.043   16.098   26.043   16.098 0.000000 0.000000 
1 1 1    0   13   46 o   15.177   7.5921 -26.1295   27.552 -26.1295   27.552 -26.1295   27.552   15.177   10.737   15.177   10.737 0.000000 0.000000 
1 1 1    0   13   47 o   16.261   8.1508 -28.5759   32.302 -28.5759   32.302 -28.5759   32.302   16.261   11.527   16.261   11.527 0.000000 0.000000 
1 1 1    0   13   48 o   23.126   10.587   15.096   33.687   15.096   33.687   15.096   33.687   23.126   14.972   23.126   14.972 0.000000 0.000000 
1 1 1    0   13   49 o   21.377   10.683 -16.6642   54.088 -16.6642   54.088 -16.6642   54.088   21.377   15.107   21.377   15.107 0.000000 0.000000 
1 1 1    0   14    0 o  290.203   3.5041  1738.57   59.275  1738.57   59.275  1738.57   59.275  290.203   4.9555  290.203   4.9555 0.000000 0.000000 
1 1 1    0   14    1 o  725.050   5.0189 10851.70  212.208 10851.70  212.208 10851.70  212.208  725.050   7.0978  725.050   7.0978 0.000000 0.000000 
1 1 1    0   14    2 o  256.696   2.6945  1360.02   40.323  1360.02   40.323  1360.02   40.323  256.696   3.8106  256.696   3.8106 0.000000 0.000000 
1 1 1    0   14    4 o  212.574   4.4512  934.811   55.082  934.811   55.082  934.811   55.082  212.574   6.2950  212.574   6.2950 0.000000 0.000000 
1 1 1    0   14    5 f  324.810   3.8378  2178.38   72.663  2178.38   72.663  2178.38   72.663  324.810   5.4274  324.810   5.4274 0.000000 0.000000 
1 1 1    0   14    6 o  588.681   5.9438  7158.20  203.998  7158.20  203.998  7158.20  203.998  588.681   8.4058  588.681   8.4058 0.000000 0.000000 
1 1 1    0   14    7 o  157.383   3.2235  512.249   29.536  512.249   29.536  512.249   29.536  157.383   4.5588  157.383   4.5588 0.000000 0.000000 
1 1 1    0   14    8 o  624.423   5.0980  8050.49  185.621  8050.49  185.621  8050.49  185.621  624.423   7.2096  624.423   7.2096 0.000000 0.000000 
1 1 1    0   14    9 o  195.431   2.5552  788.598   29.104  788.598   29.104  788.598   29.104  195.431   3.6136  195.431   3.6136 0.000000 0.000000 
1 1 1    0   14   10 o  204.442   2.2208  862.685   26.469  862.685   26.469  862.685   26.469  204.442   3.1407  204.442   3.1407 0.000000 0.000000 
1 1 1    0   14   11 o  207.487   2.2615  888.605   27.355  888.605   27.355  888.605   27.355  207.487   3.1983  207.487   3.1983 0.000000 0.000000 
1 1 1    0   14   12 o  262.133   2.4735  1418.14   37.804  1418.14   37.804  1418.14   37.804  262.133   3.4980  262.133   3.4980 0.000000 0.000000 
1 1 1    0   14   13 f   84.808   3.8102  150.210   18.674  150.210   18.674  150.210   18.674   84.808   5.3884   84.808   5.3884 0.000000 0.000000 
1 1 1    0   14   14 o  691.052   4.8470  9862.62  195.329  9862.62  195.329  9862.62  195.329  691.052   6.8547  691.052   6.8547 0.000000 0.000000 
1 1 1    0   14   15 o  186.143   2.4029  715.492   26.070  715.492   26.070  715.492   26.070  186.143   3.3983  186.143   3.3983 0.000000 0.000000 
1 1 1    0   14   16 o  206.692   2.4663  882.096   29.714  882.096   29.714  882.096   29.714  206.692   3.4878  206.692   3.4878 0.000000 0.000000 
1 1 1    0   14   17 o  181.788   3.7580  683.878   39.771  683.878   39.771  683.878   39.771  181.788   5.3146  181.788   5.3146 0.000000 0.000000 
1 1 1    0   14   18 o  203.611   2.5451  856.161   30.205  856.161   30.205  856.161   30.205  203.611   3.5993  203.611   3.5993 0.000000 0.000000 
1 1 1    0   14   19 o  199.772   2.5829  824.297   30.074  824.297   30.074  824.297   30.074  199.772   3.6527  199.772   3.6527 0.000000 0.000000 
1 1 1    0   14   20 o   36.974   8.7992   36.525   16.957   36.525   16.957   36.525   16.957   36.974   12.444   36.974   12.444 0.000000 0.000000 
1 1 1    0   14   21 o  315.074   2.8738  2050.08   52.793  2050.08   52.793  2050.08   52.793  315.074   4.0641  315.074   4.0641 0.000000 0.000000 
1 1 1    0   14   22 o  194.261   3.0941  780.226   35.019  780.226   35.019  780.226   35.019  194.261   4.3757  194.261   4.3757 0.000000 0.000000 
1 1 1    0   14   23 o   47.081   11.872   60.990   29.743   60.990   29.743   60.990   29.743   47.081   16.790   47.081   16.790 0.000000 0.000000 
1 1 1    0   14   24 o  216.546   3.0691  969.389   38.729  969.389   38.729  969.389   38.729  216.546   4.3403  216.546   4.3403 0.000000 0.000000 
1 1 1    0   14   25 o  369.203   4.3711  2821.21   94.073  2821.21   94.073  2821.21   94.073  369.203   6.1817  369.203   6.1817 0.000000 0.000000 
1 1 1    0   14   26 o   36.899   13.250   42.320   35.664   42.320   35.664   42.320   35.664   36.899   18.738   36.899   18.738 0.000000 0.000000 
1 1 1    0   14   27 o  244.111   3.2491  1232.28   46.226  1232.28   46.226  1232.28   46.226  244.111   4.5950  244.111   4.5950 0.000000 0.000000 
1 1 1    0   14   28 o  141.506   3.2973  415.032   27.148  415.032   27.148  415.032   27.148  141.506   4.6630  141.506   4.6630 0.000000 0.000000 
1 1 1    0   14   29 o   73.885   5.4541  116.799   22.919  116.799   22.919  116.799   22.919   73.885   7.7133   73.885   7.7133 0.000000 0.000000 
1 1 1    0   14   30 o   39.602   10.547   44.294   22.795   44.294   22.795   44.294   22.795   39.602   14.915   39.602   14.915 0.000000 0.000000 
1 1 1    0   14   31 o  170.492   3.5588  602.819   35.321  602.819   35.321  602.819   35.321  170.492   5.0329  170.492   5.0329 0.000000 0.000000 
1 1 1    0   14   32 o   27.517   10.738   22.541   25.095   22.541   25.095   22.541   25.095   27.517   15.186   27.517   15.186 0.000000 0.000000 
1 1 1    0   14   33 o   23.704   10.128   12.216   25.681   12.216   25.681   12.216   25.681   23.704   14.323   23.704   14.323 0.000000 0.000000 
1 1 1    0   14   34 f   99.523   8.4012  218.533   46.933  218.533   46.933  218.533   46.933   99.523   11.881   99.523   11.881 0.000000 0.000000 
1 1 1    0   14   35 o   53.782   11.439   76.831   31.279   76.831   31.279   76.831   31.279   53.782   16.177   53.782   16.177 0.000000 0.000000 
1 1 1    0   14   36 o   68.042   6.2100  102.143   23.516  102.143   23.516  102.143   23.516   68.042   8.7823   68.042   8.7823 0.000000 0.000000 
1 1 1    0   14   37 o   74.407   5.8913  120.956   24.746  120.956   24.746  120.956   24.746   74.407   8.3315   74.407   8.3315 0.000000 0.000000 
1 1 1    0   14   38 o   18.992   8.6524   2.2246   22.136   2.2246   22.136   2.2246   22.136   18.992   12.236   18.992   12.236 0.000000 0.000000 
1 1 1    0   14   39 o   56.014   8.4517   75.916   24.262   75.916   24.262   75.916   24.262   56.014   11.953   56.014   11.953 0.000000 0.000000 
1 1 1    0   14   40 o   26.691   10.729   23.003   25.984   23.003   25.984   23.003   25.984   26.691   15.173   26.691   15.173 0.000000 0.000000 
1 1 1    0   14   41 o   29.903   11.739   30.963   30.187   30.963   30.187   30.963   30.187   29.903   16.601   29.903   16.601 0.000000 0.000000 
1 1 1    0   14   42 o   46.101   11.999   65.092   29.851   65.092   29.851   65.092   29.851   46.101   16.969   46.101   16.969 0.000000 0.000000 
1 1 1    0   14   43 o   18.176   8.6177  -4.4139   25.588  -4.4139   25.588  -4.4139   25.588   18.176   12.187   18.176   12.187 0.000000 0.000000 
1 1 1    0   14   44 o   11.658   5.9570 -36.1014   21.026 -36.1014   21.026 -36.1014   21.026   11.658   8.4245   11.658   8.4245 0.000000 0.000000 
1 1 1    0   14   45 o   92.363   5.2122  188.098   27.669  188.098   27.669  188.098   27.669   92.363   7.3711   92.363   7.3711 0.000000 0.000000 
1 1 1    0   14   46 o   42.765   10.880   57.436   24.844   57.436   24.844   57.436   24.844   42.765   15.386   42.765   15.386 0.000000 0.000000 
1 1 1    0   14   47 o   51.333   14.072   97.240   40.078   97.240   40.078   97.240   40.078   51.333   19.901   51.333   19.901 0.000000 0.000000 
1 1 1    0   14   48 o   21.139   9.7985   9.5146   30.161   9.5146   30.161   9.5146   30.161   21.139   13.857   21.139   13.857 0.000000 0.000000 
1 1 1    0   14   49 o   28.128   13.161   43.063   56.440   43.063   56.440   43.063   56.440   28.128   18.613   28.128   18.613 0.000000 0.000000 
1 1 1    0   15    1 o  173.816   1.9887  623.601   20.150  623.601   20.150  623.601   20.150  173.816   2.8124  173.816   2.8124 0.000000 0.000000 
1 1 1    0   15    2 o  565.877   4.6679  6610.67  154.025  6610.67  154.025  6610.67  154.025  565.877   6.6014  565.877   6.6014 0.000000 0.000000 
1 1 1    0   15    3 f  140.528   4.0540  409.485   33.104  409.485   33.104  409.485   33.104  140.528   5.7332  140.528   5.7332 0.000000 0.000000 
1 1 1    0   15    4 o   74.510   3.7333  116.253   16.038  116.253   16.038  116.253   16.038   74.510   5.2797   74.510   5.2797 0.000000 0.000000 
1 1 1    0   15    5 o  182.750   3.1191  690.146   33.204  690.146   33.204  690.146   33.204  182.750   4.4110  182.750   4.4110 0.000000 0.000000 
1 1 1    0   15    6 o   48.406   6.0129   52.613   15.411   52.613   15.411   52.613   15.411   48.406   8.5035   48.406   8.5035 0.000000 0.000000 
1 1 1    0   15    7 o  413.309   6.4074  3532.52  154.299  3532.52  154.299  3532.52  154.299  413.309   9.0614  413.309   9.0614 0.000000 0.000000 
1 1 1    0   15    8 o  117.298   2.1481  284.352   14.674  284.352   14.674  284.352   14.674  117.298   3.0379  117.298   3.0379 0.000000 0.000000 
1 1 1    0   15    9 o  258.078   2.7845  1374.88   41.893  1374.88   41.893  1374.88   41.893  258.078   3.9378  258.078   3.9378 0.000000 0.000000 
1 1 1    0   15   10 o  196.163   2.5920  794.591   29.634  794.591   29.634  794.591   29.634  196.163   3.6656  196.163   3.6656 0.000000 0.000000 
1 1 1    0   15   11 f  117.806   2.2631  286.902   15.525  286.902   15.525  286.902   15.525  117.806   3.2005  117.806   3.2005 0.000000 0.000000 
1 1 1    0   15   12 o  161.684   2.2429  539.857   21.134  539.857   21.134  539.857   21.134  161.684   3.1719  161.684   3.1719 0.000000 0.000000 
1 1 1    0   15   13 o  116.194   2.6719  279.410   18.065  279.410   18.065  279.410   18.065  116.194   3.7786  116.194   3.7786 0.000000 0.000000 
1 1 1    0   15   14 o   44.311   6.3778   45.248   14.585   45.248   14.585   45.248   14.585   44.311   9.0196   44.311   9.0196 0.000000 0.000000 
1 1 1    0   15   15 o  203.221   2.4300  852.723   28.786  852.723   28.786  852.723   28.786  203.221   3.4366  203.221   3.4366 0.000000 0.000000 
1 1 1    0   15   16 o   68.497   3.9308   98.754   15.467   98.754   15.467   98.754   15.467   68.497   5.5591   68.497   5.5591 0.000000 0.000000 
1 1 1    0   15   17 f   17.347   8.2867 -11.6193   24.515 -11.6193   24.515 -11.6193   24.515   17.347   11.719   17.347   11.719 0.000000 0.000000 
1 1 1    0   15   18 f   75.549   3.9451  119.774   17.167  119.774   17.167  119.774   17.167   75.549   5.5792   75.549   5.5792 0.000000 0.000000 
1 1 1    0   15   19 o  135.238   2.8039  378.451   22.074  378.451   22.074  378.451   22.074  135.238   3.9653  135.238   3.9653 0.000000 0.000000 
1 1 1    0   15   20 o  110.729   3.1454  254.344   20.241  254.344   20.241  254.344   20.241  110.729   4.4483  110.729   4.4483 0.000000 0.000000 
1 1 1    0   15   21 o  138.308   2.8252  395.819   22.749  395.819   22.749  395.819   22.749  138.308   3.9955  138.308   3.9955 0.000000 0.000000 
1 1 1    0   15   22 o  163.332   3.0663  551.954   29.166  551.954   29.166  551.954   29.166  163.332   4.3364  163.332   4.3364 0.000000 0.000000 
1 1 1    0   15   23 o   46.076   8.1611   51.491   18.973   51.491   18.973   51.491   18.973   46.076   11.541   46.076   11.541 0.000000 0.000000 
1 1 1    0   15   24 o  107.458   3.4623  240.018   21.599  240.018   21.599  240.018   21.599  107.458   4.8964  107.458   4.8964 0.000000 0.000000 
1 1 1    0   15   25 o   68.220   5.2669   99.741   20.323   99.741   20.323   99.741   20.323   68.220   7.4485   68.220   7.4485 0.000000 0.000000 
1 1 1    0   15   26 f   62.630   7.3533   87.881   24.636   87.881   24.636   87.881   24.636   62.630   10.399   62.630   10.399 0.000000 0.000000 
1 1 1    0   15   27 o  239.780   4.1871  1191.27   58.481  1191.27   58.481  1191.27   58.481  239.780   5.9215  239.780   5.9215 0.000000 0.000000 
1 1 1    0   15   28 o   23.147   9.9655   10.348   25.261   10.348   25.261   10.348   25.261   23.147   14.093   23.147   14.093 0.000000 0.000000 
1 1 1    0   15   29 o   76.391   6.4666  126.332   27.721  126.332   27.721  126.332   27.721   76.391   9.1451   76.391   9.1451 0.000000 0.000000 
1 1 1    0   15   30 o   21.524   9.4578   6.8712   23.867   6.8712   23.867   6.8712   23.867   21.524   13.375   21.524   13.375 0.000000 0.000000 
1 1 1    0   15   31 f  150.947   3.7341  473.376   32.785  473.376   32.785  473.376   32.785  150.947   5.2808  150.947   5.2808 0.000000 0.000000 
1 1 1    0   15   32 o   79.279   6.2458  135.805   27.965  135.805   27.965  135.805   27.965   79.279   8.8329   79.279   8.8329 0.000000 0.000000 
1 1 1    0   15   33 o   87.660   5.0504  163.177   25.429  163.177   25.429  163.177   25.429   87.660   7.1424   87.660   7.1424 0.000000 0.000000 
1 1 1    0   15   34 o   48.000   11.392   63.541   28.475   63.541   28.475   63.541   28.475   48.000   16.110   48.000   16.110 0.000000 0.000000 
1 1 1    0   15   35 o   91.444   6.3553  181.253   33.146  181.253   33.146  181.253   33.146   91.444   8.9877   91.444   8.9877 0.000000 0.000000 
1 1 1    0   15   36 o   25.610   10.192   19.881   23.138   19.881   23.138   19.881   23.138   25.610   14.413   25.610   14.413 0.000000 0.000000 
1 1 1    0   15   37 o  133.030   3.7708  370.842   29.152  370.842   29.152  370.842   29.152  133.030   5.3327  133.030   5.3327 0.000000 0.000000 
1 1 1    0   15   38 f   30.015   11.025   30.259   25.046   30.259   25.046   30.259   25.046   30.015   15.592   30.015   15.592 0.000000 0.000000 
1 1 1    0   15   39 o   29.305   10.727   28.786   23.645   28.786   23.645   28.786   23.645   29.305   15.170   29.305   15.170 0.000000 0.000000 
1 1 1    0   15   40 f   42.450   13.458   61.655   35.548   61.655   35.548   61.655   35.548   42.450   19.033   42.450   19.033 0.000000 0.000000 
1 1 1    0   15   41 o   22.673   10.349   6.3354   31.879   6.3354   31.879   6.3354   31.879   22.673   14.636   22.673   14.636 0.000000 0.000000 
1 1 1    0   15   42 o   24.648   10.050   19.760   23.273   19.760   23.273   19.760   23.273   24.648   14.213   24.648   14.213 0.000000 0.000000 
1 1 1    0   15   43 o   24.342   9.9340   19.826   22.771   19.826   22.771   19.826   22.771   24.342   14.049   24.342   14.049 0.000000 0.000000 
1 1 1    0   15   44 o   50.451   9.0016   67.055   22.908   67.055   22.908   67.055   22.908   50.451   12.730   50.451   12.730 0.000000 0.000000 
1 1 1    0   15   45 o   17.173   8.1691  -3.8502   23.359  -3.8502   23.359  -3.8502   23.359   17.173   11.553   17.173   11.553 0.000000 0.000000 
1 1 1    0   15   46 o   28.145   10.590   30.728   23.532   30.728   23.532   30.728   23.532   28.145   14.976   28.145   14.976 0.000000 0.000000 
1 1 1    0   15   47 o   38.103   13.532   64.043   36.960   64.043   36.960   64.043   36.960   38.103   19.137   38.103   19.137 0.000000 0.000000 
1 1 1    0   15   48 o   21.721   9.9684   13.296   30.120   13.296   30.120   13.296   30.120   21.721   14.097   21.721   14.097 0.000000 0.000000 
1 1 1    0   15   49 o   23.542   11.572   6.9094   56.207   6.9094   56.207   6.9094   56.207   23.542   16.366   23.542   16.366 0.000000 0.000000 
1 1 1    0   16    0 o  472.015   4.9109  4599.36  135.140  4599.36  135.140  4599.36  135.140  472.015   6.9450  472.015   6.9450 0.000000 0.000000 
1 1 1    0   16    1 o  104.955   1.9198  227.649   11.735  227.649   11.735  227.649   11.735  104.955   2.7150  104.955   2.7150 0.000000 0.000000 
1 1 1    0   16    2 o  343.644   3.1887  2437.36   63.890  2437.36   63.890  2437.36   63.890  343.644   4.5095  343.644   4.5095 0.000000 0.000000 
1 1 1    0   16    3 o  122.066   4.0852  309.499   28.938  309.499   28.938  309.499   28.938  122.066   5.7773  122.066   5.7773 0.000000 0.000000 
1 1 1    0   16    4 o  408.014   4.4365  3437.82  105.528  3437.82  105.528  3437.82  105.528  408.014   6.2742  408.014   6.2742 0.000000 0.000000 
1 1 1    0   16    5 o  304.636   3.7024  1916.44   65.744  1916.44   65.744  1916.44   65.744  304.636   5.2360  304.636   5.2360 0.000000 0.000000 
1 1 1    0   16    6 o  140.265   3.2100  407.157   26.200  407.157   26.200  407.157   26.200  140.265   4.5396  140.265   4.5396 0.000000 0.000000 
1 1 1    0   16    7 o  284.082   5.1717  1669.36   85.567  1669.36   85.567  1669.36   85.567  284.082   7.3139  284.082   7.3139 0.000000 0.000000 
1 1 1    0   16    8 o  125.771   3.4605  327.860   25.299  327.860   25.299  327.860   25.299  125.771   4.8938  125.771   4.8938 0.000000 0.000000 
1 1 1    0   16    9 o   35.037   9.4512   34.449   18.198   34.449   18.198   34.449   18.198   35.037   13.366   35.037   13.366 0.000000 0.000000 
1 1 1    0   16   10 o   81.671   2.9051  138.650   13.759  138.650   13.759  138.650   13.759   81.671   4.1084   81.671   4.1084 0.000000 0.000000 
1 1 1    0   16   11 o  279.360   2.9577  1611.22   48.170  1611.22   48.170  1611.22   48.170  279.360   4.1828  279.360   4.1828 0.000000 0.000000 
1 1 1    0   16   12 o  258.407   2.8766  1378.72   43.334  1378.72   43.334  1378.72   43.334  258.407   4.0682  258.407   4.0682 0.000000 0.000000 
1 1 1    0   16   13 o  169.350   2.5593  592.482   25.255  592.482   25.255  592.482   25.255  169.350   3.6194  169.350   3.6194 0.000000 0.000000 
1 1 1    0   16   14 o   39.853   7.0753   38.412   14.226   38.412   14.226   38.412   14.226   39.853   10.006   39.853   10.006 0.000000 0.000000 
1 1 1    0   16   15 f  130.194   2.5588  350.536   19.398  350.536   19.398  350.536   19.398  130.194   3.6187  130.194   3.6187 0.000000 0.000000 
1 1 1    0   16   16 o   64.937   4.4772   89.552   16.588   89.552   16.588   89.552   16.588   64.937   6.3318   64.937   6.3318 0.000000 0.000000 
1 1 1    0   16   17 o   34.386   8.0269   31.316   14.304   31.316   14.304   31.316   14.304   34.386   11.352   34.386   11.352 0.000000 0.000000 
1 1 1    0   16   18 o  293.372   3.2121  1778.17   54.935  1778.17   54.935  1778.17   54.935  293.372   4.5425  293.372   4.5425 0.000000 0.000000 
1 1 1    0   16   19 o   35.223   8.4949   33.319   15.659   33.319   15.659   33.319   15.659   35.223   12.014   35.223   12.014 0.000000 0.000000 
1 1 1    0   16   20 o   86.920   3.6894  157.713   18.551  157.713   18.551  157.713   18.551   86.920   5.2176   86.920   5.2176 0.000000 0.000000 
1 1 1    0   16   21 o   94.675   3.4717  186.612   19.054  186.612   19.054  186.612   19.054   94.675   4.9098   94.675   4.9098 0.000000 0.000000 
1 1 1    0   16   22 f  132.086   3.2640  361.610   25.078  361.610   25.078  361.610   25.078  132.086   4.6160  132.086   4.6160 0.000000 0.000000 
1 1 1    0   16   23 o   66.957   4.7748   95.535   18.213   95.535   18.213   95.535   18.213   66.957   6.7525   66.957   6.7525 0.000000 0.000000 
1 1 1    0   16   24 o  188.135   3.0883  732.147   33.848  732.147   33.848  732.147   33.848  188.135   4.3675  188.135   4.3675 0.000000 0.000000 
1 1 1    0   16   25 o  101.449   4.3214  215.165   25.359  215.165   25.359  215.165   25.359  101.449   6.1114  101.449   6.1114 0.000000 0.000000 
1 1 1    0   16   26 o   89.640   4.1562  168.297   21.516  168.297   21.516  168.297   21.516   89.640   5.8777   89.640   5.8777 0.000000 0.000000 
1 1 1    0   16   27 o  266.563   4.3779  1472.74   67.985  1472.74   67.985  1472.74   67.985  266.563   6.1912  266.563   6.1912 0.000000 0.000000 
1 1 1    0   16   28 f   80.421   5.0153  137.077   23.105  137.077   23.105  137.077   23.105   80.421   7.0927   80.421   7.0927 0.000000 0.000000 
1 1 1    0   16   29 o  106.200   4.0774  235.495   25.087  235.495   25.087  235.495   25.087  106.200   5.7663  106.200   5.7663 0.000000 0.000000 
1 1 1    0   16   30 o   36.338   10.824   39.347   23.127   39.347   23.127   39.347   23.127   36.338   15.308   36.338   15.308 0.000000 0.000000 
1 1 1    0   16   31 o   65.372   6.5932   94.356   23.660   94.356   23.660   94.356   23.660   65.372   9.3242   65.372   9.3242 0.000000 0.000000 
1 1 1    0   16   32 o  172.127   3.5905  615.506   35.977  615.506   35.977  615.506   35.977  172.127   5.0777  172.127   5.0777 0.000000 0.000000 
1 1 1    0   16   33 o   30.498   11.428   29.625   27.317   29.625   27.317   29.625   27.317   30.498   16.162   30.498   16.162 0.000000 0.000000 
1 1 1    0   16   34 o   37.424   12.074   44.715   28.644   44.715   28.644   44.715   28.644   37.424   17.075   37.424   17.075 0.000000 0.000000 
1 1 1    0   16   35 o   80.232   6.8704  141.903   30.898  141.903   30.898  141.903   30.898   80.232   9.7162   80.232   9.7162 0.000000 0.000000 
1 1 1    0   16   36 o   17.407   8.3736 -11.8649   25.925 -11.8649   25.925 -11.8649   25.925   17.407   11.842   17.407   11.842 0.000000 0.000000 
1 1 1    0   16   37 o   88.978   7.6026  177.531   37.927  177.531   37.927  177.531   37.927   88.978   10.752   88.978   10.752 0.000000 0.000000 
1 1 1    0   16   38 o   28.722   11.189   27.252   27.189   27.252   27.189   27.252   27.189   28.722   15.823   28.722   15.823 0.000000 0.000000 
1 1 1    0   16   39 o   34.829   10.981   39.548   23.672   39.548   23.672   39.548   23.672   34.829   15.530   34.829   15.530 0.000000 0.000000 
1 1 1    0   16   40 o   15.774   7.7699 -19.9970   25.704 -19.9970   25.704 -19.9970   25.704   15.774   10.988   15.774   10.988 0.000000 0.000000 
1 1 1    0   16   41 o   17.892   8.3874  -2.3827   23.093  -2.3827   23.093  -2.3827   23.093   17.892   11.862   17.892   11.862 0.000000 0.000000 
1 1 1    0   16   42 o   36.927   10.682   43.817   22.674   43.817   22.674   43.817   22.674   36.927   15.107   36.927   15.107 0.000000 0.000000 
1 1 1    0   16   43 o   14.715   7.3986 -30.9253   27.352 -30.9253   27.352 -30.9253   27.352   14.715   10.463   14.715   10.463 0.000000 0.000000 
1 1 1    0   16   44 o   10.468   5.4457 -61.3132   23.203 -61.3132   23.203 -61.3132   23.203   10.468   7.7014   10.468   7.7014 0.000000 0.000000 
1 1 1    0   16   45 o   29.816   10.702   33.454   23.265   33.454   23.265   33.454   23.265   29.816   15.135   29.816   15.135 0.000000 0.000000 
1 1 1    0   16   46 o   20.119   9.4705   3.3618   29.951   3.3618   29.951   3.3618   29.951   20.119   13.393   20.119   13.393 0.000000 0.000000 
1 1 1    0   16   47 o   36.075   13.249   59.639   36.162   59.639   36.162   59.639   36.162   36.075   18.737   36.075   18.737 0.000000 0.000000 
1 1 1    0   16   48 o   18.077   8.7224  -2.9699   28.588  -2.9699   28.588  -2.9699   28.588   18.077   12.335   18.077   12.335 0.000000 0.000000 
1 1 1    0   17    1 o  111.068   2.2240  255.059   14.382  255.059   14.382  255.059   14.382  111.068   3.1452  111.068   3.1452 0.000000 0.000000 
1 1 1    0   17    2 o  472.627   3.5023  4610.39   96.527  4610.39   96.527  4610.39   96.527  472.627   4.9530  472.627   4.9530 0.000000 0.000000 
1 1 1    0   17    3 o  404.918   6.2174  3391.57  146.689  3391.57  146.689  3391.57  146.689  404.918   8.7928  404.918   8.7928 0.000000 0.000000 
1 1 1    0   17    4 o  435.502   4.6662  3917.73  118.470  3917.73  118.470  3917.73  118.470  435.502   6.5990  435.502   6.5990 0.000000 0.000000 
1 1 1    0   17    5 o   71.441   4.1626  107.461   17.075  107.461   17.075  107.461   17.075   71.441   5.8868   71.441   5.8868 0.000000 0.000000 
1 1 1    0   17    6 o  205.583   3.2554  873.337   38.993  873.337   38.993  873.337   38.993  205.583   4.6038  205.583   4.6038 0.000000 0.000000 
1 1 1    0   17    7 o  372.496   4.2365  2866.15   91.994  2866.15   91.994  2866.15   91.994  372.496   5.9914  372.496   5.9914 0.000000 0.000000 
1 1 1    0   17    8 o  350.455   4.0905  2537.05   83.564  2537.05   83.564  2537.05   83.564  350.455   5.7848  350.455   5.7848 0.000000 0.000000 
1 1 1    0   17    9 o  259.388   3.5734  1390.06   54.017  1390.06   54.017  1390.06   54.017  259.388   5.0535  259.388   5.0535 0.000000 0.000000 
1 1 1    0   17   10 o  171.175   2.1102  604.964   21.055  604.964   21.055  604.964   21.055  171.175   2.9843  171.175   2.9843 0.000000 0.000000 
1 1 1    0   17   11 o   68.321   3.3760   97.730   13.303   97.730   13.303   97.730   13.303   68.321   4.7745   68.321   4.7745 0.000000 0.000000 
1 1 1    0   17   12 o  133.858   3.0566  370.888   23.808  370.888   23.808  370.888   23.808  133.858   4.3226  133.858   4.3226 0.000000 0.000000 
1 1 1    0   17   13 o  136.968   2.7972  388.062   22.305  388.062   22.305  388.062   22.305  136.968   3.9558  136.968   3.9558 0.000000 0.000000 
1 1 1    0   17   14 o  125.984   2.4149  328.189   17.716  328.189   17.716  328.189   17.716  125.984   3.4151  125.984   3.4151 0.000000 0.000000 
1 1 1    0   17   15 o   65.627   4.2139   91.128   15.825   91.128   15.825   91.128   15.825   65.627   5.9594   65.627   5.9594 0.000000 0.000000 
1 1 1    0   17   16 o   17.662   7.4877   6.5951   13.818   6.5951   13.818   6.5951   13.818   17.662   10.589   17.662   10.589 0.000000 0.000000 
1 1 1    0   17   17 o  216.551   2.4871  968.485   31.397  968.485   31.397  968.485   31.397  216.551   3.5173  216.551   3.5173 0.000000 0.000000 
1 1 1    0   17   18 o   60.555   6.1968   80.506   20.554   80.506   20.554   80.506   20.554   60.555   8.7637   60.555   8.7637 0.000000 0.000000 
1 1 1    0   17   19 f  178.827   2.5515  660.777   26.590  660.777   26.590  660.777   26.590  178.827   3.6084  178.827   3.6084 0.000000 0.000000 
1 1 1    0   17   20 o  469.371   3.5811  4552.39   98.016  4552.39   98.016  4552.39   98.016  469.371   5.0644  469.371   5.0644 0.000000 0.000000 
1 1 1    0   17   21 o  275.939   3.1531  1573.53   50.719  1573.53   50.719  1573.53   50.719  275.939   4.4591  275.939   4.4591 0.000000 0.000000 
1 1 1    0   17   22 o  253.951   2.7289  1332.31   40.401  1332.31   40.401  1332.31   40.401  253.951   3.8593  253.951   3.8593 0.000000 0.000000 
1 1 1    0   17   23 o  175.878   2.7042  639.517   27.712  639.517   27.712  639.517   27.712  175.878   3.8243  175.878   3.8243 0.000000 0.000000 
1 1 1    0   17   24 o   15.974   7.4855  -4.6202   18.367  -4.6202   18.367  -4.6202   18.367   15.974   10.586   15.974   10.586 0.000000 0.000000 
1 1 1    0   17   25 o   89.651   4.6758  169.022   24.145  169.022   24.145  169.022   24.145   89.651   6.6125   89.651   6.6125 0.000000 0.000000 
1 1 1    0   17   26 f   32.296   9.9377   31.195   19.403   31.195   19.403   31.195   19.403   32.296   14.054   32.296   14.054 0.000000 0.000000 
1 1 1    0   17   27 o  186.043   3.6040  717.131   39.043  717.131   39.043  717.131   39.043  186.043   5.0969  186.043   5.0969 0.000000 0.000000 
1 1 1    0   17   28 o   61.879   6.5285   84.712   22.018   84.712   22.018   84.712   22.018   61.879   9.2327   61.879   9.2327 0.000000 0.000000 
1 1 1    0   17   29 o  102.255   4.1163  218.635   24.369  218.635   24.369  218.635   24.369  102.255   5.8214  102.255   5.8214 0.000000 0.000000 
1 1 1    0   17   30 o   49.351   9.8755   61.953   24.620   61.953   24.620   61.953   24.620   49.351   13.966   49.351   13.966 0.000000 0.000000 
1 1 1    0   17   31 o   94.520   4.5914  188.169   25.039  188.169   25.039  188.169   25.039   94.520   6.4933   94.520   6.4933 0.000000 0.000000 
1 1 1    0   17   32 o   55.450   8.2606   72.690   23.517   72.690   23.517   72.690   23.517   55.450   11.682   55.450   11.682 0.000000 0.000000 
1 1 1    0   17   33 f   20.250   9.4364  -3.4669   28.538  -3.4669   28.538  -3.4669   28.538   20.250   13.345   20.250   13.345 0.000000 0.000000 
1 1 1    0   17   34 o   57.312   10.456   83.168   30.210   83.168   30.210   83.168   30.210   57.312   14.787   57.312   14.787 0.000000 0.000000 
1 1 1    0   17   35 o   16.707   7.9738  -8.6156   22.602  -8.6156   22.602  -8.6156   22.602   16.707   11.277   16.707   11.277 0.000000 0.000000 
1 1 1    0   17   36 o   77.018   9.0362  138.842   37.233  138.842   37.233  138.842   37.233   77.018   12.779   77.018   12.779 0.000000 0.000000 
1 1 1    0   17   37 o   22.180   9.4907   12.095   22.614   12.095   22.614   12.095   22.614   22.180   13.422   22.180   13.422 0.000000 0.000000 
1 1 1    0   17   38 o   23.445   9.8714   15.219   23.692   15.219   23.692   15.219   23.692   23.445   13.960   23.445   13.960 0.000000 0.000000 
1 1 1    0   17   39 o   25.837   10.166   21.907   22.698   21.907   22.698   21.907   22.698   25.837   14.376   25.837   14.376 0.000000 0.000000 
1 1 1    0   17   40 o   31.455   11.620   35.208   27.943   35.208   27.943   35.208   27.943   31.455   16.433   31.455   16.433 0.000000 0.000000 
1 1 1    0   17   41 o   14.670   7.3136 -24.4713   24.865 -24.4713   24.865 -24.4713   24.865   14.670   10.343   14.670   10.343 0.000000 0.000000 
1 1 1    0   17   42 o   32.870   11.761   40.019   28.044   40.019   28.044   40.019   28.044   32.870   16.633   32.870   16.633 0.000000 0.000000 
1 1 1    0   17   43 o   27.276   12.463   21.818   46.399   21.818   46.399   21.818   46.399   27.276   17.626   27.276   17.626 0.000000 0.000000 
1 1 1    0   17   44 o   19.345   8.8651   5.1264   23.704   5.1264   23.704   5.1264   23.704   19.345   12.537   19.345   12.537 0.000000 0.000000 
1 1 1    0   17   45 o   24.326   10.068   21.882   23.908   21.882   23.908   21.882   23.908   24.326   14.239   24.326   14.239 0.000000 0.000000 
1 1 1    0   17   46 o   17.730   8.6414  -9.7476   29.708  -9.7476   29.708  -9.7476   29.708   17.730   12.221   17.730   12.221 0.000000 0.000000 
1 1 1    0   17   47 o   14.794   7.4880 -32.0585   29.856 -32.0585   29.856 -32.0585   29.856   14.794   10.590   14.794   10.590 0.000000 0.000000 
1 1 1    0   17   48 o   20.433   9.5209   9.3383   29.038   9.3383   29.038   9.3383   29.038   20.433   13.465   20.433   13.465 0.000000 0.000000 
1 1 1    0   18    0 o  484.693   5.0232  4850.90  141.944  4850.90  141.944  4850.90  141.944  484.693   7.1038  484.693   7.1038 0.000000 0.000000 
1 1 1    0   18    1 o  219.993   2.1768  998.880   27.920  998.880   27.920  998.880   27.920  219.993   3.0784  219.993   3.0784 0.000000 0.000000 
1 1 1    0   18    2 o  331.642   2.6922  2269.89   52.063  2269.89   52.063  2269.89   52.063  331.642   3.8074  331.642   3.8074 0.000000 0.000000 
1 1 1    0   18    3 o  378.234   5.9328  2959.92  130.743  2959.92  130.743  2959.92  130.743  378.234   8.3902  378.234   8.3902 0.000000 0.000000 
1 1 1    0   18    4 o   91.852   3.5680  175.671   18.984  175.671   18.984  175.671   18.984   91.852   5.0459   91.852   5.0459 0.000000 0.000000 
1 1 1    0   18    5 o  397.151   4.3962  3258.55  101.782  3258.55  101.782  3258.55  101.782  397.151   6.2171  397.151   6.2171 0.000000 0.000000 
1 1 1    0   18    6 o   57.356   9.8990   79.107   28.690   79.107   28.690   79.107   28.690   57.356   13.999   57.356   13.999 0.000000 0.000000 
1 1 1    0   18    7 f  393.854   4.3948  3205.05  100.904  3205.05  100.904  3205.05  100.904  393.854   6.2151  393.854   6.2151 0.000000 0.000000 
1 1 1    0   18    8 o  255.215   3.5682  1345.86   53.070  1345.86   53.070  1345.86   53.070  255.215   5.0461  255.215   5.0461 0.000000 0.000000 
1 1 1    0   18    9 o  101.622   4.2399  215.423   24.931  215.423   24.931  215.423   24.931  101.622   5.9961  101.622   5.9961 0.000000 0.000000 
1 1 1    0   18   10 o  170.452   3.4966  601.162   34.698  601.162   34.698  601.162   34.698  170.452   4.9450  170.452   4.9450 0.000000 0.000000 
1 1 1    0   18   11 o  184.202   2.1678  700.545   23.277  700.545   23.277  700.545   23.277  184.202   3.0657  184.202   3.0657 0.000000 0.000000 
1 1 1    0   18   12 o  103.735   3.1560  223.320   19.016  223.320   19.016  223.320   19.016  103.735   4.4633  103.735   4.4633 0.000000 0.000000 
1 1 1    0   18   13 o  270.098   2.4785  1506.00   39.033  1506.00   39.033  1506.00   39.033  270.098   3.5052  270.098   3.5052 0.000000 0.000000 
1 1 1    0   18   14 o  101.188   3.3454  212.766   19.646  212.766   19.646  212.766   19.646  101.188   4.7311  101.188   4.7311 0.000000 0.000000 
1 1 1    0   18   15 o   13.525   6.2667  -1.8505   12.318  -1.8505   12.318  -1.8505   12.318   13.525   8.8625   13.525   8.8625 0.000000 0.000000 
1 1 1    0   18   16 o  171.747   2.7126  609.695   27.143  609.695   27.143  609.695   27.143  171.747   3.8362  171.747   3.8362 0.000000 0.000000 
1 1 1    0   18   17 o   18.008   7.3607   8.2974   12.532   8.2974   12.532   8.2974   12.532   18.008   10.410   18.008   10.410 0.000000 0.000000 
1 1 1    0   18   18 o  250.301   2.5773  1293.85   37.610  1293.85   37.610  1293.85   37.610  250.301   3.6449  250.301   3.6449 0.000000 0.000000 
1 1 1    0   18   19 o  164.375   3.1489  559.147   30.141  559.147   30.141  559.147   30.141  164.375   4.4533  164.375   4.4533 0.000000 0.000000 
1 1 1    0   18   20 o  118.974   2.8899  293.264   20.001  293.264   20.001  293.264   20.001  118.974   4.0869  118.974   4.0869 0.000000 0.000000 
1 1 1    0   18   21 o   20.754   8.4095   11.460   16.136   11.460   16.136   11.460   16.136   20.754   11.893   20.754   11.893 0.000000 0.000000 
1 1 1    0   18   22 o  109.320   3.2166  248.119   20.430  248.119   20.430  248.119   20.430  109.320   4.5490  109.320   4.5490 0.000000 0.000000 
1 1 1    0   18   23 o  234.085   3.0782  1132.91   41.996  1132.91   41.996  1132.91   41.996  234.085   4.3532  234.085   4.3532 0.000000 0.000000 
1 1 1    0   18   24 o  117.461   3.3827  286.477   23.089  286.477   23.089  286.477   23.089  117.461   4.7839  117.461   4.7839 0.000000 0.000000 
1 1 1    0   18   25 o  117.966   3.3735  288.967   23.126  288.967   23.126  288.967   23.126  117.966   4.7709  117.966   4.7709 0.000000 0.000000 
1 1 1    0   18   26 o   78.483   4.6862  130.231   21.100  130.231   21.100  130.231   21.100   78.483   6.6272   78.483   6.6272 0.000000 0.000000 
1 1 1    0   18   27 o   78.989   4.8120  132.143   21.792  132.143   21.792  132.143   21.792   78.989   6.8051   78.989   6.8051 0.000000 0.000000 
1 1 1    0   18   28 o   47.206   11.475   60.976   28.417   60.976   28.417   60.976   28.417   47.206   16.228   47.206   16.228 0.000000 0.000000 
1 1 1    0   18   29 o   67.992   5.8029  100.290   22.124  100.290   22.124  100.290   22.124   67.992   8.2065   67.992   8.2065 0.000000 0.000000 
1 1 1    0   18   30 o  141.723   3.4969  417.409   28.827  417.409   28.827  417.409   28.827  141.723   4.9454  141.723   4.9454 0.000000 0.000000 
1 1 1    0   18   31 o   71.048   5.8785  109.735   23.489  109.735   23.489  109.735   23.489   71.048   8.3134   71.048   8.3134 0.000000 0.000000 
1 1 1    0   18   32 o  163.680   3.3169  556.923   31.608  556.923   31.608  556.923   31.608  163.680   4.6908  163.680   4.6908 0.000000 0.000000 
1 1 1    0   18   33 o   19.735   8.9395   2.7635   23.213   2.7635   23.213   2.7635   23.213   19.735   12.642   19.735   12.642 0.000000 0.000000 
1 1 1    0   18   34 o   36.713   10.543   40.603   22.133   40.603   22.133   40.603   22.133   36.713   14.910   36.713   14.910 0.000000 0.000000 
1 1 1    0   18   35 o   17.534   8.1967  -3.0091   21.809  -3.0091   21.809  -3.0091   21.809   17.534   11.592   17.534   11.592 0.000000 0.000000 
1 1 1    0   18   36 f   13.397   6.8237 -44.0798   26.556 -44.0798   26.556 -44.0798   26.556   13.397   9.6502   13.397   9.6502 0.000000 0.000000 
1 1 1    0   18   37 o   19.363   8.8807   1.4399   23.856   1.4399   23.856   1.4399   23.856   19.363   12.559   19.363   12.559 0.000000 0.000000 
1 1 1    0   18   38 o   36.089   10.771   41.290   22.890   41.290   22.890   41.290   22.890   36.089   15.232   36.089   15.232 0.000000 0.000000 
1 1 1    0   18   39 o   29.697   10.669   30.377   23.131   30.377   23.131   30.377   23.131   29.697   15.088   29.697   15.088 0.000000 0.000000 
1 1 1    0   18   40 o   26.315   10.239   23.660   22.740   23.660   22.740   23.660   22.740   26.315   14.481   26.315   14.481 0.000000 0.000000 
1 1 1    0   18   41 o   14.126   7.0623 -24.6973   23.732 -24.6973   23.732 -24.6973   23.732   14.126   9.9877   14.126   9.9877 0.000000 0.000000 
1 1 1    0   18   42 o   53.025   8.3772   71.110   22.629   71.110   22.629   71.110   22.629   53.025   11.847   53.025   11.847 0.000000 0.000000 
1 1 1    0   18   43 o   16.863   8.0212  -3.9164   22.514  -3.9164   22.514  -3.9164   22.514   16.863   11.344   16.863   11.344 0.000000 0.000000 
1 1 1    0   18   44 o   19.695   8.8885   7.8944   22.691   7.8944   22.691   7.8944   22.691   19.695   12.570   19.695   12.570 0.000000 0.000000 
1 1 1    0   18   45 o   27.378   10.641   30.064   24.530   30.064   24.530   30.064   24.530   27.378   15.049   27.378   15.049 0.000000 0.000000 
1 1 1    0   18   46 o   38.001   12.630   59.525   31.469   59.525   31.469   59.525   31.469   38.001   17.862   38.001   17.862 0.000000 0.000000 
1 1 1    0   18   47 o   19.859   9.3528   6.0827   29.273   6.0827   29.273   6.0827   29.273   19.859   13.227   19.859   13.227 0.000000 0.000000 
1 1 1    0   19    1 o  366.733   2.8773  2775.99   61.531  2775.99   61.531  2775.99   61.531  366.733   4.0691  366.733   4.0691 0.000000 0.000000 
1 1 1    0   19    2 o   77.955   2.5600  126.180   11.583  126.180   11.583  126.180   11.583   77.955   3.6204   77.955   3.6204 0.000000 0.000000 
1 1 1    0   19    3 o  231.474   3.2719  1107.00   44.136  1107.00   44.136  1107.00   44.136  231.474   4.6272  231.474   4.6272 0.000000 0.000000 
1 1 1    0   19    4 o   18.902   7.8017   8.7701   14.291   8.7701   14.291   8.7701   14.291   18.902   11.033   18.902   11.033 0.000000 0.000000 
1 1 1    0   19    5 o  277.013   3.5913  1585.37   57.983  1585.37   57.983  1585.37   57.983  277.013   5.0788  277.013   5.0788 0.000000 0.000000 
1 1 1    0   19    6 o  185.101   4.8789  710.615   52.510  710.615   52.510  710.615   52.510  185.101   6.8998  185.101   6.8998 0.000000 0.000000 
1 1 1    0   19    7 o   69.455   5.1778  102.938   20.443  102.938   20.443  102.938   20.443   69.455   7.3225   69.455   7.3225 0.000000 0.000000 
1 1 1    0   19    8 o  240.696   3.5135  1197.35   49.280  1197.35   49.280  1197.35   49.280  240.696   4.9688  240.696   4.9688 0.000000 0.000000 
1 1 1    0   19    9 f  211.596   3.4723  925.677   42.804  925.677   42.804  925.677   42.804  211.596   4.9106  211.596   4.9106 0.000000 0.000000 
1 1 1    0   19   10 o  166.960   3.4734  576.917   33.759  576.917   33.759  576.917   33.759  166.960   4.9121  166.960   4.9121 0.000000 0.000000 
1 1 1    0   19   11 o  368.271   2.9893  2800.19   64.193  2800.19   64.193  2800.19   64.193  368.271   4.2275  368.271   4.2275 0.000000 0.000000 
1 1 1    0   19   12 o  214.850   2.5144  953.326   31.490  953.326   31.490  953.326   31.490  214.850   3.5559  214.850   3.5559 0.000000 0.000000 
1 1 1    0   19   13 o  278.382   2.5199  1600.05   40.901  1600.05   40.901  1600.05   40.901  278.382   3.5636  278.382   3.5636 0.000000 0.000000 
1 1 1    0   19   14 o   35.479   3.4972   27.462   6.8350   27.462   6.8350   27.462   6.8350   35.479   4.9458   35.479   4.9458 0.000000 0.000000 
1 1 1    0   19   15 o   42.809   6.6032   42.901   14.444   42.901   14.444   42.901   14.444   42.809   9.3384   42.809   9.3384 0.000000 0.000000 
1 1 1    0   19   16 o  213.218   2.8114  939.363   34.937  939.363   34.937  939.363   34.937  213.218   3.9759  213.218   3.9759 0.000000 0.000000 
1 1 1    0   19   17 o  142.958   2.4673  422.544   20.546  422.544   20.546  422.544   20.546  142.958   3.4893  142.958   3.4893 0.000000 0.000000 
1 1 1    0   19   18 o  168.848   2.4373  589.132   23.981  589.132   23.981  589.132   23.981  168.848   3.4468  168.848   3.4468 0.000000 0.000000 
1 1 1    0   19   19 o   79.276   4.8753  132.945   22.151  132.945   22.151  132.945   22.151   79.276   6.8947   79.276   6.8947 0.000000 0.000000 
1 1 1    0   19   20 o  429.713   3.3735  3815.89   84.532  3815.89   84.532  3815.89   84.532  429.713   4.7709  429.713   4.7709 0.000000 0.000000 
1 1 1    0   19   21 o  250.097   2.9767  1292.75   43.395  1292.75   43.395  1292.75   43.395  250.097   4.2097  250.097   4.2097 0.000000 0.000000 
1 1 1    0   19   22 f   61.043   4.9333   80.092   16.972   80.092   16.972   80.092   16.972   61.043   6.9768   61.043   6.9768 0.000000 0.000000 
1 1 1    0   19   23 o  124.519   3.0783  321.423   22.296  321.423   22.296  321.423   22.296  124.519   4.3534  124.519   4.3534 0.000000 0.000000 
1 1 1    0   19   24 o   92.188   4.4533  178.322   23.690  178.322   23.690  178.322   23.690   92.188   6.2980   92.188   6.2980 0.000000 0.000000 
1 1 1    0   19   25 o   62.579   6.4575   86.329   22.104   86.329   22.104   86.329   22.104   62.579   9.1323   62.579   9.1323 0.000000 0.000000 
1 1 1    0   19   26 o  219.371   3.2401  996.024   41.418  996.024   41.418  996.024   41.418  219.371   4.5822  219.371   4.5822 0.000000 0.000000 
1 1 1    0   19   27 o  105.361   3.8850  231.656   23.727  231.656   23.727  231.656   23.727  105.361   5.4942  105.361   5.4942 0.000000 0.000000 
1 1 1    0   19   28 o   22.623   9.9835   7.3519   26.885   7.3519   26.885   7.3519   26.885   22.623   14.119   22.623   14.119 0.000000 0.000000 
1 1 1    0   19   29 o  148.694   3.7425  459.797   32.366  459.797   32.366  459.797   32.366  148.694   5.2927  148.694   5.2927 0.000000 0.000000 
1 1 1    0   19   30 o   73.988   5.9220  118.738   24.713  118.738   24.713  118.738   24.713   73.988   8.3750   73.988   8.3750 0.000000 0.000000 
1 1 1    0   19   31 o   94.692   4.4184  189.079   24.160  189.079   24.160  189.079   24.160   94.692   6.2486   94.692   6.2486 0.000000 0.000000 
1 1 1    0   19   32 o  123.160   4.5524  319.124   32.499  319.124   32.499  319.124   32.499  123.160   6.4381  123.160   6.4381 0.000000 0.000000 
1 1 1    0   19   33 o   61.769   6.6202   85.754   22.229   85.754   22.229   85.754   22.229   61.769   9.3623   61.769   9.3623 0.000000 0.000000 
1 1 1    0   19   34 o   17.174   8.0376  -3.2529   21.068  -3.2529   21.068  -3.2529   21.068   17.174   11.367   17.174   11.367 0.000000 0.000000 
1 1 1    0   19   35 o   42.344   10.024   50.070   22.087   50.070   22.087   50.070   22.087   42.344   14.175   42.344   14.175 0.000000 0.000000 
1 1 1    0   19   36 o   17.611   8.2408  -3.0972   22.133  -3.0972   22.133  -3.0972   22.133   17.611   11.654   17.611   11.654 0.000000 0.000000 
1 1 1    0   19   37 o   15.622   7.6238 -14.9208   23.297 -14.9208   23.297 -14.9208   23.297   15.622   10.782   15.622   10.782 0.000000 0.000000 
1 1 1    0   19   38 f   17.272   8.1091  -3.1208   21.720  -3.1208   21.720  -3.1208   21.720   17.272   11.468   17.272   11.468 0.000000 0.000000 
1 1 1    0   19   39 o   21.600   9.7268   7.5797   26.986   7.5797   26.986   7.5797   26.986   21.600   13.756   21.600   13.756 0.000000 0.000000 
1 1 1    0   19   40 o   18.142   8.3827   1.2740   21.819   1.2740   21.819   1.2740   21.819   18.142   11.855   18.142   11.855 0.000000 0.000000 
1 1 1    0   19   41 o   16.784   8.0010  -5.4957   22.629  -5.4957   22.629  -5.4957   22.629   16.784   11.315   16.784   11.315 0.000000 0.000000 
1 1 1    0   19   42 o   30.226   10.339   32.861   21.242   32.861   21.242   32.861   21.242   30.226   14.622   30.226   14.622 0.000000 0.000000 
1 1 1    0   19   43 o   15.515   7.5659 -11.5003   22.851 -11.5003   22.851 -11.5003   22.851   15.515   10.700   15.515   10.700 0.000000 0.000000 
1 1 1    0   19   44 o   19.105   9.1324  -2.2653   29.860  -2.2653   29.860  -2.2653   29.860   19.105   12.915   19.105   12.915 0.000000 0.000000 
1 1 1    0   19   45 o   15.569   7.7861 -23.8259   28.914 -23.8259   28.914 -23.8259   28.914   15.569   11.011   15.569   11.011 0.000000 0.000000 
1 1 1    0   19   46 o   21.422   9.8208   13.038   29.131   13.038   29.131   13.038   29.131   21.422   13.889   21.422   13.889 0.000000 0.000000 
1 1 1    0   20    0 o  315.159   3.7112  2051.04   68.179  2051.04   68.179  2051.04   68.179  315.159   5.2484  315.159   5.2484 0.000000 0.000000 
1 1 1    0   20    1 f   33.891   3.3374   25.045   6.2315   25.045   6.2315   25.045   6.2315   33.891   4.7199   33.891   4.7199 0.000000 0.000000 
1 1 1    0   20    2 o  256.427   3.2665  1358.40   48.821  1358.40   48.821  1358.40   48.821  256.427   4.6195  256.427   4.6195 0.000000 0.000000 
1 1 1    0   20    3 o  534.708   5.4836  5913.23  170.947  5913.23  170.947  5913.23  170.947  534.708   7.7550  534.708   7.7550 0.000000 0.000000 
1 1 1    0   20    4 o  342.115   3.9813  2418.61   79.398  2418.61   79.398  2418.61   79.398  342.115   5.6304  342.115   5.6304 0.000000 0.000000 
1 1 1    0   20    5 o  179.459   3.2465  666.005   33.933  666.005   33.933  666.005   33.933  179.459   4.5913  179.459   4.5913 0.000000 0.000000 
1 1 1    0   20    6 o   57.426   10.733   81.207   31.060   81.207   31.060   81.207   31.060   57.426   15.179   57.426   15.179 0.000000 0.000000 
1 1 1    0   20    7 o  105.956   3.9009  233.691   23.959  233.691   23.959  233.691   23.959  105.956   5.5167  105.956   5.5167 0.000000 0.000000 
1 1 1    0   20    8 o  321.802   3.9298  2140.47   73.713  2140.47   73.713  2140.47   73.713  321.802   5.5575  321.802   5.5575 0.000000 0.000000 
1 1 1    0   20    9 o   41.334   9.4411   44.958   20.110   44.958   20.110   44.958   20.110   41.334   13.352   41.334   13.352 0.000000 0.000000 
1 1 1    0   20   10 o  335.945   4.0602  2333.59   79.509  2333.59   79.509  2333.59   79.509  335.945   5.7420  335.945   5.7420 0.000000 0.000000 
1 1 1    0   20   11 o  222.162   4.8435  1023.34   62.629  1023.34   62.629  1023.34   62.629  222.162   6.8497  222.162   6.8497 0.000000 0.000000 
1 1 1    0   20   12 o  410.708   3.7096  3485.50   88.836  3485.50   88.836  3485.50   88.836  410.708   5.2462  410.708   5.2462 0.000000 0.000000 
1 1 1    0   20   13 o  414.343   3.2066  3545.69   77.477  3545.69   77.477  3545.69   77.477  414.343   4.5348  414.343   4.5348 0.000000 0.000000 
1 1 1    0   20   14 o  488.427   3.6238  4928.78  103.213  4928.78  103.213  4928.78  103.213  488.427   5.1248  488.427   5.1248 0.000000 0.000000 
1 1 1    0   20   15 o  159.888   3.2783  529.243   30.515  529.243   30.515  529.243   30.515  159.888   4.6362  159.888   4.6362 0.000000 0.000000 
1 1 1    0   20   16 o  208.422   2.7865  897.702   33.848  897.702   33.848  897.702   33.848  208.422   3.9406  208.422   3.9406 0.000000 0.000000 
1 1 1    0   20   17 o  271.398   3.0159  1521.98   47.716  1521.98   47.716  1521.98   47.716  271.398   4.2652  271.398   4.2652 0.000000 0.000000 
1 1 1    0   20   18 o   72.966   3.4026  111.405   14.337  111.405   14.337  111.405   14.337   72.966   4.8120   72.966   4.8120 0.000000 0.000000 
1 1 1    0   20   19 o  230.756   2.9265  1100.58   39.362  1100.58   39.362  1100.58   39.362  230.756   4.1388  230.756   4.1388 0.000000 0.000000 
1 1 1    0   20   20 o  197.605   4.0144  809.299   46.183  809.299   46.183  809.299   46.183  197.605   5.6772  197.605   5.6772 0.000000 0.000000 
1 1 1    0   20   21 o   95.948   3.3586  191.587   18.691  191.587   18.691  191.587   18.691   95.948   4.7498   95.948   4.7498 0.000000 0.000000 
1 1 1    0   20   22 o   23.787   8.7040   17.258   15.564   17.258   15.564   17.258   15.564   23.787   12.309   23.787   12.309 0.000000 0.000000 
1 1 1    0   20   23 o   67.942   4.6425   98.197   18.004   98.197   18.004   98.197   18.004   67.942   6.5656   67.942   6.5656 0.000000 0.000000 
1 1 1    0   20   24 o  132.668   4.1797  366.362   32.198  366.362   32.198  366.362   32.198  132.668   5.9110  132.668   5.9110 0.000000 0.000000 
1 1 1    0   20   25 f  164.494   4.4943  563.048   42.976  563.048   42.976  563.048   42.976  164.494   6.3560  164.494   6.3560 0.000000 0.000000 
1 1 1    0   20   26 o  139.671   3.5816  405.213   29.091  405.213   29.091  405.213   29.091  139.671   5.0651  139.671   5.0651 0.000000 0.000000 
1 1 1    0   20   27 o   80.181   5.1475  136.818   23.617  136.818   23.617  136.818   23.617   80.181   7.2796   80.181   7.2796 0.000000 0.000000 
1 1 1    0   20   28 o   20.574   8.8863   8.1611   20.234   8.1611   20.234   8.1611   20.234   20.574   12.567   20.574   12.567 0.000000 0.000000 
1 1 1    0   20   29 o  121.429   5.4074  311.392   37.951  311.392   37.951  311.392   37.951  121.429   7.6472  121.429   7.6472 0.000000 0.000000 
1 1 1    0   20   30 o  120.404   3.6278  302.528   25.373  302.528   25.373  302.528   25.373  120.404   5.1305  120.404   5.1305 0.000000 0.000000 
1 1 1    0   20   31 o   95.425   4.2897  192.034   23.655  192.034   23.655  192.034   23.655   95.425   6.0666   95.425   6.0666 0.000000 0.000000 
1 1 1    0   20   32 o  130.584   4.7897  359.292   36.258  359.292   36.258  359.292   36.258  130.584   6.7737  130.584   6.7737 0.000000 0.000000 
1 1 1    0   20   33 o  110.459   3.7369  256.078   23.951  256.078   23.951  256.078   23.951  110.459   5.2848  110.459   5.2848 0.000000 0.000000 
1 1 1    0   20   34 o   76.547   5.4811  127.410   23.897  127.410   23.897  127.410   23.897   76.547   7.7514   76.547   7.7514 0.000000 0.000000 
1 1 1    0   20   35 o   20.822   8.9350   10.197   20.157   10.197   20.157   10.197   20.157   20.822   12.636   20.822   12.636 0.000000 0.000000 
1 1 1    0   20   36 f   37.599   10.645   43.512   22.658   43.512   22.658   43.512   22.658   37.599   15.054   37.599   15.054 0.000000 0.000000 
1 1 1    0   20   37 o   64.868   8.9659  101.985   30.215  101.985   30.215  101.985   30.215   64.868   12.680   64.868   12.680 0.000000 0.000000 
1 1 1    0   20   38 o   61.674   7.0210   88.231   23.294   88.231   23.294   88.231   23.294   61.674   9.9292   61.674   9.9292 0.000000 0.000000 
1 1 1    0   20   39 o   61.306   8.5503   92.208   27.190   92.208   27.190   92.208   27.190   61.306   12.092   61.306   12.092 0.000000 0.000000 
1 1 1    0   20   40 o   28.450   10.331   28.864   21.821   28.864   21.821   28.864   21.821   28.450   14.610   28.450   14.610 0.000000 0.000000 
1 1 1    0   20   41 o   42.143   9.7661   51.702   21.283   51.702   21.283   51.702   21.283   42.143   13.811   42.143   13.811 0.000000 0.000000 
1 1 1    0   20   42 o   23.409   9.5147   19.139   20.758   19.139   20.758   19.139   20.758   23.409   13.456   23.409   13.456 0.000000 0.000000 
1 1 1    0   20   43 o   17.986   8.3990   1.5626   22.797   1.5626   22.797   1.5626   22.797   17.986   11.878   17.986   11.878 0.000000 0.000000 
1 1 1    0   20   44 o   39.925   12.891   63.389   32.654   63.389   32.654   63.389   32.654   39.925   18.230   39.925   18.230 0.000000 0.000000 
1 1 1    0   20   45 o   13.767   7.0105 -36.7956   27.935 -36.7956   27.935 -36.7956   27.935   13.767   9.9144   13.767   9.9144 0.000000 0.000000 
1 1 1    0   20   46 o   23.201   10.362   20.629   29.914   20.629   29.914   20.629   29.914   23.201   14.654   23.201   14.654 0.000000 0.000000 
1 1 1    0   21    1 o  162.859   2.7100  548.235   25.711  548.235   25.711  548.235   25.711  162.859   3.8325  162.859   3.8325 0.000000 0.000000 
1 1 1    0   21    2 o   68.142   4.6892   98.635   18.232   98.635   18.232   98.635   18.232   68.142   6.6315   68.142   6.6315 0.000000 0.000000 
1 1 1    0   21    3 o  256.617   3.4205  1360.98   51.158  1360.98   51.158  1360.98   51.158  256.617   4.8373  256.617   4.8373 0.000000 0.000000 
1 1 1    0   21    4 o  441.795   4.7329  4036.81  121.900  4036.81  121.900  4036.81  121.900  441.795   6.6933  441.795   6.6933 0.000000 0.000000 
1 1 1    0   21    5 o   92.746   3.8722  179.509   20.781  179.509   20.781  179.509   20.781   92.746   5.4762   92.746   5.4762 0.000000 0.000000 
1 1 1    0   21    6 f  419.723   4.5928  3643.84  112.379  3643.84  112.379  3643.84  112.379  419.723   6.4952  419.723   6.4952 0.000000 0.000000 
1 1 1    0   21    7 o  289.402   3.7096  1731.50   62.573  1731.50   62.573  1731.50   62.573  289.402   5.2461  289.402   5.2461 0.000000 0.000000 
1 1 1    0   21    8 o  120.143   3.7238  299.830   25.982  299.830   25.982  299.830   25.982  120.143   5.2663  120.143   5.2663 0.000000 0.000000 
1 1 1    0   21    9 o   74.999   4.9850  119.344   21.364  119.344   21.364  119.344   21.364   74.999   7.0499   74.999   7.0499 0.000000 0.000000 
1 1 1    0   21   10 o   92.049   4.4603  177.554   23.689  177.554   23.689  177.554   23.689   92.049   6.3078   92.049   6.3078 0.000000 0.000000 
1 1 1    0   21   11 o   39.012   11.565   44.766   26.423   44.766   26.423   44.766   26.423   39.012   16.356   39.012   16.356 0.000000 0.000000 
1 1 1    0   21   12 o  232.402   3.6295  1117.22   49.147  1117.22   49.147  1117.22   49.147  232.402   5.1329  232.402   5.1329 0.000000 0.000000 
1 1 1    0   21   13 f  166.391   3.6524  573.582   35.371  573.582   35.371  573.582   35.371  166.391   5.1653  166.391   5.1653 0.000000 0.000000 
1 1 1    0   21   14 o   67.532   3.2607   95.487   12.707   95.487   12.707   95.487   12.707   67.532   4.6113   67.532   4.6113 0.000000 0.000000 
1 1 1    0   21   15 o  177.108   2.4750  648.164   25.545  648.164   25.545  648.164   25.545  177.108   3.5001  177.108   3.5001 0.000000 0.000000 
1 1 1    0   21   16 o   83.093   3.2018  143.861   15.413  143.861   15.413  143.861   15.413   83.093   4.5280   83.093   4.5280 0.000000 0.000000 
1 1 1    0   21   17 o  128.668   2.8814  342.864   21.576  342.864   21.576  342.864   21.576  128.668   4.0749  128.668   4.0749 0.000000 0.000000 
1 1 1    0   21   18 o   55.096   4.1316   64.847   12.936   64.847   12.936   64.847   12.936   55.096   5.8430   55.096   5.8430 0.000000 0.000000 
1 1 1    0   21   19 o  109.773   2.8152  249.799   17.971  249.799   17.971  249.799   17.971  109.773   3.9812  109.773   3.9812 0.000000 0.000000 
1 1 1    0   21   20 o   14.947   7.2565 -14.0204   20.472 -14.0204   20.472 -14.0204   20.472   14.947   10.262   14.947   10.262 0.000000 0.000000 
1 1 1    0   21   21 o   81.681   3.7139  139.619   17.526  139.619   17.526  139.619   17.526   81.681   5.2522   81.681   5.2522 0.000000 0.000000 
1 1 1    0   21   22 o   24.662   10.018   16.310   22.989   16.310   22.989   16.310   22.989   24.662   14.167   24.662   14.167 0.000000 0.000000 
1 1 1    0   21   23 o   10.017   5.1806 -46.8956   18.879 -46.8956   18.879 -46.8956   18.879   10.017   7.3265   10.017   7.3265 0.000000 0.000000 
1 1 1    0   21   24 o   10.232   5.2387 -32.8767   16.656 -32.8767   16.656 -32.8767   16.656   10.232   7.4086   10.232   7.4086 0.000000 0.000000 
1 1 1    0   21   25 o   38.990   9.0339   40.538   18.213   40.538   18.213   40.538   18.213   38.990   12.776   38.990   12.776 0.000000 0.000000 
1 1 1    0   21   26 o   25.902   9.8213   20.439   20.389   20.439   20.389   20.439   20.389   25.902   13.889   25.902   13.889 0.000000 0.000000 
1 1 1    0   21   27 o   14.045   6.8498 -13.8032   18.741 -13.8032   18.741 -13.8032   18.741   14.045   9.6870   14.045   9.6870 0.000000 0.000000 
1 1 1    0   21   28 o   16.295   7.6537  -4.6852   19.379  -4.6852   19.379  -4.6852   19.379   16.295   10.824   16.295   10.824 0.000000 0.000000 
1 1 1    0   21   29 o   25.751   10.589   18.464   26.179   18.464   26.179   18.464   26.179   25.751   14.975   25.751   14.975 0.000000 0.000000 
1 1 1    0   21   30 o   79.214   4.7585  133.845   21.621  133.845   21.621  133.845   21.621   79.214   6.7295   79.214   6.7295 0.000000 0.000000 
1 1 1    0   21   31 o   17.129   8.1524  -8.2988   23.316  -8.2988   23.316  -8.2988   23.316   17.129   11.529   17.129   11.529 0.000000 0.000000 
1 1 1    0   21   32 o   20.996   8.9270   10.795   19.754   10.795   19.754   10.795   19.754   20.996   12.625   20.996   12.625 0.000000 0.000000 
1 1 1    0   21   33 o   39.008   9.8878   43.631   20.566   43.631   20.566   43.631   20.566   39.008   13.984   39.008   13.984 0.000000 0.000000 
1 1 1    0   21   34 o   30.127   10.693   30.242   23.075   30.242   23.075   30.242   23.075   30.127   15.123   30.127   15.123 0.000000 0.000000 
1 1 1    0   21   35 o   30.739   10.138   30.935   20.242   30.935   20.242   30.935   20.242   30.739   14.337   30.739   14.337 0.000000 0.000000 
1 1 1    0   21   36 o   18.056   8.3685  -0.4732   21.993  -0.4732   21.993  -0.4732   21.993   18.056   11.835   18.056   11.835 0.000000 0.000000 
1 1 1    0   21   37 o   17.590   8.5085 -12.5278   27.582 -12.5278   27.582 -12.5278   27.582   17.590   12.033   17.590   12.033 0.000000 0.000000 
1 1 1    0   21   38 o   13.466   6.7590 -26.3036   22.491 -26.3036   22.491 -26.3036   22.491   13.466   9.5586   13.466   9.5586 0.000000 0.000000 
1 1 1    0   21   39 o   17.086   8.0623  -3.0773   21.937  -3.0773   21.937  -3.0773   21.937   17.086   11.402   17.086   11.402 0.000000 0.000000 
1 1 1    0   21   40 o   18.449   8.4524   3.6059   21.531   3.6059   21.531   3.6059   21.531   18.449   11.954   18.449   11.954 0.000000 0.000000 
1 1 1    0   21   41 o   14.624   7.1275 -10.7689   20.212 -10.7689   20.212 -10.7689   20.212   14.624   10.080   14.624   10.080 0.000000 0.000000 
1 1 1    0   21   42 o   63.762   7.7614   99.713   26.299   99.713   26.299   99.713   26.299   63.762   10.976   63.762   10.976 0.000000 0.000000 
1 1 1    0   21   43 o   17.305   8.1746  -0.6157   22.662  -0.6157   22.662  -0.6157   22.662   17.305   11.561   17.305   11.561 0.000000 0.000000 
1 1 1    0   21   44 o   15.232   7.6718 -28.7711   29.886 -28.7711   29.886 -28.7711   29.886   15.232   10.850   15.232   10.850 0.000000 0.000000 
1 1 1    0   21   45 o   14.120   7.1579 -31.4325   27.718 -31.4325   27.718 -31.4325   27.718   14.120   10.123   14.120   10.123 0.000000 0.000000 
1 1 1    0   22    1 o   63.271   1.8033   82.985   6.6305   82.985   6.6305   82.985   6.6305   63.271   2.5503   63.271   2.5503 0.000000 0.000000 
1 1 1    0   22    2 o   85.408   4.1632  152.841   20.513  152.841   20.513  152.841   20.513   85.408   5.8876   85.408   5.8876 0.000000 0.000000 
1 1 1    0   22    3 o   87.733   3.5171  160.470   17.866  160.470   17.866  160.470   17.866   87.733   4.9739   87.733   4.9739 0.000000 0.000000 
1 1 1    0   22    4 o   65.076   4.4640   89.956   16.578   89.956   16.578   89.956   16.578   65.076   6.3130   65.076   6.3130 0.000000 0.000000 
1 1 1    0   22    5 o  356.518   5.9012  2635.44  122.564  2635.44  122.564  2635.44  122.564  356.518   8.3455  356.518   8.3455 0.000000 0.000000 
1 1 1    0   22    6 o  330.895   3.9458  2263.73   76.107  2263.73   76.107  2263.73   76.107  330.895   5.5802  330.895   5.5802 0.000000 0.000000 
1 1 1    0   22    7 o  118.504   3.5434  291.553   24.393  291.553   24.393  291.553   24.393  118.504   5.0111  118.504   5.0111 0.000000 0.000000 
1 1 1    0   22    8 o  317.719   3.9075  2087.26   72.365  2087.26   72.365  2087.26   72.365  317.719   5.5261  317.719   5.5261 0.000000 0.000000 
1 1 1    0   22    9 o   10.191   5.2307 -35.9335   17.160 -35.9335   17.160 -35.9335   17.160   10.191   7.3973   10.191   7.3973 0.000000 0.000000 
1 1 1    0   22   10 o   79.408   4.8962  133.368   22.281  133.368   22.281  133.368   22.281   79.408   6.9243   79.408   6.9243 0.000000 0.000000 
1 1 1    0   22   11 o   27.962   10.704   23.212   24.434   23.212   24.434   23.212   24.434   27.962   15.137   27.962   15.137 0.000000 0.000000 
1 1 1    0   22   12 o  189.938   3.5262  746.740   39.005  746.740   39.005  746.740   39.005  189.938   4.9868  189.938   4.9868 0.000000 0.000000 
1 1 1    0   22   13 o  131.261   3.9595  358.025   30.189  358.025   30.189  358.025   30.189  131.261   5.5995  131.261   5.5995 0.000000 0.000000 
1 1 1    0   22   14 o  202.119   3.1936  844.997   37.608  844.997   37.608  844.997   37.608  202.119   4.5164  202.119   4.5164 0.000000 0.000000 
1 1 1    0   22   15 o   83.936   2.9783  146.576   14.497  146.576   14.497  146.576   14.497   83.936   4.2119   83.936   4.2119 0.000000 0.000000 
1 1 1    0   22   16 o  170.450   2.7639  600.800   27.446  600.800   27.446  600.800   27.446  170.450   3.9087  170.450   3.9087 0.000000 0.000000 
1 1 1    0   22   17 o  106.354   3.0652  234.775   18.943  234.775   18.943  234.775   18.943  106.354   4.3348  106.354   4.3348 0.000000 0.000000 
1 1 1    0   22   18 o   20.483   9.3178   0.7320   25.546   0.7320   25.546   0.7320   25.546   20.483   13.177   20.483   13.177 0.000000 0.000000 
1 1 1    0   22   19 o  144.928   3.0168  434.966   25.452  434.966   25.452  434.966   25.452  144.928   4.2664  144.928   4.2664 0.000000 0.000000 
1 1 1    0   22   20 o   26.825   9.0170   22.052   16.085   22.052   16.085   22.052   16.085   26.825   12.752   26.825   12.752 0.000000 0.000000 
1 1 1    0   22   21 o   19.295   8.5742   4.0849   20.196   4.0849   20.196   4.0849   20.196   19.295   12.126   19.295   12.126 0.000000 0.000000 
1 1 1    0   22   22 o  149.428   3.1993  462.770   27.827  462.770   27.827  462.770   27.827  149.428   4.5245  149.428   4.5245 0.000000 0.000000 
1 1 1    0   22   23 o   82.333   4.5231  142.994   21.420  142.994   21.420  142.994   21.420   82.333   6.3966   82.333   6.3966 0.000000 0.000000 
1 1 1    0   22   24 o   51.770   6.3882   60.594   17.531   60.594   17.531   60.594   17.531   51.770   9.0343   51.770   9.0343 0.000000 0.000000 
1 1 1    0   22   25 o  112.251   3.3477  262.105   21.830  262.105   21.830  262.105   21.830  112.251   4.7344  112.251   4.7344 0.000000 0.000000 
1 1 1    0   22   26 o   28.788   9.4616   25.667   17.625   25.667   17.625   25.667   17.625   28.788   13.381   28.788   13.381 0.000000 0.000000 
1 1 1    0   22   27 o   16.259   7.5516  -2.3919   18.048  -2.3919   18.048  -2.3919   18.048   16.259   10.680   16.259   10.680 0.000000 0.000000 
1 1 1    0   22   28 o  140.599   3.5074  411.762   28.683  411.762   28.683  411.762   28.683  140.599   4.9602  140.599   4.9602 0.000000 0.000000 
1 1 1    0   22   29 o   11.100   5.6670 -34.2306   18.829 -34.2306   18.829 -34.2306   18.829   11.100   8.0143   11.100   8.0143 0.000000 0.000000 
1 1 1    0   22   30 o   22.637   9.2598   14.375   19.856   14.375   19.856   14.375   19.856   22.637   13.095   22.637   13.095 0.000000 0.000000 
1 1 1    0   22   31 o   66.521   6.9043   99.984   25.098   99.984   25.098   99.984   25.098   66.521   9.7642   66.521   9.7642 0.000000 0.000000 
1 1 1    0   22   32 o   44.459   9.1982   52.117   20.717   52.117   20.717   52.117   20.717   44.459   13.008   44.459   13.008 0.000000 0.000000 
1 1 1    0   22   33 o   41.722   9.7705   48.297   21.145   48.297   21.145   48.297   21.145   41.722   13.818   41.722   13.818 0.000000 0.000000 
1 1 1    0   22   34 o   9.9860   5.1772 -50.0621   19.662 -50.0621   19.662 -50.0621   19.662   9.9860   7.3217   9.9860   7.3217 0.000000 0.000000 
1 1 1    0   22   35 o   39.426   10.668   46.953   23.157   46.953   23.157   46.953   23.157   39.426   15.088   39.426   15.088 0.000000 0.000000 
1 1 1    0   22   36 o   29.404   10.332   29.513   21.442   29.513   21.442   29.513   21.442   29.404   14.611   29.404   14.611 0.000000 0.000000 
1 1 1    0   22   37 o   18.642   8.4886   3.4914   21.270   3.4914   21.270   3.4914   21.270   18.642   12.005   18.642   12.005 0.000000 0.000000 
1 1 1    0   22   38 o   39.634   13.974   61.712   39.278   61.712   39.278   61.712   39.278   39.634   19.762   39.634   19.762 0.000000 0.000000 
1 1 1    0   22   39 o   12.213   6.1842 -28.4509   20.454 -28.4509   20.454 -28.4509   20.454   12.213   8.7458   12.213   8.7458 0.000000 0.000000 
1 1 1    0   22   40 o   15.770   7.5271  -4.8696   20.144  -4.8696   20.144  -4.8696   20.144   15.770   10.645   15.770   10.645 0.000000 0.000000 
1 1 1    0   22   41 o   16.659   7.8084  -0.5084   20.004  -0.5084   20.004  -0.5084   20.004   16.659   11.043   16.659   11.043 0.000000 0.000000 
1 1 1    0   22   42 o   40.584   10.695   53.579   23.568   53.579   23.568   53.579   23.568   40.584   15.126   40.584   15.126 0.000000 0.000000 
1 1 1    0   22   43 o   22.028   9.4820   16.837   22.862   16.837   22.862   16.837   22.862   22.028   13.410   22.028   13.410 0.000000 0.000000 
1 1 1    0   22   44 o   13.510   6.8904 -37.3537   27.489 -37.3537   27.489 -37.3537   27.489   13.510   9.7445   13.510   9.7445 0.000000 0.000000 
1 1 1    0   23    1 o  127.677   2.2040  336.966   16.392  336.966   16.392  336.966   16.392  127.677   3.1170  127.677   3.1170 0.000000 0.000000 
1 1 1    0   23    2 o  127.465   3.9021  337.542   28.888  337.542   28.888  337.542   28.888  127.465   5.5185  127.465   5.5185 0.000000 0.000000 
1 1 1    0   23    3 o  105.780   3.2067  232.308   19.702  232.308   19.702  232.308   19.702  105.780   4.5349  105.780   4.5349 0.000000 0.000000 
1 1 1    0   23    4 o   50.813   5.5419   57.087   15.263   57.087   15.263   57.087   15.263   50.813   7.8375   50.813   7.8375 0.000000 0.000000 
1 1 1    0   23    5 o   55.718   10.633   77.169   29.868   77.169   29.868   77.169   29.868   55.718   15.038   55.718   15.038 0.000000 0.000000 
1 1 1    0   23    6 o  193.684   3.2827  776.031   37.037  776.031   37.037  776.031   37.037  193.684   4.6424  193.684   4.6424 0.000000 0.000000 
1 1 1    0   23    7 o  105.350   3.7161  230.997   22.705  230.997   22.705  230.997   22.705  105.350   5.2554  105.350   5.2554 0.000000 0.000000 
1 1 1    0   23    8 o   67.742   5.2354   98.304   20.059   98.304   20.059   98.304   20.059   67.742   7.4040   67.742   7.4040 0.000000 0.000000 
1 1 1    0   23    9 o  377.180   4.3336  2943.54   95.284  2943.54   95.284  2943.54   95.284  377.180   6.1286  377.180   6.1286 0.000000 0.000000 
1 1 1    0   23   10 o   59.706   6.5620   79.029   21.208   79.029   21.208   79.029   21.208   59.706   9.2801   59.706   9.2801 0.000000 0.000000 
1 1 1    0   23   11 o   62.565   6.4646   86.174   22.119   86.174   22.119   86.174   22.119   62.565   9.1423   62.565   9.1423 0.000000 0.000000 
1 1 1    0   23   12 o   81.439   5.1553  140.562   24.037  140.562   24.037  140.562   24.037   81.439   7.2907   81.439   7.2907 0.000000 0.000000 
1 1 1    0   23   13 o   35.680   10.496   37.374   21.791   37.374   21.791   37.374   21.791   35.680   14.844   35.680   14.844 0.000000 0.000000 
1 1 1    0   23   14 o  126.949   6.8328  340.479   49.921  340.479   49.921  340.479   49.921  126.949   9.6631  126.949   9.6631 0.000000 0.000000 
1 1 1    0   23   15 o   70.539   3.0239  103.888   12.337  103.888   12.337  103.888   12.337   70.539   4.2765   70.539   4.2765 0.000000 0.000000 
1 1 1    0   23   16 f   27.158   4.1488   17.208   5.7647   17.208   5.7647   17.208   5.7647   27.158   5.8673   27.158   5.8673 0.000000 0.000000 
1 1 1    0   23   17 o   58.590   2.6320   71.728   8.9116   71.728   8.9116   71.728   8.9116   58.590   3.7222   58.590   3.7222 0.000000 0.000000 
1 1 1    0   23   18 o   65.749   3.9362   91.295   14.847   91.295   14.847   91.295   14.847   65.749   5.5667   65.749   5.5667 0.000000 0.000000 
1 1 1    0   23   19 o   16.279   5.7250   8.0841   6.5862   8.0841   6.5862   8.0841   6.5862   16.279   8.0964   16.279   8.0964 0.000000 0.000000 
1 1 1    0   23   20 o  102.807   2.4677  218.995   14.759  218.995   14.759  218.995   14.759  102.807   3.4899  102.807   3.4899 0.000000 0.000000 
1 1 1    0   23   21 o   18.363   7.7354   7.6487   14.560   7.6487   14.560   7.6487   14.560   18.363   10.940   18.363   10.940 0.000000 0.000000 
1 1 1    0   23   22 o   42.547   10.033   48.745   22.187   48.745   22.187   48.745   22.187   42.547   14.189   42.547   14.189 0.000000 0.000000 
1 1 1    0   23   23 o   45.600   7.6719   50.051   17.710   50.051   17.710   50.051   17.710   45.600   10.850   45.600   10.850 0.000000 0.000000 
1 1 1    0   23   24 o  136.518   2.9797  386.533   23.676  386.533   23.676  386.533   23.676  136.518   4.2140  136.518   4.2140 0.000000 0.000000 
1 1 1    0   23   25 o   99.478   3.5117  206.612   20.260  206.612   20.260  206.612   20.260   99.478   4.9663   99.478   4.9663 0.000000 0.000000 
1 1 1    0   23   26 o   22.542   8.7250   15.333   16.412   15.333   16.412   15.333   16.412   22.542   12.339   22.542   12.339 0.000000 0.000000 
1 1 1    0   23   27 o   92.339   4.2392  179.720   22.611  179.720   22.611  179.720   22.611   92.339   5.9951   92.339   5.9951 0.000000 0.000000 
1 1 1    0   23   28 o   18.330   8.1755   4.0648   18.550   4.0648   18.550   4.0648   18.550   18.330   11.562   18.330   11.562 0.000000 0.000000 
1 1 1    0   23   29 o   12.046   6.0329 -21.5608   17.563 -21.5608   17.563 -21.5608   17.563   12.046   8.5318   12.046   8.5318 0.000000 0.000000 
1 1 1    0   23   30 o   71.240   7.1137  114.521   27.862  114.521   27.862  114.521   27.862   71.240   10.060   71.240   10.060 0.000000 0.000000 
1 1 1    0   23   31 o   15.543   7.3785  -5.9191   18.866  -5.9191   18.866  -5.9191   18.866   15.543   10.435   15.543   10.435 0.000000 0.000000 
1 1 1    0   23   32 o   20.110   8.7147   8.6860   19.606   8.6860   19.606   8.6860   19.606   20.110   12.325   20.110   12.325 0.000000 0.000000 
1 1 1    0   23   33 o   21.508   9.0373   12.574   19.787   12.574   19.787   12.574   19.787   21.508   12.781   21.508   12.781 0.000000 0.000000 
1 1 1    0   23   34 o  106.502   3.9251  239.530   24.232  239.530   24.232  239.530   24.232  106.502   5.5509  106.502   5.5509 0.000000 0.000000 
1 1 1    0   23   35 o   44.710   10.610   57.455   24.703   57.455   24.703   57.455   24.703   44.710   15.005   44.710   15.005 0.000000 0.000000 
1 1 1    0   23   36 o   11.932   6.0513 -29.7233   19.912 -29.7233   19.912 -29.7233   19.912   11.932   8.5578   11.932   8.5578 0.000000 0.000000 
1 1 1    0   23   37 o   47.983   8.8459   60.301   21.393   60.301   21.393   60.301   21.393   47.983   12.510   47.983   12.510 0.000000 0.000000 
1 1 1    0   23   38 o   17.679   8.4432  -5.8289   25.423  -5.8289   25.423  -5.8289   25.423   17.679   11.941   17.679   11.941 0.000000 0.000000 
1 1 1    0   23   39 o   22.619   9.2997   17.365   20.186   17.365   20.186   17.365   20.186   22.619   13.152   22.619   13.152 0.000000 0.000000 
1 1 1    0   23   40 o   24.428   9.5561   21.632   19.927   21.632   19.927   21.632   19.927   24.428   13.514   24.428   13.514 0.000000 0.000000 
1 1 1    0   23   41 o   15.743   7.5535  -5.1954   20.820  -5.1954   20.820  -5.1954   20.820   15.743   10.682   15.743   10.682 0.000000 0.000000 
1 1 1    0   23   42 o   16.515   7.8866  -3.2684   22.172  -3.2684   22.172  -3.2684   22.172   16.515   11.153   16.515   11.153 0.000000 0.000000 
1 1 1    0   23   43 o   18.399   8.5988   4.1600   23.979   4.1600   23.979   4.1600   23.979   18.399   12.161   18.399   12.161 0.000000 0.000000 
1 1 1    0   23   44 o   15.253   7.5845 -17.1055   26.214 -17.1055   26.214 -17.1055   26.214   15.253   10.726   15.253   10.726 0.000000 0.000000 
1 1 1    0   24    1 o  174.708   1.9706  630.258   20.070  630.258   20.070  630.258   20.070  174.708   2.7869  174.708   2.7869 0.000000 0.000000 
1 1 1    0   24    2 o   32.420   7.8914   28.337   13.428   28.337   13.428   28.337   13.428   32.420   11.160   32.420   11.160 0.000000 0.000000 
1 1 1    0   24    3 o  117.709   3.0924  287.278   21.166  287.278   21.166  287.278   21.166  117.709   4.3734  117.709   4.3734 0.000000 0.000000 
1 1 1    0   24    4 o  103.488   3.3670  222.598   20.226  222.598   20.226  222.598   20.226  103.488   4.7616  103.488   4.7616 0.000000 0.000000 
1 1 1    0   24    5 o   34.567   12.062   36.955   29.145   36.955   29.145   36.955   29.145   34.567   17.059   34.567   17.059 0.000000 0.000000 
1 1 1    0   24    6 o  378.752   4.2900  2968.42   94.721  2968.42   94.721  2968.42   94.721  378.752   6.0670  378.752   6.0670 0.000000 0.000000 
1 1 1    0   24    7 o  141.829   3.4274  416.992   28.278  416.992   28.278  416.992   28.278  141.829   4.8470  141.829   4.8470 0.000000 0.000000 
1 1 1    0   24    8 o  106.948   3.8307  238.199   23.757  238.199   23.757  238.199   23.757  106.948   5.4175  106.948   5.4175 0.000000 0.000000 
1 1 1    0   24    9 o   44.068   8.8349   48.926   19.671   48.926   19.671   48.926   19.671   44.068   12.494   44.068   12.494 0.000000 0.000000 
1 1 1    0   24   10 o   84.514   5.9542  152.400   28.683  152.400   28.683  152.400   28.683   84.514   8.4205   84.514   8.4205 0.000000 0.000000 
1 1 1    0   24   11 o  138.939   3.7865  400.760   30.583  400.760   30.583  400.760   30.583  138.939   5.3550  138.939   5.3550 0.000000 0.000000 
1 1 1    0   24   12 o  115.568   4.2062  278.393   28.182  278.393   28.182  278.393   28.182  115.568   5.9484  115.568   5.9484 0.000000 0.000000 
1 1 1    0   24   13 o   14.772   7.2299 -17.3652   21.342 -17.3652   21.342 -17.3652   21.342   14.772   10.225   14.772   10.225 0.000000 0.000000 
1 1 1    0   24   14 o   36.165   13.925   39.539   41.581   39.539   41.581   39.539   41.581   36.165   19.693   36.165   19.693 0.000000 0.000000 
1 1 1    0   24   15 o   75.529   6.2597  123.167   26.586  123.167   26.586  123.167   26.586   75.529   8.8525   75.529   8.8525 0.000000 0.000000 
1 1 1    0   24   16 o  173.861   2.7008  625.097   27.359  625.097   27.359  625.097   27.359  173.861   3.8195  173.861   3.8195 0.000000 0.000000 
1 1 1    0   24   17 o  148.666   2.3522  456.946   20.374  456.946   20.374  456.946   20.374  148.666   3.3265  148.666   3.3265 0.000000 0.000000 
1 1 1    0   24   18 o  130.035   2.2387  349.685   16.957  349.685   16.957  349.685   16.957  130.035   3.1660  130.035   3.1660 0.000000 0.000000 
1 1 1    0   24   19 o   25.945   7.8933   19.996   12.255   19.996   12.255   19.996   12.255   25.945   11.163   25.945   11.163 0.000000 0.000000 
1 1 1    0   24   20 o   27.618   5.1857   18.779   7.2176   18.779   7.2176   18.779   7.2176   27.618   7.3337   27.618   7.3337 0.000000 0.000000 
1 1 1    0   24   21 o   73.404   4.1596  113.774   17.546  113.774   17.546  113.774   17.546   73.404   5.8826   73.404   5.8826 0.000000 0.000000 
1 1 1    0   24   22 o   21.039   6.3839   13.115   8.0199   13.115   8.0199   13.115   8.0199   21.039   9.0282   21.039   9.0282 0.000000 0.000000 
1 1 1    0   24   23 o   72.104   4.4733  110.433   18.480  110.433   18.480  110.433   18.480   72.104   6.3262   72.104   6.3262 0.000000 0.000000 
1 1 1    0   24   24 o  104.008   3.6626  226.011   22.094  226.011   22.094  226.011   22.094  104.008   5.1797  104.008   5.1797 0.000000 0.000000 
1 1 1    0   24   25 o   21.993   8.4220   14.740   15.132   14.740   15.132   14.740   15.132   21.993   11.910   21.993   11.910 0.000000 0.000000 
1 1 1    0   24   26 o   40.582   8.0742   42.034   16.546   42.034   16.546   42.034   16.546   40.582   11.419   40.582   11.419 0.000000 0.000000 
1 1 1    0   24   27 o   57.009   6.0517   72.666   18.786   72.666   18.786   72.666   18.786   57.009   8.5584   57.009   8.5584 0.000000 0.000000 
1 1 1    0   24   28 o   25.959   9.5209   21.674   18.656   21.674   18.656   21.674   18.656   25.959   13.465   25.959   13.465 0.000000 0.000000 
1 1 1    0   24   29 o   27.297   9.2183   23.941   16.831   23.941   16.831   23.941   16.831   27.297   13.037   27.297   13.037 0.000000 0.000000 
1 1 1    0   24   30 o   67.837   6.2865  102.566   23.691  102.566   23.691  102.566   23.691   67.837   8.8904   67.837   8.8904 0.000000 0.000000 
1 1 1    0   24   31 o   57.895   9.1852   82.483   27.077   82.483   27.077   82.483   27.077   57.895   12.990   57.895   12.990 0.000000 0.000000 
1 1 1    0   24   32 f   14.227   6.9120 -11.2590   18.656 -11.2590   18.656 -11.2590   18.656   14.227   9.7750   14.227   9.7750 0.000000 0.000000 
1 1 1    0   24   33 o   24.970   9.6057   20.520   19.768   20.520   19.768   20.520   19.768   24.970   13.585   24.970   13.585 0.000000 0.000000 
1 1 1    0   24   34 o   57.884   6.8633   77.896   21.214   77.896   21.214   77.896   21.214   57.884   9.7061   57.884   9.7061 0.000000 0.000000 
1 1 1    0   24   35 o   22.297   9.1887   15.262   19.778   15.262   19.778   15.262   19.778   22.297   12.995   22.297   12.995 0.000000 0.000000 
1 1 1    0   24   36 o   70.738   6.2324  113.405   24.637  113.405   24.637  113.405   24.637   70.738   8.8140   70.738   8.8140 0.000000 0.000000 
1 1 1    0   24   37 o   13.289   6.6979 -28.3747   22.941 -28.3747   22.941 -28.3747   22.941   13.289   9.4723   13.289   9.4723 0.000000 0.000000 
1 1 1    0   24   38 o   27.264   9.8657   26.984   19.862   26.984   19.862   26.984   19.862   27.264   13.952   27.264   13.952 0.000000 0.000000 
1 1 1    0   24   39 o   25.080   9.5448   22.858   19.324   22.858   19.324   22.858   19.324   25.080   13.498   25.080   13.498 0.000000 0.000000 
1 1 1    0   24   40 o   20.948   8.9223   14.197   19.803   14.197   19.803   14.197   19.803   20.948   12.618   20.948   12.618 0.000000 0.000000 
1 1 1    0   24   41 o   18.128   8.3701   4.2630   21.695   4.2630   21.695   4.2630   21.695   18.128   11.837   18.128   11.837 0.000000 0.000000 
1 1 1    0   24   42 o   16.467   7.8040  -0.7002   20.944  -0.7002   20.944  -0.7002   20.944   16.467   11.036   16.467   11.036 0.000000 0.000000 
1 1 1    0   24   43 o   26.105   11.207   31.126   31.735   31.126   31.735   31.126   31.735   26.105   15.849   26.105   15.849 0.000000 0.000000 
1 1 1    0   25    1 o   47.779   2.5874   47.947   7.1135   47.947   7.1135   47.947   7.1135   47.779   3.6591   47.779   3.6591 0.000000 0.000000 
1 1 1    0   25    2 o  147.417   3.8818  451.035   33.273  451.035   33.273  451.035   33.273  147.417   5.4896  147.417   5.4896 0.000000 0.000000 
1 1 1    0   25    3 o  197.208   3.1218  804.403   35.869  804.403   35.869  804.403   35.869  197.208   4.4149  197.208   4.4149 0.000000 0.000000 
1 1 1    0   25    4 o  136.742   3.1664  387.429   25.194  387.429   25.194  387.429   25.194  136.742   4.4780  136.742   4.4780 0.000000 0.000000 
1 1 1    0   25    5 f   23.090   10.166   7.3939   27.720   7.3939   27.720   7.3939   27.720   23.090   14.378   23.090   14.378 0.000000 0.000000 
1 1 1    0   25    6 o   92.292   3.9314  177.976   20.988  177.976   20.988  177.976   20.988   92.292   5.5598   92.292   5.5598 0.000000 0.000000 
1 1 1    0   25    7 o  151.499   3.4121  475.624   30.083  475.624   30.083  475.624   30.083  151.499   4.8255  151.499   4.8255 0.000000 0.000000 
1 1 1    0   25    8 o   83.122   4.7062  145.700   22.481  145.700   22.481  145.700   22.481   83.122   6.6556   83.122   6.6556 0.000000 0.000000 
1 1 1    0   25    9 o   20.667   8.7294   9.4716   18.640   9.4716   18.640   9.4716   18.640   20.667   12.345   20.667   12.345 0.000000 0.000000 
1 1 1    0   25   10 o   33.218   11.023   33.872   23.959   33.872   23.959   33.872   23.959   33.218   15.589   33.218   15.589 0.000000 0.000000 
1 1 1    0   25   11 o  103.472   4.4476  223.947   26.615  223.947   26.615  223.947   26.615  103.472   6.2898  103.472   6.2898 0.000000 0.000000 
1 1 1    0   25   12 o  167.014   3.7237  578.330   36.193  578.330   36.193  578.330   36.193  167.014   5.2661  167.014   5.2661 0.000000 0.000000 
1 1 1    0   25   13 o   70.478   12.555  122.185   44.637  122.185   44.637  122.185   44.637   70.478   17.756   70.478   17.756 0.000000 0.000000 
1 1 1    0   25   14 o  371.573   4.4250  2859.98   95.844  2859.98   95.844  2859.98   95.844  371.573   6.2579  371.573   6.2579 0.000000 0.000000 
1 1 1    0   25   16 o   73.265   6.8766  117.422   27.941  117.422   27.941  117.422   27.941   73.265   9.7250   73.265   9.7250 0.000000 0.000000 
1 1 1    0   25   17 o   79.857   2.8845  132.792   13.356  132.792   13.356  132.792   13.356   79.857   4.0793   79.857   4.0793 0.000000 0.000000 
1 1 1    0   25   18 o   63.834   3.5982   85.893   13.202   85.893   13.202   85.893   13.202   63.834   5.0886   63.834   5.0886 0.000000 0.000000 
1 1 1    0   25   19 o   30.559   4.1605   21.341   6.6223   21.341   6.6223   21.341   6.6223   30.559   5.8839   30.559   5.8839 0.000000 0.000000 
1 1 1    0   25   20 o   15.192   6.6088   3.8622   11.372   3.8622   11.372   3.8622   11.372   15.192   9.3462   15.192   9.3462 0.000000 0.000000 
1 1 1    0   25   21 o  127.236   2.3560  335.174   17.458  335.174   17.458  335.174   17.458  127.236   3.3318  127.236   3.3318 0.000000 0.000000 
1 1 1    0   25   22 o  171.178   2.5982  606.796   25.915  606.796   25.915  606.796   25.915  171.178   3.6744  171.178   3.6744 0.000000 0.000000 
1 1 1    0   25   23 o   43.637   4.3130   41.807   10.364   41.807   10.364   41.807   10.364   43.637   6.0996   43.637   6.0996 0.000000 0.000000 
1 1 1    0   25   24 o   99.790   2.5148  206.826   14.596  206.826   14.596  206.826   14.596   99.790   3.5565   99.790   3.5565 0.000000 0.000000 
1 1 1    0   25   25 o   66.767   4.7644   95.887   18.121   95.887   18.121   95.887   18.121   66.767   6.7379   66.767   6.7379 0.000000 0.000000 
1 1 1    0   25   26 o   56.902   5.1854   71.010   16.424   71.010   16.424   71.010   16.424   56.902   7.3333   56.902   7.3333 0.000000 0.000000 
1 1 1    0   25   27 o   12.356   6.0841 -13.6570   15.720 -13.6570   15.720 -13.6570   15.720   12.356   8.6042   12.356   8.6042 0.000000 0.000000 
1 1 1    0   25   28 o  116.751   3.6513  285.782   24.754  285.782   24.754  285.782   24.754  116.751   5.1637  116.751   5.1637 0.000000 0.000000 
1 1 1    0   25   29 o   44.928   8.0559   50.577   18.254   50.577   18.254   50.577   18.254   44.928   11.393   44.928   11.393 0.000000 0.000000 
1 1 1    0   25   30 o   72.914   5.3883  115.816   22.343  115.816   22.343  115.816   22.343   72.914   7.6202   72.914   7.6202 0.000000 0.000000 
1 1 1    0   25   31 o   23.173   9.9546   13.833   25.078   13.833   25.078   13.833   25.078   23.173   14.078   23.173   14.078 0.000000 0.000000 
1 1 1    0   25   32 o   19.199   8.3907   7.6073   18.530   7.6073   18.530   7.6073   18.530   19.199   11.866   19.199   11.866 0.000000 0.000000 
1 1 1    0   25   33 o   52.534   7.2434   65.820   19.777   65.820   19.777   65.820   19.777   52.534   10.244   52.534   10.244 0.000000 0.000000 
1 1 1    0   25   34 o   85.497   4.7553  157.919   23.377  157.919   23.377  157.919   23.377   85.497   6.7249   85.497   6.7249 0.000000 0.000000 
1 1 1    0   25   35 o   24.281   9.4474   20.196   19.358   20.196   19.358   20.196   19.358   24.281   13.361   24.281   13.361 0.000000 0.000000 
1 1 1    0   25   36 o  132.919   3.7904  374.665   29.278  374.665   29.278  374.665   29.278  132.919   5.3604  132.919   5.3604 0.000000 0.000000 
1 1 1    0   25   37 o   49.540   8.4004   63.666   21.055   63.666   21.055   63.666   21.055   49.540   11.880   49.540   11.880 0.000000 0.000000 
1 1 1    0   25   38 o   35.831   9.8292   40.740   19.548   40.740   19.548   40.740   19.548   35.831   13.901   35.831   13.901 0.000000 0.000000 
1 1 1    0   25   39 o   19.423   8.9325   5.9747   24.353   5.9747   24.353   5.9747   24.353   19.423   12.632   19.423   12.632 0.000000 0.000000 
1 1 1    0   25   40 o   19.103   8.4697   9.4796   19.581   9.4796   19.581   9.4796   19.581   19.103   11.978   19.103   11.978 0.000000 0.000000 
1 1 1    0   25   41 o   16.240   7.7543  -2.5497   21.421  -2.5497   21.421  -2.5497   21.421   16.240   10.966   16.240   10.966 0.000000 0.000000 
1 1 1    0   25   42 o   14.348   7.0525 -10.9934   20.870 -10.9934   20.870 -10.9934   20.870   14.348   9.9737   14.348   9.9737 0.000000 0.000000 
1 1 1    0   26    0 o   47.670   2.6592   47.758   7.2879   47.758   7.2879   47.758   7.2879   47.670   3.7606   47.670   3.7606 0.000000 0.000000 
1 1 1    0   26    1 o   41.529   4.8027   38.414   10.699   38.414   10.699   38.414   10.699   41.529   6.7921   41.529   6.7921 0.000000 0.000000 
1 1 1    0   26    2 o   54.414   4.8768   64.161   14.801   64.161   14.801   64.161   14.801   54.414   6.8969   54.414   6.8969 0.000000 0.000000 
1 1 1    0   26    3 o  181.382   3.0981  680.706   32.734  680.706   32.734  680.706   32.734  181.382   4.3814  181.382   4.3814 0.000000 0.000000 
1 1 1    0   26    4 o   64.861   4.3178   89.297   16.003   89.297   16.003   89.297   16.003   64.861   6.1063   64.861   6.1063 0.000000 0.000000 
1 1 1    0   26    5 o  124.040   5.4200  322.420   38.871  322.420   38.871  322.420   38.871  124.040   7.6650  124.040   7.6650 0.000000 0.000000 
1 1 1    0   26    6 o  123.814   3.5365  318.333   25.446  318.333   25.446  318.333   25.446  123.814   5.0014  123.814   5.0014 0.000000 0.000000 
1 1 1    0   26    7 o   28.927   9.3977   25.433   17.367   25.433   17.367   25.433   17.367   28.927   13.290   28.927   13.290 0.000000 0.000000 
1 1 1    0   26    8 o  116.661   3.7827  283.126   25.617  283.126   25.617  283.126   25.617  116.661   5.3495  116.661   5.3495 0.000000 0.000000 
1 1 1    0   26    9 o   63.993   6.0737   89.410   21.524   89.410   21.524   89.410   21.524   63.993   8.5895   63.993   8.5895 0.000000 0.000000 
1 1 1    0   26   10 o   21.430   9.4511   6.1782   24.057   6.1782   24.057   6.1782   24.057   21.430   13.366   21.430   13.366 0.000000 0.000000 
1 1 1    0   26   11 o  196.145   3.6645  797.030   41.859  797.030   41.859  797.030   41.859  196.145   5.1824  196.145   5.1824 0.000000 0.000000 
1 1 1    0   26   12 o   12.887   6.5027 -32.1195   21.853 -32.1195   21.853 -32.1195   21.853   12.887   9.1962   12.887   9.1962 0.000000 0.000000 
1 1 1    0   26   13 o   24.668   11.452  -5.1520   41.434  -5.1520   41.434  -5.1520   41.434   24.668   16.195   24.668   16.195 0.000000 0.000000 
1 1 1    0   26   14 o   33.513   11.184   34.760   24.702   34.760   24.702   34.760   24.702   33.513   15.817   33.513   15.817 0.000000 0.000000 
1 1 1    0   26   15 o  188.492   3.9121  737.280   42.927  737.280   42.927  737.280   42.927  188.492   5.5325  188.492   5.5325 0.000000 0.000000 
1 1 1    0   26   16 o  157.809   4.2364  518.195   38.867  518.195   38.867  518.195   38.867  157.809   5.9911  157.809   5.9911 0.000000 0.000000 
1 1 1    0   26   17 f  300.122   4.1429  1868.75   72.462  1868.75   72.462  1868.75   72.462  300.122   5.8589  300.122   5.8589 0.000000 0.000000 
1 1 1    0   26   18 o   55.107   11.865   79.797   33.303   79.797   33.303   79.797   33.303   55.107   16.779   55.107   16.779 0.000000 0.000000 
1 1 1    0   26   19 o   79.219   2.3234  130.321   10.694  130.321   10.694  130.321   10.694   79.219   3.2858   79.219   3.2858 0.000000 0.000000 
1 1 1    0   26   20 o   35.851   3.5824   28.173   7.0602   28.173   7.0602   28.173   7.0602   35.851   5.0663   35.851   5.0663 0.000000 0.000000 
1 1 1    0   26   21 o   17.739   7.0680   8.9054   11.146   8.9054   11.146   8.9054   11.146   17.739   9.9957   17.739   9.9957 0.000000 0.000000 
1 1 1    0   26   22 o   42.769   3.4726   39.407   8.3667   39.407   8.3667   39.407   8.3667   42.769   4.9110   42.769   4.9110 0.000000 0.000000 
1 1 1    0   26   23 o   51.959   3.1265   57.178   9.3175   57.178   9.3175   57.178   9.3175   51.959   4.4215   51.959   4.4215 0.000000 0.000000 
1 1 1    0   26   24 o   14.512   5.7199   6.0540   7.2000   6.0540   7.2000   6.0540   7.2000   14.512   8.0892   14.512   8.0892 0.000000 0.000000 
1 1 1    0   26   25 o   63.613   2.9156   84.959   10.714   84.959   10.714   84.959   10.714   63.613   4.1232   63.613   4.1232 0.000000 0.000000 
1 1 1    0   26   26 o   21.630   6.0689   13.578   7.3852   13.578   7.3852   13.578   7.3852   21.630   8.5827   21.630   8.5827 0.000000 0.000000 
1 1 1    0   26   27 o   59.761   5.5975   79.181   18.557   79.181   18.557   79.181   18.557   59.761   7.9161   59.761   7.9161 0.000000 0.000000 
1 1 1    0   26   28 o   24.529   8.8117   19.470   15.778   19.470   15.778   19.470   15.778   24.529   12.462   24.529   12.462 0.000000 0.000000 
1 1 1    0   26   29 o   35.941   10.365   39.709   21.368   39.709   21.368   39.709   21.368   35.941   14.659   35.941   14.659 0.000000 0.000000 
1 1 1    0   26   30 o  102.166   3.6187  219.757   21.441  219.757   21.441  219.757   21.441  102.166   5.1176  102.166   5.1176 0.000000 0.000000 
1 1 1    0   26   31 o   27.059   9.3577   24.247   17.476   24.247   17.476   24.247   17.476   27.059   13.234   27.059   13.234 0.000000 0.000000 
1 1 1    0   26   32 o  104.525   4.7917  234.231   28.932  234.231   28.932  234.231   28.932  104.525   6.7764  104.525   6.7764 0.000000 0.000000 
1 1 1    0   26   33 o   94.784   3.9747  191.167   21.798  191.167   21.798  191.167   21.798   94.784   5.6211   94.784   5.6211 0.000000 0.000000 
1 1 1    0   26   34 o   16.661   7.8327  -2.3229   20.371  -2.3229   20.371  -2.3229   20.371   16.661   11.077   16.661   11.077 0.000000 0.000000 
1 1 1    0   26   35 o   30.955   9.8473   32.269   19.029   32.269   19.029   32.269   19.029   30.955   13.926   30.955   13.926 0.000000 0.000000 
1 1 1    0   26   36 o   18.169   8.3547   3.3680   21.299   3.3680   21.299   3.3680   21.299   18.169   11.815   18.169   11.815 0.000000 0.000000 
1 1 1    0   26   37 o   14.631   7.1517 -11.6772   20.704 -11.6772   20.704 -11.6772   20.704   14.631   10.114   14.631   10.114 0.000000 0.000000 
1 1 1    0   26   38 o   17.996   8.1287   6.0918   19.026   6.0918   19.026   6.0918   19.026   17.996   11.496   17.996   11.496 0.000000 0.000000 
1 1 1    0   26   39 o   14.727   7.1338  -7.5160   19.537  -7.5160   19.537  -7.5160   19.537   14.727   10.089   14.727   10.089 0.000000 0.000000 
1 1 1    0   26   40 o   14.376   7.0445 -10.4411   20.410 -10.4411   20.410 -10.4411   20.410   14.376   9.9624   14.376   9.9624 0.000000 0.000000 
1 1 1    0   26   41 o   18.836   8.5074   9.1275   20.837   9.1275   20.837   9.1275   20.837   18.836   12.031   18.836   12.031 0.000000 0.000000 
1 1 1    0   27    2 o   54.388   4.8955   64.146   14.844   64.146   14.844   64.146   14.844   54.388   6.9233   54.388   6.9233 0.000000 0.000000 
1 1 1    0   27    3 o  131.274   5.1302  360.299   39.007  360.299   39.007  360.299   39.007  131.274   7.2552  131.274   7.2552 0.000000 0.000000 
1 1 1    0   27    4 o  186.227   4.9826  721.480   53.947  721.480   53.947  721.480   53.947  186.227   7.0465  186.227   7.0465 0.000000 0.000000 
1 1 1    0   27    6 o   15.652   7.3606  -5.1329   18.015  -5.1329   18.015  -5.1329   18.015   15.652   10.410   15.652   10.410 0.000000 0.000000 
1 1 1    0   27    8 o   43.863   8.8764   48.722   19.686   48.722   19.686   48.722   19.686   43.863   12.553   43.863   12.553 0.000000 0.000000 
1 1 1    0   27    9 o   31.403   10.275   30.196   20.778   30.196   20.778   30.196   20.778   31.403   14.532   31.403   14.532 0.000000 0.000000 
1 1 1    0   27   10 o  149.433   3.8621  463.820   33.561  463.820   33.561  463.820   33.561  149.433   5.4619  149.433   5.4619 0.000000 0.000000 
1 1 1    0   27   11 o   88.067   5.0696  164.012   25.644  164.012   25.644  164.012   25.644   88.067   7.1695   88.067   7.1695 0.000000 0.000000 
1 1 1    0   27   12 o  107.782   4.5839  243.353   28.579  243.353   28.579  243.353   28.579  107.782   6.4826  107.782   6.4826 0.000000 0.000000 
1 1 1    0   27   13 o  143.827   6.9221  437.674   57.454  437.674   57.454  437.674   57.454  143.827   9.7893  143.827   9.7893 0.000000 0.000000 
1 1 1    0   27   14 o   40.298   11.174   47.048   25.153   47.048   25.153   47.048   25.153   40.298   15.802   40.298   15.802 0.000000 0.000000 
1 1 1    0   27   15 o   81.362   5.9744  142.239   27.653  142.239   27.653  142.239   27.653   81.362   8.4491   81.362   8.4491 0.000000 0.000000 
1 1 1    0   27   16 o   19.530   9.0423  -2.6595   25.579  -2.6595   25.579  -2.6595   25.579   19.530   12.788   19.530   12.788 0.000000 0.000000 
1 1 1    0   27   17 o   40.254   11.307   47.558   25.624   47.558   25.624   47.558   25.624   40.254   15.991   40.254   15.991 0.000000 0.000000 
1 1 1    0   27   18 o   19.801   9.3280  -7.3293   29.156  -7.3293   29.156  -7.3293   29.156   19.801   13.192   19.801   13.192 0.000000 0.000000 
1 1 1    0   27   19 o   56.564   10.012   79.384   28.576   79.384   28.576   79.384   28.576   56.564   14.160   56.564   14.160 0.000000 0.000000 
1 1 1    0   27   20 o   78.655   6.8590  136.083   30.183  136.083   30.183  136.083   30.183   78.655   9.7001   78.655   9.7001 0.000000 0.000000 
1 1 1    0   27   21 o   61.625   2.6274   79.470   9.3656   79.470   9.3656   79.470   9.3656   61.625   3.7157   61.625   3.7157 0.000000 0.000000 
1 1 1    0   27   22 f   30.826   7.3345   25.762   11.783   25.762   11.783   25.762   11.783   30.826   10.373   30.826   10.373 0.000000 0.000000 
1 1 1    0   27   23 o   78.170   2.4846  127.257   11.277  127.257   11.277  127.257   11.277   78.170   3.5138   78.170   3.5138 0.000000 0.000000 
1 1 1    0   27   24 f   22.008   5.7720   13.617   6.8809   13.617   6.8809   13.617   6.8809   22.008   8.1628   22.008   8.1628 0.000000 0.000000 
1 1 1    0   27   25 o  131.207   4.7287  364.203   35.975  364.203   35.975  364.203   35.975  131.207   6.6874  131.207   6.6874 0.000000 0.000000 
1 1 1    0   27   26 o   34.017   4.6380   26.707   8.2157   26.707   8.2157   26.707   8.2157   34.017   6.5592   34.017   6.5592 0.000000 0.000000 
1 1 1    0   27   27 o   18.525   5.9814   10.543   7.0307   10.543   7.0307   10.543   7.0307   18.525   8.4590   18.525   8.4590 0.000000 0.000000 
1 1 1    0   27   28 o   49.620   6.6408   57.692   17.214   57.692   17.214   57.692   17.214   49.620   9.3915   49.620   9.3915 0.000000 0.000000 
1 1 1    0   27   29 o   25.285   9.5593   21.157   19.262   21.157   19.262   21.157   19.262   25.285   13.519   25.285   13.519 0.000000 0.000000 
1 1 1    0   27   30 o   59.458   5.9377   79.781   19.410   79.781   19.410   79.781   19.410   59.458   8.3972   59.458   8.3972 0.000000 0.000000 
1 1 1    0   27   31 o   88.386   3.9418  166.028   20.136  166.028   20.136  166.028   20.136   88.386   5.5745   88.386   5.5745 0.000000 0.000000 
1 1 1    0   27   32 o   34.956   9.2350   36.554   17.549   36.554   17.549   36.554   17.549   34.956   13.060   34.956   13.060 0.000000 0.000000 
1 1 1    0   27   33 o   12.017   5.9874 -16.9494   16.591 -16.9494   16.591 -16.9494   16.591   12.017   8.4675   12.017   8.4675 0.000000 0.000000 
1 1 1    0   27   34 o   19.010   8.2753   8.9512   17.857   8.9512   17.857   8.9512   17.857   19.010   11.703   19.010   11.703 0.000000 0.000000 
1 1 1    0   27   35 o   69.009   5.2397  106.423   20.476  106.423   20.476  106.423   20.476   69.009   7.4100   69.009   7.4100 0.000000 0.000000 
1 1 1    0   27   36 o   20.979   9.0819   12.871   21.244   12.871   21.244   12.871   21.244   20.979   12.844   20.979   12.844 0.000000 0.000000 
1 1 1    0   27   37 o   50.827   7.3964   64.797   19.369   64.797   19.369   64.797   19.369   50.827   10.460   50.827   10.460 0.000000 0.000000 
1 1 1    0   27   38 o   30.307   9.8874   33.097   19.232   33.097   19.232   33.097   19.232   30.307   13.983   30.307   13.983 0.000000 0.000000 
1 1 1    0   27   39 o   36.682   9.5542   43.146   18.920   43.146   18.920   43.146   18.920   36.682   13.512   36.682   13.512 0.000000 0.000000 
1 1 1    0   27   40 o   31.945   11.737   45.298   28.391   45.298   28.391   45.298   28.391   31.945   16.599   31.945   16.599 0.000000 0.000000 
1 1 1    0   28    0 o   38.478   2.7444   31.477   6.0158   31.477   6.0158   31.477   6.0158   38.478   3.8812   38.478   3.8812 0.000000 0.000000 
1 1 1    0   28    1 o   31.757   3.4181   22.238   5.8964   22.238   5.8964   22.238   5.8964   31.757   4.8339   31.757   4.8339 0.000000 0.000000 
1 1 1    0   28    2 o  111.008   3.7853  256.644   24.380  256.644   24.380  256.644   24.380  111.008   5.3533  111.008   5.3533 0.000000 0.000000 
1 1 1    0   28    4 o   30.618   8.2260   26.440   13.808   26.440   13.808   26.440   13.808   30.618   11.633   30.618   11.633 0.000000 0.000000 
1 1 1    0   28    7 o   19.345   8.3312   7.1564   17.669   7.1564   17.669   7.1564   17.669   19.345   11.782   19.345   11.782 0.000000 0.000000 
1 1 1    0   28    8 o   19.965   8.6049   7.6089   18.882   7.6089   18.882   7.6089   18.882   19.965   12.169   19.965   12.169 0.000000 0.000000 
1 1 1    0   28    9 o   88.824   6.1503  168.844   31.163  168.844   31.163  168.844   31.163   88.824   8.6979   88.824   8.6979 0.000000 0.000000 
1 1 1    0   28   10 o  140.598   6.6365  417.853   53.868  417.853   53.868  417.853   53.868  140.598   9.3854  140.598   9.3854 0.000000 0.000000 
1 1 1    0   28   11 o  140.819   6.8900  420.203   55.971  420.203   55.971  420.203   55.971  140.819   9.7440  140.819   9.7440 0.000000 0.000000 
1 1 1    0   28   12 o   82.603   7.4855  149.611   34.443  149.611   34.443  149.611   34.443   82.603   10.586   82.603   10.586 0.000000 0.000000 
1 1 1    0   28   14 o   21.107   9.4104   5.0545   24.553   5.0545   24.553   5.0545   24.553   21.107   13.308   21.107   13.308 0.000000 0.000000 
1 1 1    0   28   15 o   14.584   7.2465 -25.2285   23.792 -25.2285   23.792 -25.2285   23.792   14.584   10.248   14.584   10.248 0.000000 0.000000 
1 1 1    0   28   16 o   90.876   5.3282  175.809   27.796  175.809   27.796  175.809   27.796   90.876   7.5352   90.876   7.5352 0.000000 0.000000 
1 1 1    0   28   17 o   11.601   5.9738 -51.6387   23.461 -51.6387   23.461 -51.6387   23.461   11.601   8.4482   11.601   8.4482 0.000000 0.000000 
1 1 1    0   28   18 o   69.903   9.7240  115.636   35.275  115.636   35.275  115.636   35.275   69.903   13.752   69.903   13.752 0.000000 0.000000 
1 1 1    0   28   19 o  121.069   4.9683  309.542   34.815  309.542   34.815  309.542   34.815  121.069   7.0262  121.069   7.0262 0.000000 0.000000 
1 1 1    0   28   20 o   75.160   7.3524  126.359   30.473  126.359   30.473  126.359   30.473   75.160   10.398   75.160   10.398 0.000000 0.000000 
1 1 1    0   28   21 o   54.364   2.4814   61.934   7.7934   61.934   7.7934   61.934   7.7934   54.364   3.5093   54.364   3.5093 0.000000 0.000000 
1 1 1    0   28   22 o   92.983   2.3342  179.696   12.624  179.696   12.624  179.696   12.624   92.983   3.3011   92.983   3.3011 0.000000 0.000000 
1 1 1    0   28   23 o   29.358   7.3393   24.014   11.426   24.014   11.426   24.014   11.426   29.358   10.379   29.358   10.379 0.000000 0.000000 
1 1 1    0   28   24 o   64.123   2.7564   86.267   10.222   86.267   10.222   86.267   10.222   64.123   3.8981   64.123   3.8981 0.000000 0.000000 
1 1 1    0   28   25 o   23.856   5.6691   15.379   7.0457   15.379   7.0457   15.379   7.0457   23.856   8.0173   23.856   8.0173 0.000000 0.000000 
1 1 1    0   28   26 o   26.274   6.1187   18.585   8.3251   18.585   8.3251   18.585   8.3251   26.274   8.6531   26.274   8.6531 0.000000 0.000000 
1 1 1    0   28   27 o   52.633   3.2708   59.052   9.8630   59.052   9.8630   59.052   9.8630   52.633   4.6257   52.633   4.6257 0.000000 0.000000 
1 1 1    0   28   28 o   22.394   6.2431   14.631   7.8352   14.631   7.8352   14.631   7.8352   22.394   8.8291   22.394   8.8291 0.000000 0.000000 
1 1 1    0   28   29 o   6.3899   3.2545 -10.5659   6.0351 -10.5659   6.0351 -10.5659   6.0351   6.3899   4.6026   6.3899   4.6026 0.000000 0.000000 
1 1 1    0   28   30 o  116.153   3.6477  284.580   24.603  284.580   24.603  284.580   24.603  116.153   5.1587  116.153   5.1587 0.000000 0.000000 
1 1 1    0   28   31 o   25.089   6.3455   17.790   8.4813   17.790   8.4813   17.790   8.4813   25.089   8.9739   25.089   8.9739 0.000000 0.000000 
1 1 1    0   28   32 o   15.555   6.1810   7.3204   8.4924   7.3204   8.4924   7.3204   8.4924   15.555   8.7412   15.555   8.7412 0.000000 0.000000 
1 1 1    0   28   33 o   22.365   10.509   3.8041   36.584   3.8041   36.584   3.8041   36.584   22.365   14.861   22.365   14.861 0.000000 0.000000 
1 1 1    0   28   34 o   12.793   6.2678 -10.7507   16.146 -10.7507   16.146 -10.7507   16.146   12.793   8.8640   12.793   8.8640 0.000000 0.000000 
1 1 1    0   28   35 o   37.042   9.1681   41.050   17.939   41.050   17.939   41.050   17.939   37.042   12.966   37.042   12.966 0.000000 0.000000 
1 1 1    0   28   36 o   29.470   9.5243   30.541   17.828   30.541   17.828   30.541   17.828   29.470   13.469   29.470   13.469 0.000000 0.000000 
1 1 1    0   28   37 o   15.353   7.2626  -1.8042   17.998  -1.8042   17.998  -1.8042   17.998   15.353   10.271   15.353   10.271 0.000000 0.000000 
1 1 1    0   28   38 o   34.695   12.155   51.480   29.645   51.480   29.645   51.480   29.645   34.695   17.190   34.695   17.190 0.000000 0.000000 
1 1 1    0   28   39 o   27.287   11.886   36.338   36.894   36.338   36.894   36.338   36.894   27.287   16.809   27.287   16.809 0.000000 0.000000 
1 1 1    0   29    1 o   49.026   2.7656   50.604   7.7927   50.604   7.7927   50.604   7.7927   49.026   3.9111   49.026   3.9111 0.000000 0.000000 
1 1 1    0   29    2 o   93.666   3.7960  183.380   20.583  183.380   20.583  183.380   20.583   93.666   5.3684   93.666   5.3684 0.000000 0.000000 
1 1 1    0   29    4 o   99.209   3.4888  205.145   20.075  205.145   20.075  205.145   20.075   99.209   4.9339   99.209   4.9339 0.000000 0.000000 
1 1 1    0   29    5 o   73.666   4.2420  114.668   17.949  114.668   17.949  114.668   17.949   73.666   5.9990   73.666   5.9990 0.000000 0.000000 
1 1 1    0   29    6 o   70.544   4.5014  105.686   18.175  105.686   18.175  105.686   18.175   70.544   6.3659   70.544   6.3659 0.000000 0.000000 
1 1 1    0   29    7 o  119.780   3.6115  298.599   25.128  298.599   25.128  298.599   25.128  119.780   5.1075  119.780   5.1075 0.000000 0.000000 
1 1 1    0   29    8 o   35.268   9.4065   35.233   18.120   35.233   18.120   35.233   18.120   35.268   13.303   35.268   13.303 0.000000 0.000000 
1 1 1    0   29    9 o   80.027   6.1897  138.203   28.014  138.203   28.014  138.203   28.014   80.027   8.7536   80.027   8.7536 0.000000 0.000000 
1 1 1    0   29   10 o  132.256   3.9347  364.446   30.232  364.446   30.232  364.446   30.232  132.256   5.5646  132.256   5.5646 0.000000 0.000000 
1 1 1    0   29   11 o  222.892   3.7331  1031.48   48.473  1031.48   48.473  1031.48   48.473  222.892   5.2794  222.892   5.2794 0.000000 0.000000 
1 1 1    0   29   12 o   54.484   9.6787   73.396   26.604   73.396   26.604   73.396   26.604   54.484   13.688   54.484   13.688 0.000000 0.000000 
1 1 1    0   29   13 o  123.913   4.4012  321.647   31.627  321.647   31.627  321.647   31.627  123.913   6.2242  123.913   6.2242 0.000000 0.000000 
1 1 1    0   29   14 o   53.983   9.3579   71.714   25.520   71.714   25.520   71.714   25.520   53.983   13.234   53.983   13.234 0.000000 0.000000 
1 1 1    0   29   15 o  173.433   3.9448  627.043   39.812  627.043   39.812  627.043   39.812  173.433   5.5788  173.433   5.5788 0.000000 0.000000 
1 1 1    0   29   16 o   58.600   8.8694   82.169   26.625   82.169   26.625   82.169   26.625   58.600   12.543   58.600   12.543 0.000000 0.000000 
1 1 1    0   29   17 o   36.228   12.738   43.591   32.600   43.591   32.600   43.591   32.600   36.228   18.014   36.228   18.014 0.000000 0.000000 
1 1 1    0   29   18 o   18.697   8.8662  -8.1413   27.109  -8.1413   27.109  -8.1413   27.109   18.697   12.539   18.697   12.539 0.000000 0.000000 
1 1 1    0   29   19 o   18.851   9.5052 -60.1086   46.361 -60.1086   46.361 -60.1086   46.361   18.851   13.442   18.851   13.442 0.000000 0.000000 
1 1 1    0   29   20 o   22.889   11.112 -23.1831   47.990 -23.1831   47.990 -23.1831   47.990   22.889   15.714   22.889   15.714 0.000000 0.000000 
1 1 1    0   29   22 o  111.439   7.0113  272.353   44.744  272.353   44.744  272.353   44.744  111.439   9.9154  111.439   9.9154 0.000000 0.000000 
1 1 1    0   29   23 o   6.8920   3.3441  -2.9211   4.3328  -2.9211   4.3328  -2.9211   4.3328   6.8920   4.7292   6.8920   4.7292 0.000000 0.000000 
1 1 1    0   29   24 o   45.732   4.9884   46.920   12.364   46.920   12.364   46.920   12.364   45.732   7.0547   45.732   7.0547 0.000000 0.000000 
1 1 1    0   29   25 o   19.292   5.7939   11.157   6.6172   11.157   6.6172   11.157   6.6172   19.292   8.1938   19.292   8.1938 0.000000 0.000000 
1 1 1    0   29   26 o   30.545   4.8505   22.268   7.5431   22.268   7.5431   22.268   7.5431   30.545   6.8596   30.545   6.8596 0.000000 0.000000 
1 1 1    0   29   27 o   18.636   6.2281   10.905   7.6625   10.905   7.6625   10.905   7.6625   18.636   8.8079   18.636   8.8079 0.000000 0.000000 
1 1 1    0   29   28 o   75.299   2.8960  119.140   12.633  119.140   12.633  119.140   12.633   75.299   4.0955   75.299   4.0955 0.000000 0.000000 
1 1 1    0   29   29 o   12.219   5.2928   2.9303   7.2245   2.9303   7.2245   2.9303   7.2245   12.219   7.4852   12.219   7.4852 0.000000 0.000000 
1 1 1    0   29   30 o   91.672   4.0123  179.438   21.266  179.438   21.266  179.438   21.266   91.672   5.6742   91.672   5.6742 0.000000 0.000000 
1 1 1    0   29   31 o   29.257   9.3923   28.590   17.325   28.590   17.325   28.590   17.325   29.257   13.283   29.257   13.283 0.000000 0.000000 
1 1 1    0   29   32 o   33.839   5.3853   27.884   9.2757   27.884   9.2757   27.884   9.2757   33.839   7.6160   33.839   7.6160 0.000000 0.000000 
1 1 1    0   29   33 o   6.9456   3.5312 -11.4833   6.9612 -11.4833   6.9612 -11.4833   6.9612   6.9456   4.9938   6.9456   4.9938 0.000000 0.000000 
1 1 1    0   29   34 o   24.804   7.2890   19.263   10.511   19.263   10.511   19.263   10.511   24.804   10.308   24.804   10.308 0.000000 0.000000 
1 1 1    0   29   35 o   13.839   6.0411   4.1775   9.5766   4.1775   9.5766   4.1775   9.5766   13.839   8.5434   13.839   8.5434 0.000000 0.000000 
1 1 1    0   29   36 o   29.305   11.548   37.156   29.337   37.156   29.337   37.156   29.337   29.305   16.331   29.305   16.331 0.000000 0.000000 
1 1 1    0   29   37 o   11.719   6.0710 -57.2801   26.662 -57.2801   26.662 -57.2801   26.662   11.719   8.5857   11.719   8.5857 0.000000 0.000000 
1 1 1    0   29   38 o   13.268   6.8142 -47.0025   29.390 -47.0025   29.390 -47.0025   29.390   13.268   9.6368   13.268   9.6368 0.000000 0.000000 
1 1 1    0   30    1 o  100.738   2.4439  210.408   14.322  210.408   14.322  210.408   14.322  100.738   3.4562  100.738   3.4562 0.000000 0.000000 
1 1 1    0   30    2 o   52.149   2.8751   57.244   8.6233   57.244   8.6233   57.244   8.6233   52.149   4.0661   52.149   4.0661 0.000000 0.000000 
1 1 1    0   30    3 o   42.978   5.4153   41.830   12.291   41.830   12.291   41.830   12.291   42.978   7.6584   42.978   7.6584 0.000000 0.000000 
1 1 1    0   30    4 o   67.786   4.0428   97.275   15.723   97.275   15.723   97.275   15.723   67.786   5.7174   67.786   5.7174 0.000000 0.000000 
1 1 1    0   30    6 o   37.804   7.9897   36.911   15.343   36.911   15.343   36.911   15.343   37.804   11.299   37.804   11.299 0.000000 0.000000 
1 1 1    0   30    7 o   67.172   4.9052   96.842   18.749   96.842   18.749   96.842   18.749   67.172   6.9370   67.172   6.9370 0.000000 0.000000 
1 1 1    0   30    8 o   75.238   4.7731  120.607   20.559  120.607   20.559  120.607   20.559   75.238   6.7501   75.238   6.7501 0.000000 0.000000 
1 1 1    0   30    9 o   16.911   7.8799  -3.1640   19.891  -3.1640   19.891  -3.1640   19.891   16.911   11.144   16.911   11.144 0.000000 0.000000 
1 1 1    0   30   10 o   17.821   8.1755  -0.2714   20.234  -0.2714   20.234  -0.2714   20.234   17.821   11.562   17.821   11.562 0.000000 0.000000 
1 1 1    0   30   11 o   57.575   7.3988   76.237   22.415   76.237   22.415   76.237   22.415   57.575   10.463   57.575   10.463 0.000000 0.000000 
1 1 1    0   30   12 o   41.966   14.652   59.213   43.014   59.213   43.014   59.213   43.014   41.966   20.721   41.966   20.721 0.000000 0.000000 
1 1 1    0   30   13 o   22.931   9.6385   13.319   22.520   13.319   22.520   13.319   22.520   22.931   13.631   22.931   13.631 0.000000 0.000000 
1 1 1    0   30   14 o   20.633   9.1384   6.4461   22.730   6.4461   22.730   6.4461   22.730   20.633   12.924   20.633   12.924 0.000000 0.000000 
1 1 1    0   30   15 o  106.292   4.7964  238.946   29.459  238.946   29.459  238.946   29.459  106.292   6.7831  106.292   6.7831 0.000000 0.000000 
1 1 1    0   30   16 o   27.006   10.521   22.840   24.043   22.840   24.043   22.840   24.043   27.006   14.879   27.006   14.879 0.000000 0.000000 
1 1 1    0   30   17 o   93.489   6.4762  190.427   34.537  190.427   34.537  190.427   34.537   93.489   9.1587   93.489   9.1587 0.000000 0.000000 
1 1 1    0   30   18 o  123.809   4.4868  323.595   32.208  323.595   32.208  323.595   32.208  123.809   6.3453  123.809   6.3453 0.000000 0.000000 
1 1 1    0   30   19 o  141.026   4.2998  418.577   35.220  418.577   35.220  418.577   35.220  141.026   6.0809  141.026   6.0809 0.000000 0.000000 
1 1 1    0   30   20 o  123.338   7.8085  336.808   55.140  336.808   55.140  336.808   55.140  123.338   11.043  123.338   11.043 0.000000 0.000000 
1 1 1    0   30   21 o   99.227   5.4786  211.798   31.264  211.798   31.264  211.798   31.264   99.227   7.7479   99.227   7.7479 0.000000 0.000000 
1 1 1    0   30   22 o   19.871   9.1857   0.0949   26.239   0.0949   26.239   0.0949   26.239   19.871   12.991   19.871   12.991 0.000000 0.000000 
1 1 1    0   30   23 o   20.502   9.4521   1.5664   27.510   1.5664   27.510   1.5664   27.510   20.502   13.367   20.502   13.367 0.000000 0.000000 
1 1 1    0   30   24 o   33.908   3.2777   25.243   6.1391   25.243   6.1391   25.243   6.1391   33.908   4.6354   33.908   4.6354 0.000000 0.000000 
1 1 1    0   30   25 o   32.475   6.9049   27.785   11.400   27.785   11.400   27.785   11.400   32.475   9.7651   32.475   9.7651 0.000000 0.000000 
1 1 1    0   30   26 o   40.968   3.5654   36.641   8.1737   36.641   8.1737   36.641   8.1737   40.968   5.0422   40.968   5.0422 0.000000 0.000000 
1 1 1    0   30   27 o   41.186   3.5647   37.063   8.2203   37.063   8.2203   37.063   8.2203   41.186   5.0412   41.186   5.0412 0.000000 0.000000 
1 1 1    0   30   28 o   61.297   3.8247   80.891   13.430   80.891   13.430   80.891   13.430   61.297   5.4090   61.297   5.4090 0.000000 0.000000 
1 1 1    0   30   29 o   11.126   4.9956   1.2112   7.0561   1.2112   7.0561   1.2112   7.0561   11.126   7.0648   11.126   7.0648 0.000000 0.000000 
1 1 1    0   30   30 o   11.501   5.1350   1.6327   7.3400   1.6327   7.3400   1.6327   7.3400   11.501   7.2619   11.501   7.2619 0.000000 0.000000 
1 1 1    0   30   31 o   36.105   4.9881   30.779   9.3570   30.779   9.3570   30.779   9.3570   36.105   7.0542   36.105   7.0542 0.000000 0.000000 
1 1 1    0   30   32 o   15.077   7.0846  -1.6217   16.632  -1.6217   16.632  -1.6217   16.632   15.077   10.019   15.077   10.019 0.000000 0.000000 
1 1 1    0   30   33 o   14.251   7.2363 -37.4517   28.836 -37.4517   28.836 -37.4517   28.836   14.251   10.234   14.251   10.234 0.000000 0.000000 
1 1 1    0   30   34 o   54.128   11.420   88.852   31.392   88.852   31.392   88.852   31.392   54.128   16.150   54.128   16.150 0.000000 0.000000 
1 1 1    0   30   35 o   28.458   11.359   35.235   28.858   35.235   28.858   35.235   28.858   28.458   16.065   28.458   16.065 0.000000 0.000000 
1 1 1    0   30   36 o   14.249   7.2124 -30.3719   27.709 -30.3719   27.709 -30.3719   27.709   14.249   10.200   14.249   10.200 0.000000 0.000000 
1 1 1    0   30   37 f   14.178   7.2222 -37.3363   29.778 -37.3363   29.778 -37.3363   29.778   14.178   10.214   14.178   10.214 0.000000 0.000000 
1 1 1    0   31    1 o   36.399   2.8797   28.429   5.9177   28.429   5.9177   28.429   5.9177   36.399   4.0725   36.399   4.0725 0.000000 0.000000 
1 1 1    0   31    2 o   82.478   2.5196  141.468   12.070  141.468   12.070  141.468   12.070   82.478   3.5632   82.478   3.5632 0.000000 0.000000 
1 1 1    0   31    4 o   70.036   3.9167  103.744   15.770  103.744   15.770  103.744   15.770   70.036   5.5391   70.036   5.5391 0.000000 0.000000 
1 1 1    0   31    5 o   88.996   7.0725  173.102   35.521  173.102   35.521  173.102   35.521   88.996   10.002   88.996   10.002 0.000000 0.000000 
1 1 1    0   31    6 o   68.808   4.4292  100.957   17.438  100.957   17.438  100.957   17.438   68.808   6.2639   68.808   6.2639 0.000000 0.000000 
1 1 1    0   31    7 f   70.152   4.5249  105.031   18.161  105.031   18.161  105.031   18.161   70.152   6.3992   70.152   6.3992 0.000000 0.000000 
1 1 1    0   31    8 o   52.560   6.5794   63.142   18.285   63.142   18.285   63.142   18.285   52.560   9.3046   52.560   9.3046 0.000000 0.000000 
1 1 1    0   31    9 o  131.813   4.5459  364.998   34.761  364.998   34.761  364.998   34.761  131.813   6.4288  131.813   6.4288 0.000000 0.000000 
1 1 1    0   31   10 o   86.840   4.8290  160.448   24.112  160.448   24.112  160.448   24.112   86.840   6.8292   86.840   6.8292 0.000000 0.000000 
1 1 1    0   31   11 o   50.595   8.6866   63.032   22.216   63.032   22.216   63.032   22.216   50.595   12.285   50.595   12.285 0.000000 0.000000 
1 1 1    0   31   12 o   29.260   12.681   20.349   41.525   20.349   41.525   20.349   41.525   29.260   17.934   29.260   17.934 0.000000 0.000000 
1 1 1    0   31   13 o  144.483   4.0118  436.737   33.691  436.737   33.691  436.737   33.691  144.483   5.6735  144.483   5.6735 0.000000 0.000000 
1 1 1    0   31   14 o   52.240   9.1046   67.999   24.019   67.999   24.019   67.999   24.019   52.240   12.876   52.240   12.876 0.000000 0.000000 
1 1 1    0   31   15 o   24.972   10.190   18.585   23.955   18.585   23.955   18.585   23.955   24.972   14.411   24.972   14.411 0.000000 0.000000 
1 1 1    0   31   16 o   33.053   11.015   35.819   23.951   35.819   23.951   35.819   23.951   33.053   15.578   33.053   15.578 0.000000 0.000000 
1 1 1    0   31   17 o   30.142   11.654   30.436   29.246   30.436   29.246   30.436   29.246   30.142   16.481   30.142   16.481 0.000000 0.000000 
1 1 1    0   31   18 o   38.743   11.191   46.440   24.896   46.440   24.896   46.440   24.896   38.743   15.826   38.743   15.826 0.000000 0.000000 
1 1 1    0   31   19 o  140.529   4.4022  416.304   35.923  416.304   35.923  416.304   35.923  140.529   6.2256  140.529   6.2256 0.000000 0.000000 
1 1 1    0   31   20 o   35.561   14.439   45.250   47.724   45.250   47.724   45.250   47.724   35.561   20.420   35.561   20.420 0.000000 0.000000 
1 1 1    0   31   21 o   47.518   10.807   63.330   26.438   63.330   26.438   63.330   26.438   47.518   15.283   47.518   15.283 0.000000 0.000000 
1 1 1    0   31   22 o   37.032   11.588   45.086   26.365   45.086   26.365   45.086   26.365   37.032   16.388   37.032   16.388 0.000000 0.000000 
1 1 1    0   31   23 o   23.558   10.142   14.642   26.165   14.642   26.165   14.642   26.165   23.558   14.343   23.558   14.343 0.000000 0.000000 
1 1 1    0   31   24 o   19.892   9.2044   1.2062   26.443   1.2062   26.443   1.2062   26.443   19.892   13.017   19.892   13.017 0.000000 0.000000 
1 1 1    0   31   25 o   92.848   2.2695  179.577   12.257  179.577   12.257  179.577   12.257   92.848   3.2095   92.848   3.2095 0.000000 0.000000 
1 1 1    0   31   26 o   50.961   2.7879   55.097   8.1729   55.097   8.1729   55.097   8.1729   50.961   3.9427   50.961   3.9427 0.000000 0.000000 
1 1 1    0   31   27 o   56.760   2.9138   68.329   9.5300   68.329   9.5300   68.329   9.5300   56.760   4.1208   56.760   4.1208 0.000000 0.000000 
1 1 1    0   31   28 o   55.582   3.1459   65.942   10.049   65.942   10.049   65.942   10.049   55.582   4.4490   55.582   4.4490 0.000000 0.000000 
1 1 1    0   31   29 o   17.262   6.2937   9.7219   8.1177   9.7219   8.1177   9.7219   8.1177   17.262   8.9006   17.262   8.9006 0.000000 0.000000 
1 1 1    0   31   30 o   15.753   7.7952 -19.3279   26.711 -19.3279   26.711 -19.3279   26.711   15.753   11.024   15.753   11.024 0.000000 0.000000 
1 1 1    0   31   31 o   22.606   10.033   14.739   27.559   14.739   27.559   14.739   27.559   22.606   14.189   22.606   14.189 0.000000 0.000000 
1 1 1    0   31   32 o   25.271   10.772   24.519   28.912   24.519   28.912   24.519   28.912   25.271   15.234   25.271   15.234 0.000000 0.000000 
1 1 1    0   31   33 f   19.083   9.3229  -9.8693   35.066  -9.8693   35.066  -9.8693   35.066   19.083   13.185   19.083   13.185 0.000000 0.000000 
1 1 1    0   31   34 o   21.449   10.560  -7.0841   47.307  -7.0841   47.307  -7.0841   47.307   21.449   14.934   21.449   14.934 0.000000 0.000000 
1 1 1    0   31   35 o   20.569   9.4530   11.066   27.215   11.066   27.215   11.066   27.215   20.569   13.369   20.569   13.369 0.000000 0.000000 
1 1 1    0   32    1 o   62.897   2.3340   82.511   8.5088   82.511   8.5088   82.511   8.5088   62.897   3.3007   62.897   3.3007 0.000000 0.000000 
1 1 1    0   32    2 o   56.060   2.6393   65.928   8.5425   65.928   8.5425   65.928   8.5425   56.060   3.7325   56.060   3.7325 0.000000 0.000000 
1 1 1    0   32    3 o   14.350   6.1450   4.2475   9.4944   4.2475   9.4944   4.2475   9.4944   14.350   8.6903   14.350   8.6903 0.000000 0.000000 
1 1 1    0   32    4 o   14.089   6.2069   2.8394   10.348   2.8394   10.348   2.8394   10.348   14.089   8.7779   14.089   8.7779 0.000000 0.000000 
1 1 1    0   32    5 f   71.233   8.5317  117.017   32.395  117.017   32.395  117.017   32.395   71.233   12.066   71.233   12.066 0.000000 0.000000 
1 1 1    0   32    6 o   68.584   4.2778  100.263   16.806  100.263   16.806  100.263   16.806   68.584   6.0497   68.584   6.0497 0.000000 0.000000 
1 1 1    0   32    7 o   18.808   7.8762   8.7800   14.940   8.7800   14.940   8.7800   14.940   18.808   11.139   18.808   11.139 0.000000 0.000000 
1 1 1    0   32    8 o   19.154   8.0291   9.1145   15.552   9.1145   15.552   9.1145   15.552   19.154   11.355   19.154   11.355 0.000000 0.000000 
1 1 1    0   32    9 o   56.410   7.7332   74.541   22.696   74.541   22.696   74.541   22.696   56.410   10.936   56.410   10.936 0.000000 0.000000 
1 1 1    0   32   10 o  103.880   4.2458  227.540   25.529  227.540   25.529  227.540   25.529  103.880   6.0045  103.880   6.0045 0.000000 0.000000 
1 1 1    0   32   11 o   38.570   10.116   43.225   21.134   43.225   21.134   43.225   21.134   38.570   14.306   38.570   14.306 0.000000 0.000000 
1 1 1    0   32   12 o   32.890   13.296   36.280   40.208   36.280   40.208   36.280   40.208   32.890   18.804   32.890   18.804 0.000000 0.000000 
1 1 1    0   32   13 o  119.834   4.2917  302.821   29.822  302.821   29.822  302.821   29.822  119.834   6.0693  119.834   6.0693 0.000000 0.000000 
1 1 1    0   32   14 o  103.903   4.7551  229.554   28.542  229.554   28.542  229.554   28.542  103.903   6.7248  103.903   6.7248 0.000000 0.000000 
1 1 1    0   32   15 o   16.456   7.8881  -9.3191   22.597  -9.3191   22.597  -9.3191   22.597   16.456   11.155   16.456   11.155 0.000000 0.000000 
1 1 1    0   32   16 o   32.324   11.102   34.789   24.528   34.789   24.528   34.789   24.528   32.324   15.701   32.324   15.701 0.000000 0.000000 
1 1 1    0   32   17 f   82.323   6.2516  149.029   29.144  149.029   29.144  149.029   29.144   82.323   8.8412   82.323   8.8412 0.000000 0.000000 
1 1 1    0   32   18 o   60.878   8.5808   89.266   27.050   89.266   27.050   89.266   27.050   60.878   12.135   60.878   12.135 0.000000 0.000000 
1 1 1    0   32   19 o   27.640   10.998   25.430   26.935   25.430   26.935   25.430   26.935   27.640   15.553   27.640   15.553 0.000000 0.000000 
1 1 1    0   32   20 o   14.086   7.0819 -30.9265   25.045 -30.9265   25.045 -30.9265   25.045   14.086   10.015   14.086   10.015 0.000000 0.000000 
1 1 1    0   32   21 o   19.613   9.0801   0.7082   25.786   0.7082   25.786   0.7082   25.786   19.613   12.841   19.613   12.841 0.000000 0.000000 
1 1 1    0   32   22 o   42.965   11.547   56.948   27.203   56.948   27.203   56.948   27.203   42.965   16.329   42.965   16.329 0.000000 0.000000 
1 1 1    0   32   23 o   26.201   10.699   22.820   26.439   22.820   26.439   22.820   26.439   26.201   15.131   26.201   15.131 0.000000 0.000000 
1 1 1    0   32   24 o   20.050   9.5171  -4.2578   31.378  -4.2578   31.378  -4.2578   31.378   20.050   13.459   20.050   13.459 0.000000 0.000000 
1 1 1    0   32   25 o   27.270   10.980   26.603   27.274   26.603   27.274   26.603   27.274   27.270   15.528   27.270   15.528 0.000000 0.000000 
1 1 1    0   32   26 o   11.632   6.0200 -59.2647   25.795 -59.2647   25.795 -59.2647   25.795   11.632   8.5136   11.632   8.5136 0.000000 0.000000 
1 1 1    0   32   27 o   29.580   13.218   33.328   48.738   33.328   48.738   33.328   48.738   29.580   18.692   29.580   18.692 0.000000 0.000000 
1 1 1    0   32   28 o   21.739   9.7172   11.632   26.368   11.632   26.368   11.632   26.368   21.739   13.742   21.739   13.742 0.000000 0.000000 
1 1 1    0   32   29 o   54.540   9.7562   80.659   26.839   80.659   26.839   80.659   26.839   54.540   13.797   54.540   13.797 0.000000 0.000000 
1 1 1    0   32   30 o   19.975   9.2404   5.7852   26.627   5.7852   26.627   5.7852   26.627   19.975   13.068   19.975   13.068 0.000000 0.000000 
1 1 1    0   32   31 o   18.542   9.0067  -8.0458   31.632  -8.0458   31.632  -8.0458   31.632   18.542   12.737   18.542   12.737 0.000000 0.000000 
1 1 1    0   32   32 o   20.416   9.3693   9.1444   26.608   9.1444   26.608   9.1444   26.608   20.416   13.250   20.416   13.250 0.000000 0.000000 
1 1 1    0   32   33 o   18.099   8.6793  -1.6140   27.418  -1.6140   27.418  -1.6140   27.418   18.099   12.274   18.099   12.274 0.000000 0.000000 
1 1 1    0   32   34 o   13.506   6.8907 -37.4011   27.613 -37.4011   27.613 -37.4011   27.613   13.506   9.7449   13.506   9.7449 0.000000 0.000000 
1 1 1    0   33    3 o  102.814   3.7012  221.847   22.065  221.847   22.065  221.847   22.065  102.814   5.2343  102.814   5.2343 0.000000 0.000000 
1 1 1    0   33    4 o   83.397   2.4631  144.830   11.934  144.830   11.934  144.830   11.934   83.397   3.4833   83.397   3.4833 0.000000 0.000000 
1 1 1    0   33    5 o   22.939   10.138   9.6652   27.830   9.6652   27.830   9.6652   27.830   22.939   14.338   22.939   14.338 0.000000 0.000000 
1 1 1    0   33    6 o   51.215   5.4677   58.790   15.233   58.790   15.233   58.790   15.233   51.215   7.7325   51.215   7.7325 0.000000 0.000000 
1 1 1    0   33    7 o   49.219   6.2860   55.885   16.298   55.885   16.298   55.885   16.298   49.219   8.8898   49.219   8.8898 0.000000 0.000000 
1 1 1    0   33    8 o   21.175   8.3503   13.646   15.354   13.646   15.354   13.646   15.354   21.175   11.809   21.175   11.809 0.000000 0.000000 
1 1 1    0   33    9 o   20.664   8.6204   11.426   17.776   11.426   17.776   11.426   17.776   20.664   12.191   20.664   12.191 0.000000 0.000000 
1 1 1    0   33   10 o   14.488   6.9212  -6.8269   17.106  -6.8269   17.106  -6.8269   17.106   14.488   9.7881   14.488   9.7881 0.000000 0.000000 
1 1 1    0   33   11 o   16.988   7.8524  -0.7141   19.173  -0.7141   19.173  -0.7141   19.173   16.988   11.105   16.988   11.105 0.000000 0.000000 
1 1 1    0   33   12 o   89.709   9.1764  186.610   45.094  186.610   45.094  186.610   45.094   89.709   12.977   89.709   12.977 0.000000 0.000000 
1 1 1    0   33   13 o   46.619   9.5544   57.372   22.546   57.372   22.546   57.372   22.546   46.619   13.512   46.619   13.512 0.000000 0.000000 
1 1 1    0   33   14 o   99.450   4.8468  211.018   27.809  211.018   27.809  211.018   27.809   99.450   6.8544   99.450   6.8544 0.000000 0.000000 
1 1 1    0   33   15 o   23.236   9.6985   15.421   22.521   15.421   22.521   15.421   22.521   23.236   13.716   23.236   13.716 0.000000 0.000000 
1 1 1    0   33   16 o   49.777   11.810   71.678   30.611   71.678   30.611   71.678   30.611   49.777   16.701   49.777   16.701 0.000000 0.000000 
1 1 1    0   33   17 o   25.926   10.446   21.643   24.709   21.643   24.709   21.643   24.709   25.926   14.773   25.926   14.773 0.000000 0.000000 
1 1 1    0   33   18 o   86.355   5.9591  163.873   29.359  163.873   29.359  163.873   29.359   86.355   8.4274   86.355   8.4274 0.000000 0.000000 
1 1 1    0   33   19 o   18.881   9.4473 -41.4183   42.748 -41.4183   42.748 -41.4183   42.748   18.881   13.361   18.881   13.361 0.000000 0.000000 
1 1 1    0   33   20 o   85.867   6.1096  163.192   29.889  163.192   29.889  163.192   29.889   85.867   8.6403   85.867   8.6403 0.000000 0.000000 
1 1 1    0   33   21 o   24.884   10.344   19.729   25.436   19.729   25.436   19.729   25.436   24.884   14.629   24.884   14.629 0.000000 0.000000 
1 1 1    0   33   22 o   48.204   11.394   68.811   28.569   68.811   28.569   68.811   28.569   48.204   16.114   48.204   16.114 0.000000 0.000000 
1 1 1    0   33   23 o   24.454   10.346   19.025   26.275   19.025   26.275   19.025   26.275   24.454   14.632   24.454   14.632 0.000000 0.000000 
1 1 1    0   33   24 o   18.512   8.9284  -9.4788   29.882  -9.4788   29.882  -9.4788   29.882   18.512   12.627   18.512   12.627 0.000000 0.000000 
1 1 1    0   33   25 o   17.189   8.2714  -7.5830   25.338  -7.5830   25.338  -7.5830   25.338   17.189   11.698   17.189   11.698 0.000000 0.000000 
1 1 1    0   33   26 o   43.641   11.428   61.078   26.996   61.078   26.996   61.078   26.996   43.641   16.162   43.641   16.162 0.000000 0.000000 
1 1 1    0   33   27 o   24.619   10.428   21.184   26.756   21.184   26.756   21.184   26.756   24.619   14.748   24.619   14.748 0.000000 0.000000 
1 1 1    0   33   28 f   31.056   11.342   38.141   26.393   38.141   26.393   38.141   26.393   31.056   16.041   31.056   16.041 0.000000 0.000000 
1 1 1    0   33   29 o   24.156   10.299   21.608   26.435   21.608   26.435   21.608   26.435   24.156   14.564   24.156   14.564 0.000000 0.000000 
1 1 1    0   33   30 o   21.530   9.7437   12.543   27.500   12.543   27.500   12.543   27.500   21.530   13.780   21.530   13.780 0.000000 0.000000 
1 1 1    0   33   31 o   19.415   9.3217  -0.6334   31.825  -0.6334   31.825  -0.6334   31.825   19.415   13.183   19.415   13.183 0.000000 0.000000 
1 1 1    0   33   32 o   24.703   10.518   25.824   27.501   25.824   27.501   25.824   27.501   24.703   14.875   24.703   14.875 0.000000 0.000000 
1 1 1    0   34    2 f   64.029   2.4181   85.680   8.9722   85.680   8.9722   85.680   8.9722   64.029   3.4197   64.029   3.4197 0.000000 0.000000 
1 1 1    0   34    4 o   24.414   5.1312   15.350   6.3586   15.350   6.3586   15.350   6.3586   24.414   7.2566   24.414   7.2566 0.000000 0.000000 
1 1 1    0   34    5 o   27.398   11.096   23.682   28.068   23.682   28.068   23.682   28.068   27.398   15.692   27.398   15.692 0.000000 0.000000 
1 1 1    0   34    6 o   10.574   5.2017  -9.8478   11.414  -9.8478   11.414  -9.8478   11.414   10.574   7.3563   10.574   7.3563 0.000000 0.000000 
1 1 1    0   34    7 o   75.680   4.2336  122.070   18.419  122.070   18.419  122.070   18.419   75.680   5.9872   75.680   5.9872 0.000000 0.000000 
1 1 1    0   34    8 o   51.042   6.3728   60.020   17.208   60.020   17.208   60.020   17.208   51.042   9.0126   51.042   9.0126 0.000000 0.000000 
1 1 1    0   34    9 o   13.650   6.6156  -9.9809   16.852  -9.9809   16.852  -9.9809   16.852   13.650   9.3559   13.650   9.3559 0.000000 0.000000 
1 1 1    0   34   10 o   63.342   5.6298   88.765   19.908   88.765   19.908   88.765   19.908   63.342   7.9617   63.342   7.9617 0.000000 0.000000 
1 1 1    0   34   11 o   66.448   5.7104   97.693   21.261   97.693   21.261   97.693   21.261   66.448   8.0757   66.448   8.0757 0.000000 0.000000 
1 1 1    0   34   12 o   46.199   14.432   73.734   40.898   73.734   40.898   73.734   40.898   46.199   20.410   46.199   20.410 0.000000 0.000000 
1 1 1    0   34   13 o   53.272   8.4524   69.924   22.927   69.924   22.927   69.924   22.927   53.272   11.953   53.272   11.953 0.000000 0.000000 
1 1 1    0   34   14 o   22.661   9.5641   14.213   22.339   14.213   22.339   14.213   22.339   22.661   13.526   22.661   13.526 0.000000 0.000000 
1 1 1    0   34   15 o   16.298   7.8633 -10.6764   23.222 -10.6764   23.222 -10.6764   23.222   16.298   11.120   16.298   11.120 0.000000 0.000000 
1 1 1    0   34   16 o   21.204   9.6356   5.5866   27.230   5.5866   27.230   5.5866   27.230   21.204   13.627   21.204   13.627 0.000000 0.000000 
1 1 1    0   34   17 o   24.500   10.262   18.222   25.372   18.222   25.372   18.222   25.372   24.500   14.513   24.500   14.513 0.000000 0.000000 
1 1 1    0   34   18 o   43.522   10.991   56.568   25.467   56.568   25.467   56.568   25.467   43.522   15.543   43.522   15.543 0.000000 0.000000 
1 1 1    0   34   19 o   38.836   14.556   61.401   44.318   61.401   44.318   61.401   44.318   38.836   20.585   38.836   20.585 0.000000 0.000000 
1 1 1    0   34   20 o   18.248   8.6049  -2.7669   24.920  -2.7669   24.920  -2.7669   24.920   18.248   12.169   18.248   12.169 0.000000 0.000000 
1 1 1    0   34   21 o   62.560   8.3289   95.792   27.245   95.792   27.245   95.792   27.245   62.560   11.779   62.560   11.779 0.000000 0.000000 
1 1 1    0   34   22 o   20.110   9.2339   4.7711   25.889   4.7711   25.889   4.7711   25.889   20.110   13.059   20.110   13.059 0.000000 0.000000 
1 1 1    0   34   23 o   21.431   9.6974   9.5337   27.226   9.5337   27.226   9.5337   27.226   21.431   13.714   21.431   13.714 0.000000 0.000000 
1 1 1    0   34   24 o   14.379   7.1987 -24.9015   24.935 -24.9015   24.935 -24.9015   24.935   14.379   10.180   14.379   10.180 0.000000 0.000000 
1 1 1    0   34   25 o   20.963   9.4161   10.042   25.093   10.042   25.093   10.042   25.093   20.963   13.316   20.963   13.316 0.000000 0.000000 
1 1 1    0   34   26 o   27.159   12.346   26.354   44.761   26.354   44.761   26.354   44.761   27.159   17.461   27.159   17.461 0.000000 0.000000 
1 1 1    0   34   27 o   18.254   8.6573  -0.7804   25.862  -0.7804   25.862  -0.7804   25.862   18.254   12.243   18.254   12.243 0.000000 0.000000 
1 1 1    0   34   28 o   16.443   8.0604 -12.4745   26.791 -12.4745   26.791 -12.4745   26.791   16.443   11.399   16.443   11.399 0.000000 0.000000 
1 1 1    0   34   29 o   18.688   8.8226   2.0615   26.328   2.0615   26.328   2.0615   26.328   18.688   12.477   18.688   12.477 0.000000 0.000000 
1 1 1    0   34   30 o   17.763   8.5387  -2.4783   26.862  -2.4783   26.862  -2.4783   26.862   17.763   12.076   17.763   12.076 0.000000 0.000000 
1 1 1    0   34   31 o   42.264   11.966   66.038   28.630   66.038   28.630   66.038   28.630   42.264   16.922   42.264   16.922 0.000000 0.000000 
1 1 1    0   35    3 o   30.976   3.5852   21.517   5.9563   21.517   5.9563   21.517   5.9563   30.976   5.0703   30.976   5.0703 0.000000 0.000000 
1 1 1    0   35    4 o   33.084   3.7795   24.535   6.7223   24.535   6.7223   24.535   6.7223   33.084   5.3450   33.084   5.3450 0.000000 0.000000 
1 1 1    0   35    6 o   31.797   7.8677   28.384   13.213   28.384   13.213   28.384   13.213   31.797   11.127   31.797   11.127 0.000000 0.000000 
1 1 1    0   35    7 o  127.561   3.4418  341.118   25.524  341.118   25.524  341.118   25.524  127.561   4.8674  127.561   4.8674 0.000000 0.000000 
1 1 1    0   35    8 o   17.468   7.5650   6.4650   14.754   6.4650   14.754   6.4650   14.754   17.468   10.699   17.468   10.699 0.000000 0.000000 
1 1 1    0   35    9 o   97.559   4.7270  203.494   26.609  203.494   26.609  203.494   26.609   97.559   6.6849   97.559   6.6849 0.000000 0.000000 
1 1 1    0   35   10 o   19.533   8.2551   9.9189   16.689   9.9189   16.689   9.9189   16.689   19.533   11.674   19.533   11.674 0.000000 0.000000 
1 1 1    0   35   11 o   91.100   4.3132  176.918   22.684  176.918   22.684  176.918   22.684   91.100   6.0998   91.100   6.0998 0.000000 0.000000 
1 1 1    0   35   12 o   55.518   7.5159   73.465   21.754   73.465   21.754   73.465   21.754   55.518   10.629   55.518   10.629 0.000000 0.000000 
1 1 1    0   35   13 o  147.882   3.8640  460.827   33.227  460.827   33.227  460.827   33.227  147.882   5.4645  147.882   5.4645 0.000000 0.000000 
1 1 1    0   35   14 o   20.913   8.9899   11.121   20.486   11.121   20.486   11.121   20.486   20.913   12.714   20.913   12.714 0.000000 0.000000 
1 1 1    0   35   15 o   19.694   8.8422   6.1641   22.100   6.1641   22.100   6.1641   22.100   19.694   12.505   19.694   12.505 0.000000 0.000000 
1 1 1    0   35   16 o   20.856   9.6065   3.9113   28.320   3.9113   28.320   3.9113   28.320   20.856   13.586   20.856   13.586 0.000000 0.000000 
1 1 1    0   35   17 o   18.029   8.4051  -0.2949   22.678  -0.2949   22.678  -0.2949   22.678   18.029   11.887   18.029   11.887 0.000000 0.000000 
1 1 1    0   35   18 f   23.855   10.025   18.110   24.352   18.110   24.352   18.110   24.352   23.855   14.177   23.855   14.177 0.000000 0.000000 
1 1 1    0   35   19 o   79.498   10.586  162.238   44.003  162.238   44.003  162.238   44.003   79.498   14.971   79.498   14.971 0.000000 0.000000 
1 1 1    0   35   20 o   18.697   8.7302   0.6974   24.627   0.6974   24.627   0.6974   24.627   18.697   12.346   18.697   12.346 0.000000 0.000000 
1 1 1    0   35   21 o   22.589   9.8833   14.950   25.783   14.950   25.783   14.950   25.783   22.589   13.977   22.589   13.977 0.000000 0.000000 
1 1 1    0   35   22 o   28.855   10.941   31.853   25.300   31.853   25.300   31.853   25.300   28.855   15.472   28.855   15.472 0.000000 0.000000 
1 1 1    0   35   23 o   26.058   11.260   24.431   32.525   24.431   32.525   24.431   32.525   26.058   15.925   26.058   15.925 0.000000 0.000000 
1 1 1    0   35   24 o   17.172   8.2954  -7.6085   26.027  -7.6085   26.027  -7.6085   26.027   17.172   11.731   17.172   11.731 0.000000 0.000000 
1 1 1    0   35   25 o   15.405   7.6316 -17.7523   25.812 -17.7523   25.812 -17.7523   25.812   15.405   10.793   15.405   10.793 0.000000 0.000000 
1 1 1    0   35   26 o   23.491   11.131   10.173   42.583   10.173   42.583   10.173   42.583   23.491   15.742   23.491   15.742 0.000000 0.000000 
1 1 1    0   35   27 o   14.679   7.3343 -21.2155   25.473 -21.2155   25.473 -21.2155   25.473   14.679   10.372   14.679   10.372 0.000000 0.000000 
1 1 1    0   35   28 o   12.069   6.2163 -46.7220   25.483 -46.7220   25.483 -46.7220   25.483   12.069   8.7912   12.069   8.7912 0.000000 0.000000 
1 1 1    0   35   29 o   13.311   6.7546 -30.2750   24.963 -30.2750   24.963 -30.2750   24.963   13.311   9.5525   13.311   9.5525 0.000000 0.000000 
1 1 1    0   36    3 o   13.427   4.6449   5.5920   4.3064   5.5920   4.3064   5.5920   4.3064   13.427   6.5689   13.427   6.5689 0.000000 0.000000 
1 1 1    0   36    4 o   11.384   5.2936  -1.1606   8.9051  -1.1606   8.9051  -1.1606   8.9051   11.384   7.4862   11.384   7.4862 0.000000 0.000000 
1 1 1    0   36    5 o   44.145   3.2471   41.940   8.1539   41.940   8.1539   41.940   8.1539   44.145   4.5921   44.145   4.5921 0.000000 0.000000 
1 1 1    0   36    6 o   35.881   3.9243   28.799   7.6283   28.799   7.6283   28.799   7.6283   35.881   5.5498   35.881   5.5498 0.000000 0.000000 
1 1 1    0   36    7 o   82.529   3.9561  144.936   18.843  144.936   18.843  144.936   18.843   82.529   5.5948   82.529   5.5948 0.000000 0.000000 
1 1 1    0   36    8 o   44.628   6.7958   48.092   15.523   48.092   15.523   48.092   15.523   44.628   9.6106   44.628   9.6106 0.000000 0.000000 
1 1 1    0   36    9 o   15.661   7.2550  -0.5823   16.497  -0.5823   16.497  -0.5823   16.497   15.661   10.260   15.661   10.260 0.000000 0.000000 
1 1 1    0   36   10 o   29.505   9.2493   27.992   16.796   27.992   16.796   27.992   16.796   29.505   13.080   29.505   13.080 0.000000 0.000000 
1 1 1    0   36   11 o   16.765   7.6076   2.6521   16.901   2.6521   16.901   2.6521   16.901   16.765   10.759   16.765   10.759 0.000000 0.000000 
1 1 1    0   36   12 o   12.491   6.1872 -15.4207   16.946 -15.4207   16.946 -15.4207   16.946   12.491   8.7500   12.491   8.7500 0.000000 0.000000 
1 1 1    0   36   13 o   33.665   10.239   37.073   20.621   37.073   20.621   37.073   20.621   33.665   14.480   33.665   14.480 0.000000 0.000000 
1 1 1    0   36   14 o   33.662   10.468   37.803   21.522   37.803   21.522   37.803   21.522   33.662   14.804   33.662   14.804 0.000000 0.000000 
1 1 1    0   36   15 o   13.131   6.5339 -18.8400   19.554 -18.8400   19.554 -18.8400   19.554   13.131   9.2403   13.131   9.2403 0.000000 0.000000 
1 1 1    0   36   16 o   15.047   7.4561 -20.2173   24.679 -20.2173   24.679 -20.2173   24.679   15.047   10.545   15.047   10.545 0.000000 0.000000 
1 1 1    0   36   17 o   16.431   7.8283  -4.8752   21.606  -4.8752   21.606  -4.8752   21.606   16.431   11.071   16.431   11.071 0.000000 0.000000 
1 1 1    0   36   18 f   50.317   9.6133   69.180   24.385   69.180   24.385   69.180   24.385   50.317   13.595   50.317   13.595 0.000000 0.000000 
1 1 1    0   36   19 o   24.320   10.095   20.755   24.165   20.755   24.165   20.755   24.165   24.320   14.277   24.320   14.277 0.000000 0.000000 
1 1 1    0   36   20 o   26.543   10.487   26.468   24.265   26.468   24.265   26.468   24.265   26.543   14.830   26.543   14.830 0.000000 0.000000 
1 1 1    0   36   21 o   14.468   7.2153 -21.6678   24.262 -21.6678   24.262 -21.6678   24.262   14.468   10.204   14.468   10.204 0.000000 0.000000 
1 1 1    0   36   22 o   15.393   7.5744 -14.4719   24.247 -14.4719   24.247 -14.4719   24.247   15.393   10.712   15.393   10.712 0.000000 0.000000 
1 1 1    0   36   23 o   19.087   9.2663  -7.4468   33.374  -7.4468   33.374  -7.4468   33.374   19.087   13.105   19.087   13.105 0.000000 0.000000 
1 1 1    0   36   24 o   21.834   9.7651   14.142   26.670   14.142   26.670   14.142   26.670   21.834   13.810   21.834   13.810 0.000000 0.000000 
1 1 1    0   36   25 o   16.724   8.1367  -8.2586   26.068  -8.2586   26.068  -8.2586   26.068   16.724   11.507   16.724   11.507 0.000000 0.000000 
1 1 1    0   36   26 o   15.992   7.8415 -10.7108   25.399 -10.7108   25.399 -10.7108   25.399   15.992   11.090   15.992   11.090 0.000000 0.000000 
1 1 1    0   36   27 o   14.295   7.1820 -23.2747   25.596 -23.2747   25.596 -23.2747   25.596   14.295   10.157   14.295   10.157 0.000000 0.000000 
1 1 1    0   37    4 o   8.5258   3.9321  -0.3637   4.7672  -0.3637   4.7672  -0.3637   4.7672   8.5258   5.5608   8.5258   5.5608 0.000000 0.000000 
1 1 1    0   37    5 o   32.431   3.9496   23.915   6.8064   23.915   6.8064   23.915   6.8064   32.431   5.5856   32.431   5.5856 0.000000 0.000000 
1 1 1    0   37    6 o   25.210   6.3974   17.971   8.6033   17.971   8.6033   17.971   8.6033   25.210   9.0474   25.210   9.0474 0.000000 0.000000 
1 1 1    0   37    7 o   33.652   4.2205   25.937   7.5070   25.937   7.5070   25.937   7.5070   33.652   5.9687   33.652   5.9687 0.000000 0.000000 
1 1 1    0   37    8 o   59.709   4.8125   78.691   16.198   78.691   16.198   78.691   16.198   59.709   6.8060   59.709   6.8060 0.000000 0.000000 
1 1 1    0   37    9 o  100.911   4.5748  219.057   26.673  219.057   26.673  219.057   26.673  100.911   6.4697  100.911   6.4697 0.000000 0.000000 
1 1 1    0   37   10 o   39.307   8.4385   42.191   16.888   42.191   16.888   42.191   16.888   39.307   11.934   39.307   11.934 0.000000 0.000000 
1 1 1    0   37   11 f   72.429   5.0637  115.486   20.913  115.486   20.913  115.486   20.913   72.429   7.1612   72.429   7.1612 0.000000 0.000000 
1 1 1    0   37   12 o   9.8227   5.0564 -34.8558   16.717 -34.8558   16.717 -34.8558   16.717   9.8227   7.1508   9.8227   7.1508 0.000000 0.000000 
1 1 1    0   37   13 o   29.090   9.9516   29.666   19.679   29.666   19.679   29.666   19.679   29.090   14.074   29.090   14.074 0.000000 0.000000 
1 1 1    0   37   14 o   11.326   5.7687 -30.0630   18.970 -30.0630   18.970 -30.0630   18.970   11.326   8.1582   11.326   8.1582 0.000000 0.000000 
1 1 1    0   37   15 o   18.478   8.3808   5.3845   20.481   5.3845   20.481   5.3845   20.481   18.478   11.852   18.478   11.852 0.000000 0.000000 
1 1 1    0   37   16 o   28.996   10.360   30.902   21.744   30.902   21.744   30.902   21.744   28.996   14.652   28.996   14.652 0.000000 0.000000 
1 1 1    0   37   17 o   18.081   8.3417   2.8898   21.481   2.8898   21.481   2.8898   21.481   18.081   11.797   18.081   11.797 0.000000 0.000000 
1 1 1    0   37   18 o   23.416   9.8925   18.805   23.948   18.805   23.948   18.805   23.948   23.416   13.990   23.416   13.990 0.000000 0.000000 
1 1 1    0   37   19 o   24.755   10.152   22.935   23.962   22.935   23.962   22.935   23.962   24.755   14.357   24.755   14.357 0.000000 0.000000 
1 1 1    0   37   20 o   22.044   9.6213   15.657   24.283   15.657   24.283   15.657   24.283   22.044   13.607   22.044   13.607 0.000000 0.000000 
1 1 1    0   37   21 o   16.066   7.8526 -11.1439   24.950 -11.1439   24.950 -11.1439   24.950   16.066   11.105   16.066   11.105 0.000000 0.000000 
1 1 1    0   37   22 o   32.786   11.606   43.889   27.138   43.889   27.138   43.889   27.138   32.786   16.413   32.786   16.413 0.000000 0.000000 
1 1 1    0   37   23 o   32.563   11.399   43.474   26.063   43.474   26.063   43.474   26.063   32.563   16.121   32.563   16.121 0.000000 0.000000 
1 1 1    0   37   24 o   21.008   9.5163   13.198   26.305   13.198   26.305   13.198   26.305   21.008   13.458   21.008   13.458 0.000000 0.000000 
1 1 1    0   37   25 o   22.953   10.920   13.656   41.764   13.656   41.764   13.656   41.764   22.953   15.444   22.953   15.444 0.000000 0.000000 
1 1 1    0   38    4 o   52.020   2.5934   57.215   7.7792   57.215   7.7792   57.215   7.7792   52.020   3.6676   52.020   3.6676 0.000000 0.000000 
1 1 1    0   38    5 o   51.788   4.6646   59.712   13.467   59.712   13.467   59.712   13.467   51.788   6.5968   51.788   6.5968 0.000000 0.000000 
1 1 1    0   38    6 o   43.140   4.4440   41.844   10.490   41.844   10.490   41.844   10.490   43.140   6.2847   43.140   6.2847 0.000000 0.000000 
1 1 1    0   38    7 o   43.347   3.5802   41.090   8.7293   41.090   8.7293   41.090   8.7293   43.347   5.0632   43.347   5.0632 0.000000 0.000000 
1 1 1    0   38    8 o   60.623   3.0175   78.095   10.549   78.095   10.549   78.095   10.549   60.623   4.2675   60.623   4.2675 0.000000 0.000000 
1 1 1    0   38    9 o   15.519   7.2978  -1.9057   17.706  -1.9057   17.706  -1.9057   17.706   15.519   10.321   15.519   10.321 0.000000 0.000000 
1 1 1    0   38   10 o   90.047   4.2937  175.197   22.316  175.197   22.316  175.197   22.316   90.047   6.0722   90.047   6.0722 0.000000 0.000000 
1 1 1    0   38   11 o   21.858   8.7488   16.291   17.180   16.291   17.180   16.291   17.180   21.858   12.373   21.858   12.373 0.000000 0.000000 
1 1 1    0   38   12 o   15.692   7.3194  -0.3934   17.235  -0.3934   17.235  -0.3934   17.235   15.692   10.351   15.692   10.351 0.000000 0.000000 
1 1 1    0   38   13 o   14.351   6.9061  -6.6016   17.670  -6.6016   17.670  -6.6016   17.670   14.351   9.7667   14.351   9.7667 0.000000 0.000000 
1 1 1    0   38   14 o   12.782   6.3901 -19.7949   19.424 -19.7949   19.424 -19.7949   19.424   12.782   9.0369   12.782   9.0369 0.000000 0.000000 
1 1 1    0   38   15 o   21.095   8.9957   14.005   20.179   14.005   20.179   14.005   20.179   21.095   12.722   21.095   12.722 0.000000 0.000000 
1 1 1    0   38   16 f   18.242   8.3779   4.5242   21.328   4.5242   21.328   4.5242   21.328   18.242   11.848   18.242   11.848 0.000000 0.000000 
1 1 1    0   38   17 o   22.413   9.5354   17.421   22.567   17.421   22.567   17.421   22.567   22.413   13.485   22.413   13.485 0.000000 0.000000 
1 1 1    0   38   18 o   23.051   10.812   10.835   38.469   10.835   38.469   10.835   38.469   23.051   15.291   23.051   15.291 0.000000 0.000000 
1 1 1    0   38   19 o   14.177   7.0699 -19.6080   23.288 -19.6080   23.288 -19.6080   23.288   14.177   9.9983   14.177   9.9983 0.000000 0.000000 
1 1 1    0   38   20 o   29.279   11.024   35.928   25.521   35.928   25.521   35.928   25.521   29.279   15.591   29.279   15.591 0.000000 0.000000 
1 1 1    0   38   21 o   21.454   9.5187   15.350   24.780   15.350   24.780   15.350   24.780   21.454   13.461   21.454   13.461 0.000000 0.000000 
1 1 1    0   38   22 o   22.651   10.343   17.413   31.882   17.413   31.882   17.413   31.882   22.651   14.627   22.651   14.627 0.000000 0.000000 
1 1 1    0   38   23 o   27.007   10.794   32.216   26.099   32.216   26.099   32.216   26.099   27.007   15.265   27.007   15.265 0.000000 0.000000 
1 1 1    0   39    8 o   33.615   9.1012   35.046   16.849   35.046   16.849   35.046   16.849   33.615   12.871   33.615   12.871 0.000000 0.000000 
1 1 1    0   39    9 o   41.467   8.7896   47.996   18.522   47.996   18.522   47.996   18.522   41.467   12.430   41.467   12.430 0.000000 0.000000 
1 1 1    0   39   10 o   39.481   8.0785   42.529   16.142   42.529   16.142   42.529   16.142   39.481   11.425   39.481   11.425 0.000000 0.000000 
1 1 1    0   39   11 o   28.563   9.2286   28.142   16.738   28.142   16.738   28.142   16.738   28.563   13.051   28.563   13.051 0.000000 0.000000 
1 1 1    0   39   12 o   13.578   6.9518 -46.8066   29.346 -46.8066   29.346 -46.8066   29.346   13.578   9.8314   13.578   9.8314 0.000000 0.000000 
1 1 1    0   39   13 o   21.503   8.8062   16.220   17.992   16.220   17.992   16.220   17.992   21.503   12.454   21.503   12.454 0.000000 0.000000 
1 1 1    0   39   14 o   41.434   9.5121   51.012   20.334   51.012   20.334   51.012   20.334   41.434   13.452   41.434   13.452 0.000000 0.000000 
1 1 1    0   39   15 o   19.684   8.6865   10.742   20.351   10.742   20.351   10.742   20.351   19.684   12.285   19.684   12.285 0.000000 0.000000 
1 1 1    0   39   16 o   24.681   9.8979   23.867   22.047   23.867   22.047   23.867   22.047   24.681   13.998   24.681   13.998 0.000000 0.000000 
1 1 1    0   39   17 o   17.634   8.2743   2.0222   22.563   2.0222   22.563   2.0222   22.563   17.634   11.702   17.634   11.702 0.000000 0.000000 
1 1 1    0   39   18 o   24.714   11.268   23.991   37.645   23.991   37.645   23.991   37.645   24.714   15.936   24.714   15.936 0.000000 0.000000 
1 1 1    0   39   19 o   26.019   10.299   28.617   23.456   28.617   23.456   28.617   23.456   26.019   14.565   26.019   14.565 0.000000 0.000000 
1 1 1    0   39   20 o   27.538   10.617   32.610   24.198   32.610   24.198   32.610   24.198   27.538   15.015   27.538   15.015 0.000000 0.000000 
1 1 1    1    0    1 o  235.225   3.0320  1143.53   41.569  1143.53   41.569  1143.53   41.569  235.225   4.2879  235.225   4.2879 0.000000 0.000000 
1 1 1    1    0    2 o  321.447   3.6628  2135.01   68.636  2135.01   68.636  2135.01   68.636  321.447   5.1800  321.447   5.1800 0.000000 0.000000 
1 1 1    1    0    3 o   50.032   1.7475   52.008   5.0713   52.008   5.0713   52.008   5.0713   50.032   2.4713   50.032   2.4713 0.000000 0.000000 
1 1 1    1    0    4 o  123.720   1.7734  316.093   12.786  316.093   12.786  316.093   12.786  123.720   2.5079  123.720   2.5079 0.000000 0.000000 
1 1 1    1    0    5 o  284.984   2.4301  1676.09   40.382  1676.09   40.382  1676.09   40.382  284.984   3.4367  284.984   3.4367 0.000000 0.000000 
1 1 1    1    0    6 o  143.362   1.8918  424.343   15.807  424.343   15.807  424.343   15.807  143.362   2.6754  143.362   2.6754 0.000000 0.000000 
1 1 1    1    0    7 o  620.515   4.3697  7946.17  158.119  7946.17  158.119  7946.17  158.119  620.515   6.1796  620.515   6.1796 0.000000 0.000000 
1 1 1    1    0    8 o  183.433   2.9172  695.088   31.177  695.088   31.177  695.088   31.177  183.433   4.1255  183.433   4.1255 0.000000 0.000000 
1 1 1    1    0    9 o  217.863   2.1921  979.587   27.843  979.587   27.843  979.587   27.843  217.863   3.1001  217.863   3.1001 0.000000 0.000000 
1 1 1    1    0   10 o  235.580   2.2786  1145.44   31.298  1145.44   31.298  1145.44   31.298  235.580   3.2225  235.580   3.2225 0.000000 0.000000 
1 1 1    1    0   11 o  497.027   3.6443  5100.05  105.626  5100.05  105.626  5100.05  105.626  497.027   5.1538  497.027   5.1538 0.000000 0.000000 
1 1 1    1    0   12 o  267.459   3.4533  1477.68   53.832  1477.68   53.832  1477.68   53.832  267.459   4.8837  267.459   4.8837 0.000000 0.000000 
1 1 1    1    0   13 o   34.243   5.8065   27.999   10.059   27.999   10.059   27.999   10.059   34.243   8.2116   34.243   8.2116 0.000000 0.000000 
1 1 1    1    0   14 o  398.367   3.1163  3275.24   72.390  3275.24   72.390  3275.24   72.390  398.367   4.4070  398.367   4.4070 0.000000 0.000000 
1 1 1    1    0   15 o  126.540   2.5048  331.049   18.455  331.049   18.455  331.049   18.455  126.540   3.5423  126.540   3.5423 0.000000 0.000000 
1 1 1    1    0   16 o  316.822   2.7886  2071.35   51.515  2071.35   51.515  2071.35   51.515  316.822   3.9437  316.822   3.9437 0.000000 0.000000 
1 1 1    1    0   17 o  381.307   3.1051  3000.39   69.039  3000.39   69.039  3000.39   69.039  381.307   4.3912  381.307   4.3912 0.000000 0.000000 
1 1 1    1    0   18 o  278.732   3.7595  1604.54   61.072  1604.54   61.072  1604.54   61.072  278.732   5.3168  278.732   5.3168 0.000000 0.000000 
1 1 1    1    0   19 o   24.722   9.1205   18.347   17.196   18.347   17.196   18.347   17.196   24.722   12.898   24.722   12.898 0.000000 0.000000 
1 1 1    1    0   20 o   63.104   5.1788   85.456   18.393   85.456   18.393   85.456   18.393   63.104   7.3239   63.104   7.3239 0.000000 0.000000 
1 1 1    1    0   21 o  275.525   2.7405  1566.92   44.023  1566.92   44.023  1566.92   44.023  275.525   3.8757  275.525   3.8757 0.000000 0.000000 
1 1 1    1    0   22 o  328.302   4.2030  2226.78   80.424  2226.78   80.424  2226.78   80.424  328.302   5.9439  328.302   5.9439 0.000000 0.000000 
1 1 1    1    0   23 o  236.105   2.6813  1150.96   36.905  1150.96   36.905  1150.96   36.905  236.105   3.7920  236.105   3.7920 0.000000 0.000000 
1 1 1    1    0   24 o  169.335   2.9292  592.711   28.893  592.711   28.893  592.711   28.893  169.335   4.1426  169.335   4.1426 0.000000 0.000000 
1 1 1    1    0   25 o   56.889   7.3348   73.254   21.944   73.254   21.944   73.254   21.944   56.889   10.373   56.889   10.373 0.000000 0.000000 
1 1 1    1    0   26 o   73.794   5.2669  115.963   22.141  115.963   22.141  115.963   22.141   73.794   7.4485   73.794   7.4485 0.000000 0.000000 
1 1 1    1    0   27 o   56.878   7.3881   73.415   22.070   73.415   22.070   73.415   22.070   56.878   10.448   56.878   10.448 0.000000 0.000000 
1 1 1    1    0   28 o   54.959   7.5619   69.225   21.608   69.225   21.608   69.225   21.608   54.959   10.694   54.959   10.694 0.000000 0.000000 
1 1 1    1    0   29 o   29.674   10.187   27.035   20.648   27.035   20.648   27.035   20.648   29.674   14.407   29.674   14.407 0.000000 0.000000 
1 1 1    1    0   30 o   15.677   7.4848  -9.2348   19.951  -9.2348   19.951  -9.2348   19.951   15.677   10.585   15.677   10.585 0.000000 0.000000 
1 1 1    1    0   31 o   33.675   12.947   33.998   35.893   33.998   35.893   33.998   35.893   33.675   18.310   33.675   18.310 0.000000 0.000000 
1 1 1    1    0   32 o   59.965   6.9530   80.371   22.355   80.371   22.355   80.371   22.355   59.965   9.8330   59.965   9.8330 0.000000 0.000000 
1 1 1    1    0   33 o   50.024   9.1885   61.519   23.169   61.519   23.169   61.519   23.169   50.024   12.995   50.024   12.995 0.000000 0.000000 
1 1 1    1    0   34 o   21.167   9.3894   5.2727   24.096   5.2727   24.096   5.2727   24.096   21.167   13.279   21.167   13.279 0.000000 0.000000 
1 1 1    1    0   35 f   14.159   7.0825 -29.6176   23.971 -29.6176   23.971 -29.6176   23.971   14.159   10.016   14.159   10.016 0.000000 0.000000 
1 1 1    1    0   36 o   19.586   9.2938 -10.6561   29.872 -10.6561   29.872 -10.6561   29.872   19.586   13.143   19.586   13.143 0.000000 0.000000 
1 1 1    1    0   37 o   23.144   10.533   1.9521   32.688   1.9521   32.688   1.9521   32.688   23.144   14.896   23.144   14.896 0.000000 0.000000 
1 1 1    1    0   38 o   36.967   14.552   43.630   46.536   43.630   46.536   43.630   46.536   36.967   20.580   36.967   20.580 0.000000 0.000000 
1 1 1    1    0   39 o   18.374   8.9259 -19.2528   31.087 -19.2528   31.087 -19.2528   31.087   18.374   12.623   18.374   12.623 0.000000 0.000000 
1 1 1    1    0   40 o   13.886   6.9904 -33.1315   24.703 -33.1315   24.703 -33.1315   24.703   13.886   9.8860   13.886   9.8860 0.000000 0.000000 
1 1 1    1    0   41 o   16.933   8.0991  -9.3246   23.553  -9.3246   23.553  -9.3246   23.553   16.933   11.454   16.933   11.454 0.000000 0.000000 
1 1 1    1    0   42 o   26.897   10.467   23.442   23.765   23.442   23.765   23.442   23.765   26.897   14.802   26.897   14.802 0.000000 0.000000 
1 1 1    1    0   43 o   42.914   12.121   57.029   29.396   57.029   29.396   57.029   29.396   42.914   17.141   42.914   17.141 0.000000 0.000000 
1 1 1    1    0   44 o   27.251   10.552   24.921   24.014   24.921   24.014   24.921   24.014   27.251   14.922   27.251   14.922 0.000000 0.000000 
1 1 1    1    0   45 o   23.233   9.8923   14.991   24.327   14.991   24.327   14.991   24.327   23.233   13.990   23.233   13.990 0.000000 0.000000 
1 1 1    1    0   46 o   17.232   8.2275  -6.8753   24.107  -6.8753   24.107  -6.8753   24.107   17.232   11.635   17.232   11.635 0.000000 0.000000 
1 1 1    1    0   47 o   24.955   10.082   21.360   23.102   21.360   23.102   21.360   23.102   24.955   14.259   24.955   14.259 0.000000 0.000000 
1 1 1    1    0   48 o   29.274   10.547   31.630   22.641   31.630   22.641   31.630   22.641   29.274   14.915   29.274   14.915 0.000000 0.000000 
1 1 1    1    0   49 o   17.778   8.5207  -5.6599   26.349  -5.6599   26.349  -5.6599   26.349   17.778   12.050   17.778   12.050 0.000000 0.000000 
1 1 1    1    0   50 o   16.755   8.2412 -14.7212   28.624 -14.7212   28.624 -14.7212   28.624   16.755   11.655   16.755   11.655 0.000000 0.000000 
1 1 1    1    1    0 o  211.255   2.0268  921.319   24.964  921.319   24.964  921.319   24.964  211.255   2.8663  211.255   2.8663 0.000000 0.000000 
1 1 1    1    1    1 o  271.634   3.2846  1525.22   36.799  1527.15   52.082  1523.30   52.001  271.805   4.6458  271.463   4.6445 0.3419189 6.569230 
1 1 1    1    1    2 o  210.002   2.3525  910.201   20.376  908.848   28.771  911.563   28.862  209.846   3.3242  210.159   3.3297 -0.3128662 4.705024 
1 1 1    1    1    3 o  417.714   3.1330  3601.96   53.977  3598.77   76.247  3605.17   76.423  417.529   4.4276  417.899   4.4339 -0.3701782 6.266062 
1 1 1    1    1    4 o  113.893   1.7507  267.572   8.2238  269.525   11.672  265.647   11.589  114.306   2.4757  113.481   2.4761 0.8253021 3.501456 
1 1 1    1    1    5 o  132.305   1.8289  361.071   9.9795  357.306   14.031  364.924   14.196  131.607   2.5850  133.002   2.5879 -1.395584 3.657789 
1 1 1    1    1    6 o  274.382   2.3890  1553.14   27.035  1557.58   38.364  1548.76   38.104  274.771   3.3852  273.993   3.3719 0.7779541 4.777996 
1 1 1    1    1    7 o  342.034   2.7443  2412.99   38.709  2393.26   54.214  2433.52   55.288  340.608   3.8591  343.460   3.9029 -2.851959 5.488677 
1 1 1    1    1    8 o  164.871   2.3281  560.278   15.824  546.348   21.972  575.285   22.807  162.744   3.2734  166.998   3.3112 -4.253632 4.656150 
1 1 1    1    1    9 o   55.378   2.6618   63.428   6.0639   67.853   8.5080   58.859   8.6451   57.347   3.5971   53.408   3.9246 3.938381 5.323667 
1 1 1    1    1   10 o  217.887   2.2133  979.143   19.885  961.788   27.752  997.457   28.507  215.904   3.1165  219.870   3.1436 -3.966019 4.426538 
1 1 1    1    1   11 o  358.095   2.8655  2646.69   42.318  2666.10   60.371  2627.94   59.335  359.383   4.0729  356.806   4.0319 2.577454 5.731046 
1 1 1    1    1   12 o  216.399   3.1920  966.290   28.479  986.533   40.955  947.337   39.629  218.590   4.5427  214.207   4.4855 4.383301 6.384034 
1 1 1    1    1   13 o  312.223   2.6652  2011.78   34.321  2017.91   48.652  2005.71   48.422  312.696   3.7724  311.750   3.7659 0.9458313 5.330385 
1 1 1    1    1   14 o  390.864   3.0765  3153.06   49.596  3159.77   70.324  3146.41   69.957  391.278   4.3576  390.451   4.3441 0.8272400 6.153032 
1 1 1    1    1   15 o   40.228   5.6879   34.519   9.2295   25.499   13.025   43.617   13.081   34.498   9.0435   45.957   6.9010 -11.45919 11.37579 
1 1 1    1    1   16 o  466.112   3.5279  4482.91   67.818  4508.54   96.534  4457.94   95.296  467.426   5.0073  464.797   4.9710 2.628326 7.055758 
1 1 1    1    1   17 o  306.525   2.7764  1937.00   35.080  1897.35   48.621  1980.04   50.665  303.258   3.8873  309.793   3.9652 -6.534851 5.552838 
1 1 1    1    1   18 o  189.438   2.9773  738.192   23.226  700.101   31.778  781.873   34.029  184.208   4.1826  194.667   4.2383 -10.45946 5.954658 
1 1 1    1    1   19 o  225.448   2.6375  1048.20   24.520  1072.24   35.089  1025.27   34.277  227.973   3.7318  222.923   3.7280 5.050034 5.274930 
1 1 1    1    1   20 o  132.005   3.0090  358.940   16.351  391.472   23.621  329.010   22.657  137.739   4.1579  126.270   4.3505 11.46933 6.017927 
1 1 1    1    1   21 o  193.473   2.6658  772.261   21.270  764.610   29.831  780.173   30.337  192.499   3.7573  194.447   3.7827 -1.948364 5.331610 
1 1 1    1    1   22 o  249.042   3.1382  1280.32   32.232  1289.59   45.473  1270.96   45.695  249.950   4.4110  248.135   4.4649 1.814560 6.276327 
1 1 1    1    1   23 o  107.882   3.4684  240.737   15.403  225.218   21.892  255.954   21.677  104.427   5.0828  111.336   4.7206 -6.909233 6.936786 
1 1 1    1    1   24 o  186.799   2.8335  720.244   21.827  724.399   31.201  716.263   30.545  187.325   4.0383  186.273   3.9758 1.052002 5.666982 
1 1 1    1    1   25 o  110.376   3.7630  253.332   16.946  297.641   24.064  209.742   23.869  120.029   4.8610  100.722   5.7456 19.30647 7.526035 
1 1 1    1    1   26 o  103.038   3.9198  220.066   16.606  200.533   23.534  239.434   23.434   98.461   5.7952  107.616   5.2796 -9.154854 7.839542 
1 1 1    1    1   27 o  235.078   3.2102  1142.16   31.125  1135.61   43.860  1148.80   44.175  234.399   4.5368  235.756   4.5430 -1.356583 6.420417 
1 1 1    1    1   28 o   28.480   8.1426   1.6056   16.098 -17.0559   22.872   19.925   22.662   22.899   10.534   34.060   12.419 -11.16063 16.28522 
1 1 1    1    1   29 o  203.542   2.8938  856.239   24.293  852.292   34.404  860.164   34.307  203.073   4.1076  204.012   4.0773 -0.9389191 5.787617 
1 1 1    1    1   30 o   94.347   4.8738  189.973   18.385  214.139   24.280  157.498   28.146  101.668   5.7902   87.026   7.8417 14.64245 9.747694 
1 1 1    1    1   31 o  188.686   3.5795  736.801   27.847  709.882   39.030  764.713   39.743  185.170   5.1104  192.202   5.0134 -7.032425 7.158970 
1 1 1    1    1   32 o  105.898   4.0277  232.253   17.578  219.427   24.480  245.903   25.255  102.876   5.7694  108.921   5.6217 -6.044601 8.055417 
1 1 1    1    1   33 o  117.380   4.0039  285.921   19.367  275.303   27.578  296.253   27.205  115.212   5.8036  119.548   5.5175 -4.336151 8.007789 
1 1 1    1    1   34 o  149.848   4.3337  465.847   26.744  502.743   38.430  431.199   37.241  155.620   5.9874  144.077   6.2670 11.54333 8.667429 
1 1 1    1    1   35 o   33.212   9.2567   14.007   18.658   17.991   27.367   10.546   25.504   34.845   13.445   31.579   12.727 3.266336 18.51335 
1 1 1    1    1   36 o   37.066   9.0040   19.685   19.535   49.816   27.272 -12.0652   27.996   47.349   13.375   26.784   12.058 20.56539 18.00790 
1 1 1    1    1   37 o   86.403   5.4944  156.766   19.575  157.585   28.037  155.987   27.342   86.608   7.8490   86.199   7.6906 0.4084930 10.98875 
1 1 1    1    1   38 o   81.141   7.1101  144.032   23.280  114.967   33.725  170.487   32.175   72.769   11.237   89.514   8.7150 -16.74450 14.22020 
1 1 1    1    1   39 o  121.618   5.1285  313.804   25.645  341.546   36.265  286.056   36.269  127.149   6.9153  116.086   7.5751 11.06265 10.25692 
1 1 1    1    1   40 o   72.296   6.1149  112.544   18.161  125.919   26.078   99.949   25.306   76.603   8.2540   67.989   9.0244 8.613358 12.22981 
1 1 1    1    1   41 o   34.625   9.7720   19.851   21.054   20.938   29.692   18.751   29.857   34.935   13.848   34.315   13.791 0.6196671 19.54395 
1 1 1    1    1   42 o   28.384   8.1681  -5.8081   17.605 -37.0101   23.871   31.408   26.070   19.309   9.3943   37.458   13.365 -18.14826 16.33613 
1 1 1    1    1   43 o   42.364   9.3887   42.362   18.987   58.913   27.319   26.898   26.406   48.993   13.216   35.736   13.339 13.25725 18.77744 
1 1 1    1    1   44 o   27.136   8.2582   3.4258   16.945   11.609   24.068  -4.6171   23.861   29.392   12.165   24.881   11.172 4.511648 16.51650 
1 1 1    1    1   45 o   22.909   7.7388 -28.0592   20.532 -30.7205   29.667 -25.6128   28.445   22.829   10.948   22.989   10.941 -0.1595097 15.47753 
1 1 1    1    1   46 o   35.212   9.6537   26.903   20.868   11.254   29.630   42.304   29.395   30.408   13.081   40.015   14.201 -9.606785 19.30741 
1 1 1    1    1   47 o   47.459   8.1447   57.622   16.352   37.739   22.520   79.797   23.782   37.893   12.455   57.024   10.499 -19.13107 16.28937 
1 1 1    1    1   48 o   26.786   8.0772   10.244   15.771   6.8967   22.320   13.581   22.287   25.803   11.226   27.768   11.616 -1.965431 16.15437 
1 1 1    1    1   49 o   25.774   8.0292   5.7146   16.652   9.5417   23.623   1.9346   23.477   26.773   11.598   24.776   11.107 1.996853 16.05846 
1 1 1    1    1   50 o   27.914   8.4360   3.2651   20.025   39.135   27.820 -35.3036   28.848   35.446   13.587   20.382   10.003 15.06424 16.87190 
1 1 1    1    1   51 o   23.415   8.1784 -46.2807   28.219  -3.9730   41.202 -83.6588   38.727   27.178   12.998   19.652   9.9290 7.525578 16.35672 
1 1 1    1    2    0 o   59.750   2.1863   74.237   7.5729   74.237   7.5729   74.237   7.5729   59.750   3.0919   59.750   3.0919 0.000000 0.000000 
1 1 1    1    2    1 o  250.059   3.1310  1289.08   32.251  1253.14   44.291  1329.64   47.053  246.360   4.3589  253.759   4.4958 -7.398666 6.261928 
1 1 1    1    2    2 o  186.174   2.5074  712.304   18.782  702.112   23.966  728.527   30.236  184.468   3.1500  187.880   3.9019 -3.411621 5.014734 
1 1 1    1    2    3 o  154.156   1.8328  490.223   11.653  491.610   16.506  488.845   16.454  154.374   2.5923  153.939   2.5916 0.4347076 3.665605 
1 1 1    1    2    4 o  625.304   4.3893  8077.97  113.187  8123.95  161.499  8033.59  158.680  627.046   6.2446  623.563   6.1699 3.482849 8.778509 
1 1 1    1    2    5 o  201.225   2.0487  835.324   17.003  838.846   24.131  831.852   23.960  201.646   2.9015  200.804   2.8930 0.8421478 4.097380 
1 1 1    1    2    6 o  128.604   1.8719  341.023   9.9273  348.275   14.190  334.070   13.893  129.943   2.6477  127.265   2.6469 2.677582 3.743822 
1 1 1    1    2    7 o  376.905   2.9383  2929.82   45.662  2899.06   63.659  2962.43   65.533  374.869   4.1173  378.941   4.1930 -4.071991 5.876521 
1 1 1    1    2    8 o  412.636   3.1454  3513.15   53.529  3530.58   76.169  3496.13   75.241  413.646   4.4646  411.625   4.4319 2.021393 6.290816 
1 1 1    1    2    9 o  261.812   2.7488  1414.45   29.682  1411.57   41.932  1417.34   42.021  261.545   3.8872  262.079   3.8875 -0.5339966 5.497520 
1 1 1    1    2   10 o  183.719   2.1038  696.292   15.940  705.331   22.715  687.522   22.375  184.893   2.9787  182.544   2.9718 2.348953 4.207614 
1 1 1    1    2   11 o  170.107   2.4279  597.089   17.033  603.910   24.235  590.430   23.946  171.067   3.4348  169.147   3.4324 1.919861 4.855864 
1 1 1    1    2   12 o  284.036   2.5207  1664.83   29.528  1673.11   42.024  1656.75   41.499  284.733   3.5784  283.339   3.5512 1.394043 5.041415 
1 1 1    1    2   13 o  286.834   2.9432  1697.00   34.800  1732.24   50.211  1664.42   48.276  289.696   4.2024  283.972   4.1218 5.723175 5.886333 
1 1 1    1    2   14 o  254.768   2.4483  1338.81   25.722  1356.56   36.813  1321.88   35.954  256.417   3.4809  253.119   3.4440 3.297928 4.896677 
1 1 1    1    2   15 o   78.583   3.1552  127.470   10.222  130.947   14.399  123.938   14.514   79.664   4.3823   77.501   4.5405 2.162880 6.310376 
1 1 1    1    2   16 o  202.152   2.4980  842.895   20.824  836.540   29.162  849.508   29.747  201.375   3.5111  202.929   3.5542 -1.554108 4.995965 
1 1 1    1    2   17 o  313.507   2.7919  2027.76   36.100  2032.38   51.190  2023.20   50.917  313.862   3.9544  313.153   3.9422 0.7087097 5.583755 
1 1 1    1    2   18 o  215.887   2.7705  965.476   24.459  994.615   32.816  929.057   36.687  219.573   3.6236  212.201   4.1918 7.372833 5.540914 
1 1 1    1    2   19 o  495.003   4.3019  5057.83   87.807  5106.24  125.781  5011.80  122.634  497.308   6.1323  492.697   6.0349 4.611206 8.603775 
1 1 1    1    2   20 o  395.612   3.2071  3229.43   52.325  3256.15   74.606  3203.56   73.405  397.221   4.5538  394.003   4.5171 3.218506 6.414177 
1 1 1    1    2   21 o  319.214   3.3405  2103.14   43.977  2116.56   62.691  2090.14   61.706  320.215   4.7468  318.213   4.7016 2.002136 6.681056 
1 1 1    1    2   22 o  151.075   2.8884  470.982   17.992  474.144   25.809  467.993   25.094  151.567   4.1285  150.584   4.0405 0.9837341 5.776714 
1 1 1    1    2   23 o  135.906   3.0835  381.319   17.284  378.269   24.397  384.391   24.490  135.360   4.3701  136.452   4.3515 -1.091476 6.167060 
1 1 1    1    2   24 o  191.078   2.8267  753.506   22.273  741.555   31.177  765.964   31.832  189.531   3.9883  192.624   4.0067 -3.093246 5.653318 
1 1 1    1    2   25 o  207.885   2.8131  892.107   24.117  907.900   34.415  876.868   33.807  209.693   3.9792  206.078   3.9775 3.614670 5.626240 
1 1 1    1    2   26 o  340.422   3.0655  2393.94   43.039  2404.99   61.201  2383.12   60.539  341.198   4.3489  339.647   4.3216 1.551086 6.130996 
1 1 1    1    2   27 o   96.544   4.5417  193.158   18.078  197.311   25.417  188.906   25.717   97.602   6.3140   95.486   6.5300 2.115952 9.083363 
1 1 1    1    2   28 o  157.116   3.4782  511.015   22.513  488.853   32.097  532.479   31.586  153.747   5.0617  160.485   4.7720 -6.738953 6.956428 
1 1 1    1    2   29 f   95.618   4.1854  189.894   16.463  201.765   23.006  177.437   23.567   98.707   5.6511   92.528   6.1755 6.179329 8.370848 
1 1 1    1    2   30 o   92.017   6.6158  169.339   24.333  148.909   30.222  206.984   41.025   84.537   8.6680   99.498   9.9970 -14.96167 13.23154 
1 1 1    1    2   31 o  162.590   3.8465  547.712   25.788  537.372   36.590  557.917   36.352  161.055   5.5084  164.124   5.3701 -3.068512 7.692904 
1 1 1    1    2   32 o   37.855   9.0194   27.825   17.031   18.549   24.059   37.143   24.112   33.922   12.719   41.788   12.792 -7.866451 18.03886 
1 1 1    1    2   33 o   69.785   6.0522  102.329   17.240   85.522   24.351  119.221   24.412   63.932   9.2348   75.638   7.8252 -11.70605 12.10438 
1 1 1    1    2   34 o   90.046   5.1314  169.215   18.965  189.673   26.977  149.222   26.668   95.487   6.8499   84.605   7.6424 10.88181 10.26287 
1 1 1    1    2   35 o   84.786   5.7949  150.702   20.198  165.453   28.677  136.181   28.452   88.966   7.8153   80.606   8.5583 8.360825 11.58981 
1 1 1    1    2   36 o   25.488   8.1331 -12.6059   18.175 -18.0421   25.060  -6.5730   26.400   23.838   10.988   27.139   11.994 -3.300625 16.26628 
1 1 1    1    2   37 f   68.883   7.1514  103.484   19.212  133.398   27.514   75.023   26.838   79.570   8.3837   58.197   11.588 21.37311 14.30287 
1 1 1    1    2   38 o   36.806   9.7450   17.534   22.176   45.233   31.294 -10.4050   31.430   45.048   14.676   28.564   12.825 16.48316 19.48995 
1 1 1    1    2   39 o   37.833   10.020   26.092   21.401   16.095   29.499   37.199   31.095   34.093   13.706   41.573   14.621 -7.480301 20.04083 
1 1 1    1    2   40 o   27.065   8.2828   0.3095   17.026  -2.9994   23.704   3.8359   24.470   25.943   11.420   28.187   12.000 -2.244200 16.56558 
1 1 1    1    2   41 o   25.165   7.8216  -6.4970   16.471 -23.0250   23.419   9.6804   23.170   21.288   10.071   29.043   11.970 -7.754812 15.64311 
1 1 1    1    2   42 o   24.800   7.7936  -5.2575   16.307 -15.4020   23.445   4.2489   22.695   22.613   10.495   26.988   11.524 -4.374231 15.58714 
1 1 1    1    2   43 o   43.176   8.8598   45.045   16.839   38.595   24.021   51.275   23.610   40.219   12.836   46.132   12.216 -5.912853 17.71951 
1 1 1    1    2   44 o   48.412   9.3199   61.750   19.886   41.075   31.616   75.282   25.579   40.816   14.701   56.008   11.459 -15.19271 18.63972 
1 1 1    1    2   45 o   25.627   8.3308 -14.1254   20.671   2.8149   29.357 -30.7818   29.110   28.709   12.670   22.546   10.820 6.163706 16.66167 
1 1 1    1    2   46 o   42.043   10.730   48.540   24.316   59.353   33.726   36.835   35.090   45.776   15.251   38.310   15.096 7.466576 21.45917 
1 1 1    1    2   47 o   33.606   8.9341   27.474   16.846   24.612   23.754   30.371   23.895   32.503   12.530   34.709   12.738 -2.206070 17.86825 
1 1 1    1    2   48 o   49.891   7.9072   64.782   16.451   46.726   22.951   83.859   23.591   41.008   12.465   58.773   9.7322 -17.76438 15.81438 
1 1 1    1    2   49 o   30.076   8.7030   20.226   17.162   19.449   23.882   21.057   24.679   29.752   12.194   30.399   12.420 -0.6470795 17.40599 
1 1 1    1    2   50 o   32.785   9.3118   27.962   20.699   49.433   29.133   6.0767   29.413   38.787   14.091   26.782   12.177 12.00583 18.62364 
1 1 1    1    2   51 o   25.231   8.6365 -16.4695   27.616 -13.7175   38.333 -19.4391   39.820   25.377   12.240   25.086   12.188 0.2915459 17.27301 
1 1 1    1    3    0 o  221.590   2.9535  1014.10   38.143  1014.10   38.143  1014.10   38.143  221.590   4.1768  221.590   4.1768 0.000000 0.000000 
1 1 1    1    3    1 o  194.704   2.4039  780.156   18.157  776.203   22.158  788.236   31.677  193.973   2.7696  195.434   3.9299 -1.461609 4.807766 
1 1 1    1    3    2 o  206.555   2.8711  877.272   24.398  836.911   33.103  925.269   36.099  201.377   3.9856  211.734   4.1337 -10.35762 5.742151 
1 1 1    1    3    3 o  209.831   2.2206  906.786   18.977  898.208   24.885  918.707   29.336  208.655   2.8916  211.007   3.3708 -2.351761 4.441118 
1 1 1    1    3    4 o  119.678   1.7812  295.456   8.7919  294.897   12.422  296.018   12.446  119.564   2.5189  119.791   2.5190 -0.2270203 3.562330 
1 1 1    1    3    5 o  142.234   1.8627  417.232   10.927  410.735   15.352  423.901   15.555  141.112   2.6378  143.356   2.6307 -2.243866 3.725439 
1 1 1    1    3    6 o  431.342   3.2326  3838.53   57.506  3823.41   80.896  3853.99   81.764  430.483   4.5562  432.200   4.5868 -1.716553 6.465134 
1 1 1    1    3    7 o  222.782   2.5131  1023.82   23.091  1027.55   32.764  1020.14   32.549  223.185   3.5593  222.379   3.5488 0.8060303 5.026225 
1 1 1    1    3    8 o  101.720   1.9951  213.430   8.3693  209.547   11.800  217.360   11.873  100.789   2.8385  102.651   2.8043 -1.861961 3.990141 
1 1 1    1    3    9 o  157.717   2.3460  512.829   15.255  495.699   21.236  531.094   21.928  154.998   3.3218  160.436   3.3138 -5.438507 4.692084 
1 1 1    1    3   10 o   91.754   2.1844  173.728   8.2637  167.808   11.654  179.715   11.720   90.181   3.1331   93.327   3.0448 -3.146202 4.368859 
1 1 1    1    3   11 o  375.960   3.4184  2918.78   53.005  2929.73   75.284  2908.01   74.642  376.658   4.8461  375.262   4.8226 1.396179 6.836813 
1 1 1    1    3   12 o   36.161   4.6334   27.856   6.6455   19.939   9.2701   36.226   9.5315   30.445   7.4445   41.877   5.5184 -11.43237 9.266826 
1 1 1    1    3   13 o  325.920   3.1577  2192.51   42.443  2179.28   59.580  2206.14   60.478  324.923   4.4458  326.917   4.4853 -1.993713 6.315346 
1 1 1    1    3   14 o  165.943   2.2723  568.025   15.551  560.513   21.854  575.732   22.135  164.832   3.2146  167.055   3.2126 -2.222763 4.544671 
1 1 1    1    3   15 o  124.035   2.5230  317.160   12.901  330.991   18.489  304.038   18.010  126.669   3.5390  121.401   3.5968 5.267563 5.045934 
1 1 1    1    3   16 o  360.746   2.9845  2684.41   44.393  2657.96   61.959  2712.30   63.639  358.923   4.1854  362.570   4.2556 -3.647369 5.968903 
1 1 1    1    3   17 o  294.229   3.1368  1785.63   38.058  1815.80   54.499  1756.93   53.170  296.652   4.4542  291.805   4.4178 4.847168 6.273529 
1 1 1    1    3   18 o  267.592   2.6357  1476.34   29.075  1449.13   40.363  1505.69   41.918  265.032   3.6925  270.153   3.7621 -5.120575 5.271380 
1 1 1    1    3   19 o  257.052   3.0671  1362.28   32.500  1397.45   46.920  1329.83   45.060  260.238   4.3714  253.865   4.3035 6.372391 6.134290 
1 1 1    1    3   20 o  123.521   3.2071  310.174   16.105  289.010   20.802  341.839   25.444  118.345   4.2618  128.697   4.7936 -10.35166 6.414134 
1 1 1    1    3   21 o  236.442   3.0414  1151.08   29.615  1202.72   43.359  1105.92   40.545  241.398   4.3549  231.485   4.2467 9.913208 6.082727 
1 1 1    1    3   22 o  167.151   2.7137  576.502   18.707  569.014   26.248  584.232   26.668  166.048   3.8326  168.254   3.8429 -2.205521 5.427441 
1 1 1    1    3   23 o  359.382   3.5642  2667.52   52.831  2675.94   74.772  2659.12   74.656  359.949   5.0366  358.815   5.0446 1.133881 7.128482 
1 1 1    1    3   24 o  148.721   3.1282  456.746   19.185  466.564   27.160  446.969   27.103  150.318   4.3808  147.124   4.4666 3.194199 6.256328 
1 1 1    1    3   25 o  247.467   2.8187  1264.51   28.770  1270.85   40.677  1258.16   40.696  248.088   3.9753  246.846   3.9972 1.242874 5.637496 
1 1 1    1    3   26 o  125.572   3.9221  326.806   19.985  329.857   26.093  322.477   31.083  126.317   5.0083  124.827   6.0374 1.490211 7.844286 
1 1 1    1    3   27 o  117.919   4.8023  288.504   23.172  285.704   34.944  290.701   30.957  117.369   7.2186  118.469   6.3357 -1.099197 9.604671 
1 1 1    1    3   28 o  124.518   3.9099  320.848   20.078  320.142   28.568  321.536   28.225  124.379   5.5689  124.656   5.4898 -0.2765427 7.819873 
1 1 1    1    3   29 o   68.856   6.1839  100.847   16.310   65.485   22.297  141.547   23.920   55.133   10.180   82.580   7.0231 -27.44667 12.36778 
1 1 1    1    3   30 o   62.808   7.5738   84.568   18.958   99.870   26.893   69.453   26.729   69.157   9.4284   56.459   11.856 12.69736 15.14765 
1 1 1    1    3   31 o   92.734   4.4390  177.464   16.889  205.110   24.799  153.550   23.065   99.454   6.0457   86.014   6.5015 13.44064 8.878022 
1 1 1    1    3   32 o   42.531   9.0762   39.196   17.287   44.174   22.221   31.566   27.512   44.962   11.825   40.099   13.772 4.862705 18.15231 
1 1 1    1    3   33 o   72.573   5.9190  111.374   17.161   78.706   23.881  146.259   24.678   61.303   9.4452   83.844   7.1363 -22.54096 11.83806 
1 1 1    1    3   34 o  104.564   4.4597  227.072   19.229  232.553   27.521  221.843   26.879  105.797   6.3070  103.331   6.3070 2.465027 8.919400 
1 1 1    1    3   35 o   24.051   7.8410 -19.0086   18.096 -22.6380   25.672 -15.4241   25.513   23.387   10.897   24.715   11.278 -1.328074 15.68196 
1 1 1    1    3   36 o   60.652   7.5232   79.966   18.257   90.553   25.601   69.009   26.043   65.458   9.4827   55.845   11.682 9.612854 15.04645 
1 1 1    1    3   37 o   26.930   8.2966 -15.7081   18.952   14.512   27.580 -42.7456   26.087   33.491   13.324   20.369   9.8893 13.12183 16.59319 
1 1 1    1    3   38 o   53.008   10.044   64.875   22.693   79.040   32.509   51.411   31.693   58.550   13.704   47.467   14.688 11.08297 20.08840 
1 1 1    1    3   39 o   42.317   9.0487   40.631   17.899   54.592   24.698   25.184   25.978   48.630   12.304   36.004   13.271 12.62602 18.09748 
1 1 1    1    3   40 o   28.811   8.5206   5.8837   17.157   12.940   24.193  -1.2566   24.336   30.887   12.414   26.736   11.675 4.151031 17.04129 
1 1 1    1    3   41 o  114.654   4.2449  278.549   20.062  280.324   28.895  276.897   27.877  114.959   6.0942  114.349   5.9109 0.6107559 8.489893 
1 1 1    1    3   42 o   26.447   8.2409  -1.4034   17.521  -3.8816   25.206   0.9133   24.371   26.051   11.605   26.844   11.704 -0.7931175 16.48190 
1 1 1    1    3   43 o  108.156   4.4751  249.718   19.956  241.780   28.177  257.707   28.266  106.377   6.4222  109.935   6.2339 -3.558434 8.950197 
1 1 1    1    3   44 o   22.104   7.4474 -26.9550   18.838 -20.1307   26.278 -34.1697   27.019   22.992   10.813   21.216   10.244 1.776310 14.89489 
1 1 1    1    3   45 o   32.589   9.0101   21.637   17.563   20.872   24.828   22.403   24.849   32.318   12.710   32.859   12.774 -0.5410767 18.02025 
1 1 1    1    3   46 o   28.675   8.6130   4.0560   18.320   27.471   28.419 -12.5912   23.963   34.635   13.605   22.716   10.565 11.91891 17.22591 
1 1 1    1    3   47 o   31.849   8.7971   22.937   16.724   23.297   23.201   22.547   24.129   31.907   12.360   31.791   12.521 0.1164589 17.59427 
1 1 1    1    3   48 o   39.854   9.8458   47.044   20.075   40.832   28.474   53.185   28.309   37.489   13.880   42.220   13.968 -4.730778 19.69166 
1 1 1    1    3   49 o   29.938   8.6010   18.135   17.460   32.579   24.521   3.2822   24.866   34.344   12.848   25.531   11.439 8.813206 17.20200 
1 1 1    1    3   50 o   32.143   9.3712   28.754   20.126   23.969   27.850   33.984   29.116   30.676   12.918   33.610   13.580 -2.934010 18.74246 
1 1 1    1    3   51 o   25.126   8.6325 -18.7951   28.222 -13.4664   40.584 -23.7850   39.273   25.823   12.489   24.429   11.921 1.393541 17.26509 
1 1 1    1    4    1 o  356.959   3.6216  2611.11   51.511  2555.46   64.621  2708.10   85.309  351.841   4.4531  362.078   5.7125 -10.23724 7.243136 
1 1 1    1    4    2 o  369.324   3.7147  2801.15   54.868  2754.38   69.286  2879.79   89.853  365.272   4.5990  373.376   5.8347 -8.103851 7.429319 
1 1 1    1    4    3 o  381.285   3.7860  3002.92   58.371  3008.67   75.491  2994.38   92.047  381.783   4.7942  380.787   5.8609 0.9957275 7.571918 
1 1 1    1    4    4 o   30.362   2.5096   19.026   3.1277   21.536   4.4871   16.655   4.3620   32.310   3.3671   28.413   3.7222 3.896858 5.019181 
1 1 1    1    4    5 f  519.748   3.7480  5573.73   80.334  5610.11  114.741  5538.75  112.510  521.409   5.3355  518.087   5.2653 3.322388 7.496055 
1 1 1    1    4    6 o  378.130   2.9336  2949.67   45.749  2962.23   65.070  2937.40   64.335  378.925   4.1635  377.335   4.1338 1.589935 5.867143 
1 1 1    1    4    7 o  388.180   3.4611  3109.30   55.405  3135.28   79.186  3084.38   77.548  389.766   4.9258  386.594   4.8635 3.172791 6.922218 
1 1 1    1    4    8 o  206.307   2.1349  877.879   18.163  889.912   25.950  866.322   25.431  207.692   3.0294  204.922   3.0089 2.770676 4.269711 
1 1 1    1    4    9 o  184.813   2.2526  706.435   17.037  718.892   22.831  690.781   25.593  186.663   2.9655  182.963   3.3915 3.699646 4.505165 
1 1 1    1    4   10 o  173.078   2.2549  619.850   15.964  604.062   24.009  632.361   21.373  171.090   3.4024  175.066   2.9601 -3.976212 4.509787 
1 1 1    1    4   11 o  219.227   2.5856  991.256   23.368  972.802   32.453  1011.13   33.675  217.111   3.6242  221.343   3.6887 -4.232285 5.171196 
1 1 1    1    4   12 o  159.562   2.1480  525.300   14.136  528.914   20.008  521.697   19.975  160.111   3.0298  159.014   3.0457 1.096603 4.295993 
1 1 1    1    4   13 o  106.521   2.6263  234.068   11.454  234.689   17.289  233.583   15.290  106.643   3.9306  106.399   3.4843 0.2436829 5.252659 
1 1 1    1    4   14 o  397.613   3.1222  3262.14   51.198  3245.49   71.884  3279.28   72.938  396.584   4.3947  398.641   4.4361 -2.056854 6.244421 
1 1 1    1    4   15 o  359.730   2.9475  2668.96   43.719  2637.73   60.956  2702.04   62.738  357.565   4.1333  361.895   4.2032 -4.330078 5.895006 
1 1 1    1    4   16 f  406.577   3.2128  3410.73   53.872  3430.81   76.755  3391.22   75.629  407.755   4.5640  405.398   4.5232 2.357361 6.425627 
1 1 1    1    4   17 o  426.208   3.8391  3747.27   67.449  3698.48   93.595  3799.98   97.287  423.328   5.3606  429.089   5.4972 -5.761261 7.678239 
1 1 1    1    4   18 o  211.254   2.5162  920.084   21.916  950.446   31.445  891.403   30.562  214.641   3.5520  207.867   3.5648 6.773972 5.032309 
1 1 1    1    4   19 o  265.402   2.8805  1456.52   31.318  1482.12   42.130  1424.89   46.823  268.024   3.8111  262.781   4.3202 5.243317 5.760924 
1 1 1    1    4   20 o  218.978   2.5885  988.967   23.373  1007.20   33.499  971.670   32.627  220.944   3.6761  217.013   3.6452 3.931244 5.177002 
1 1 1    1    4   21 o  332.519   2.9182  2281.92   40.022  2288.72   56.780  2275.20   56.420  333.011   4.1340  332.027   4.1200 0.9842224 5.836437 
1 1 1    1    4   22 o   87.496   4.2175  157.899   14.968  156.701   19.443  159.643   23.453   87.104   5.4120   87.889   6.4700 -0.7854156 8.435046 
1 1 1    1    4   23 o  181.137   3.2916  677.473   24.590  672.426   34.559  682.649   34.997  180.454   4.6432  181.820   4.6668 -1.365387 6.583240 
1 1 1    1    4   24 o   77.275   5.1931  125.917   16.241  105.526   24.021  143.088   22.042   71.370   8.1603   83.179   6.4251 -11.80917 10.38616 
1 1 1    1    4   25 o  196.846   3.2132  800.533   26.075  796.687   37.409  804.168   36.365  196.381   4.6187  197.312   4.4685 -0.9309082 6.426495 
1 1 1    1    4   26 o  241.913   3.2020  1209.01   31.936  1195.82   44.452  1223.08   45.913  240.555   4.4803  243.271   4.5759 -2.715851 6.404070 
1 1 1    1    4   27 o  124.165   3.4676  319.035   17.742  331.649   24.953  306.138   25.232  126.658   4.7767  121.673   5.0279 4.985107 6.935154 
1 1 1    1    4   28 o  172.288   2.9739  613.231   21.130  600.958   29.626  625.938   30.145  170.533   4.2121  174.042   4.1994 -3.509186 5.947819 
1 1 1    1    4   29 o   54.083   7.6237   64.371   16.705   33.702   23.413   96.177   23.843   40.198   12.655   67.968   8.5052 -27.76980 15.24742 
1 1 1    1    4   30 o  112.373   3.8226  262.250   17.663  242.131   25.213  281.641   24.753  108.106   5.6547  116.639   5.1454 -8.533447 7.645269 
1 1 1    1    4   31 o   23.581   7.4339  -8.7071   14.787 -14.7359   21.001  -2.7785   20.825   22.109   10.142   25.053   10.871 -2.943903 14.86780 
1 1 1    1    4   32 o  163.945   3.8609  556.448   26.076  595.666   37.463  519.594   36.317  169.557   5.3571  158.332   5.5612 11.22536 7.721748 
1 1 1    1    4   33 o  112.644   4.0651  263.216   18.876  274.722   26.828  251.937   26.563  115.093   5.6517  110.195   5.8444 4.897812 8.130141 
1 1 1    1    4   34 o   40.424   9.1016   34.201   17.195   39.232   24.145   29.023   24.493   42.651   12.745   38.197   12.997 4.454380 18.20321 
1 1 1    1    4   35 o   63.368   7.2715   86.373   18.482   77.739   26.362   94.719   25.918   59.651   11.124   67.086   9.3671 -7.435303 14.54292 
1 1 1    1    4   36 o   37.366   8.5844   23.040   17.684  -4.9325   24.891   51.551   25.129   26.673   11.723   48.060   12.544 -21.38686 17.16887 
1 1 1    1    4   37 o  107.583   5.0173  242.663   22.263  243.980   31.518  241.351   31.451  107.877   7.0837  107.288   7.1075 0.5886917 10.03470 
1 1 1    1    4   38 o   65.769   7.1140   95.342   18.217   67.609   25.298  125.208   26.253   54.766   11.563   76.772   8.2912 -22.00571 14.22808 
1 1 1    1    4   39 o   34.735   8.9976   22.606   17.162   31.585   24.521   13.986   24.027   38.192   13.004   31.278   12.439 6.913975 17.99520 
1 1 1    1    4   40 o   91.707   6.3086  182.068   23.498  222.664   33.877  144.426   32.621  101.970   8.0550   81.444   9.7113 20.52638 12.61718 
1 1 1    1    4   41 o   23.929   7.6530  -8.7868   16.269  -2.7259   23.086 -14.7662   22.930   25.350   11.209   22.508   10.422 2.842216 15.30598 
1 1 1    1    4   42 o   34.864   9.0824   23.203   17.981   8.9427   24.832   38.924   26.072   29.282   12.257   40.445   13.406 -11.16313 18.16477 
1 1 1    1    4   43 o   34.750   8.6292   23.591   16.682   5.0904   23.316   42.992   23.877   27.402   11.691   42.098   12.696 -14.69598 17.25839 
1 1 1    1    4   44 o   61.483   8.2404   91.254   20.173   64.475   28.331  118.795   28.731   50.463   13.390   72.503   9.6081 -22.03927 16.48081 
1 1 1    1    4   45 o   30.983   8.6983   16.910   17.077   6.2653   24.586   26.832   23.738   27.692   11.914   34.275   12.676 -6.582256 17.39655 
1 1 1    1    4   46 o   37.637   8.8285   35.860   16.516   47.168   23.353   24.544   23.362   42.502   12.493   32.772   12.477 9.730492 17.65694 
1 1 1    1    4   47 o   28.644   8.4124   13.895   16.359   13.596   22.946   14.204   23.329   28.493   11.842   28.795   11.952 -0.3026638 16.82477 
1 1 1    1    4   48 o   37.050   9.2951   38.763   17.934   32.836   25.115   44.929   25.616   34.682   12.997   39.417   13.292 -4.734501 18.59029 
1 1 1    1    4   49 o   36.628   8.9981   37.527   17.366   51.628   24.744   23.839   24.378   42.136   12.968   31.120   12.478 11.01628 17.99627 
1 1 1    1    4   50 o   25.334   8.6030 -19.1334   26.480   3.3637   37.312 -41.9615   37.585   27.983   13.071   22.686   11.189 5.297016 17.20605 
1 1 1    1    4   51 o   27.815   9.0904  -3.6025   26.719   41.741   37.242 -51.6958   38.355   34.034   14.653   21.596   10.762 12.43840 18.18075 
1 1 1    1    5    0 f  460.379   4.7819  4376.94  128.348  4376.94  128.348  4376.94  128.348  460.379   6.7627  460.379   6.7627 0.000000 0.000000 
1 1 1    1    5    1 f  483.648   4.5911  4787.86   88.142  4678.86  109.959  4983.80  147.427  476.095   5.5998  491.201   7.2770 -15.10660 9.182162 
1 1 1    1    5    2 o  240.781   2.8530  1176.48   27.172  1129.92   33.618  1264.19   46.144  234.038   3.4827  247.525   4.5199 -13.48749 5.706080 
1 1 1    1    5    3 o  290.527   3.1654  1741.73   37.139  1742.77   47.891  1740.16   58.824  290.650   3.9950  290.405   4.9112 0.2452087 6.330890 
1 1 1    1    5    4 o  124.017   1.9617  316.006   9.9068  309.795   12.956  324.749   15.372  122.557   2.5632  125.477   2.9703 -2.919815 3.923363 
1 1 1    1    5    5 o  389.812   2.9913  3134.97   48.093  3141.45   68.238  3128.58   67.791  390.212   4.2399  389.412   4.2208 0.7995300 5.982667 
1 1 1    1    5    6 o  205.077   2.2583  869.311   18.965  882.696   25.452  852.605   28.435  206.860   2.9832  203.295   3.3913 3.564957 4.516685 
1 1 1    1    5    7 f  232.725   2.2291  1114.91   21.363  1160.45   31.292  1075.14   29.238  237.166   3.1990  228.285   3.1053 8.881561 4.458283 
1 1 1    1    5    8 o  264.755   2.3755  1446.39   25.940  1448.33   36.737  1444.46   36.632  264.932   3.3620  264.578   3.3569 0.3541260 4.750992 
1 1 1    1    5    9 o  160.910   2.0352  533.805   13.502  549.820   19.423  518.829   18.783  163.244   2.8847  158.577   2.8718 4.667038 4.070478 
1 1 1    1    5   10 o  204.891   3.0735  866.367   25.968  847.766   36.321  885.816   37.141  202.643   4.3458  207.140   4.3473 -4.497574 6.146921 
1 1 1    1    5   11 f  172.957   2.1402  617.199   15.267  614.108   21.555  620.310   21.626  172.523   3.0293  173.392   3.0239 -0.8690796 4.280303 
1 1 1    1    5   12 o  271.688   2.4750  1522.81   27.729  1539.14   39.647  1507.18   38.796  273.112   3.5197  270.263   3.4805 2.848419 4.949915 
1 1 1    1    5   13 o   99.033   2.5081  202.348   10.243  202.436   14.622  202.264   14.353   99.053   3.5790   99.012   3.5146 0.4107666E-01 5.016150 
1 1 1    1    5   14 o  352.442   3.3471  2562.93   48.650  2548.15   68.259  2578.18   69.357  351.411   4.7095  353.474   4.7574 -2.062592 6.694191 
1 1 1    1    5   15 o  337.162   2.8415  2344.03   39.495  2384.45   56.902  2306.45   54.863  339.964   4.0581  334.359   3.9784 5.604309 5.682933 
1 1 1    1    5   16 o  317.627   2.7904  2081.32   36.553  2070.49   51.387  2092.42   52.007  316.791   3.9329  318.464   3.9595 -1.672485 5.580772 
1 1 1    1    5   17 o  664.564   4.7015  9117.92  128.849  9172.93  183.955  9064.93  180.534  666.527   6.6916  662.601   6.6061 3.925293 9.403033 
1 1 1    1    5   18 o  210.656   2.7309  915.401   23.440  914.546   30.835  916.572   36.075  210.547   3.5509  210.765   4.1500 -0.2177582 5.461777 
1 1 1    1    5   19 o  423.420   3.8529  3700.17   67.273  3669.50   94.033  3732.33   96.283  421.626   5.4074  425.214   5.4901 -3.587921 7.705884 
1 1 1    1    5   20 o   25.344   7.8936  -7.8564   16.140  -0.5898   23.602 -14.2400   22.121   27.569   11.762   23.119   10.531 4.450323 15.78723 
1 1 1    1    5   21 o  163.149   3.0511  549.349   20.526  552.007   29.357  546.807   28.711  163.534   4.3525  162.764   4.2769 0.7695465 6.102110 
1 1 1    1    5   22 o   67.793   4.9207   96.195   13.516   75.733   19.152  116.500   19.078   60.503   7.6748   75.083   6.1606 -14.58049 9.841496 
1 1 1    1    5   23 o  192.080   3.2633  762.090   25.844  773.392   36.267  750.429   36.838  193.531   4.5436  190.629   4.6853 2.902512 6.526557 
1 1 1    1    5   24 o   82.948   4.5068  142.330   15.411  143.037   21.502  141.583   22.100   83.164   6.2687   82.732   6.4768 0.4317017 9.013625 
1 1 1    1    5   25 o   88.148   4.2900  160.649   15.546  143.649   21.639  178.783   22.349   83.320   6.2968   92.976   5.8282 -9.655220 8.580048 
1 1 1    1    5   26 o  273.007   3.2462  1540.52   36.550  1538.20   51.364  1542.91   52.021  272.802   4.5651  273.213   4.6165 -0.4106750 6.492465 
1 1 1    1    5   27 o  133.092   3.2731  366.046   17.951  345.657   25.151  387.218   25.630  129.309   4.7159  136.874   4.5400 -7.565460 6.546109 
1 1 1    1    5   28 o  187.590   2.9055  727.195   22.480  729.499   31.804  724.895   31.780  187.887   4.1040  187.292   4.1140 0.5947876 5.811063 
1 1 1    1    5   29 f  116.593   5.0158  282.353   24.100  295.772   34.096  268.955   34.069  119.382   6.9246  113.805   7.2583 5.576019 10.03161 
1 1 1    1    5   30 o   65.361   5.6642   88.987   15.250   94.446   21.636   83.597   21.499   67.371   7.7865   63.350   8.2282 4.020535 11.32841 
1 1 1    1    5   31 o  257.279   3.1930  1371.11   33.513  1381.42   44.340  1357.38   51.180  258.470   4.1593  256.088   4.8456 2.382050 6.385900 
1 1 1    1    5   32 o   59.215   8.4889   76.470   20.018   73.206   27.877   79.944   28.763   57.869   12.070   60.561   11.940 -2.692253 16.97779 
1 1 1    1    5   33 o  116.209   4.2114  278.692   20.072  294.712   30.341  266.225   26.765  119.133   6.1749  113.284   5.7285 5.849922 8.422872 
1 1 1    1    5   34 o   27.487   8.3884  -4.7432   17.958 -18.9044   25.814   8.5370   24.998   24.230   11.163   30.744   12.524 -6.513264 16.77671 
1 1 1    1    5   35 o   66.964   6.6528   94.463   18.311   84.489   25.574  104.952   26.228   63.278   9.7992   70.651   9.0008 -7.373112 13.30553 
1 1 1    1    5   36 o   30.715   8.8102   9.6935   17.405   9.7119   24.533   9.6750   24.698   30.683   12.441   30.748   12.478 -0.6498528E-01 17.62046 
1 1 1    1    5   37 o   99.137   6.7577  209.372   27.419  177.302   38.099  243.830   39.492   91.059   10.144  107.215   8.9308 -16.15576 13.51535 
1 1 1    1    5   38 o   86.592   5.2462  158.413   18.731  155.533   26.106  161.468   26.891   85.793   7.3777   87.391   7.4605 -1.597893 10.49233 
1 1 1    1    5   39 o   23.797   7.7095 -13.5633   17.104 -10.8822   23.705 -16.4750   24.704   24.099   10.948   23.496   10.858 0.6026878 15.41902 
1 1 1    1    5   40 o   67.643   8.4409  104.483   22.635   79.233   31.558  131.238   32.485   57.900   13.469   77.386   10.178 -19.48629 16.88179 
1 1 1    1    5   41 o   31.146   8.6145   14.354   16.892   0.0675   24.324   27.661   23.476   26.672   11.659   35.619   12.685 -8.947128 17.22910 
1 1 1    1    5   42 o   60.013   7.2433   81.959   17.508   86.040   24.509   77.707   25.019   62.210   9.5521   57.817   10.891 4.392651 14.48665 
1 1 1    1    5   43 o   33.230   8.8290   21.939   16.622   14.555   22.985   30.034   24.065   30.169   12.109   36.291   12.852 -6.122196 17.65798 
1 1 1    1    5   44 o   37.290   10.075   31.216   21.592   32.106   30.107   30.273   30.983   37.526   14.194   37.054   14.304 0.4720573 20.15090 
1 1 1    1    5   45 o   33.724   8.8228   23.875   17.044   10.170   23.914   38.024   24.298   28.542   11.992   38.906   12.945 -10.36395 17.64568 
1 1 1    1    5   46 o   57.193   7.6171   81.654   17.240   52.132   24.350  111.324   24.411   44.452   12.667   69.934   8.4633 -25.48140 15.23419 
1 1 1    1    5   47 o   26.266   8.3684  -2.6652   19.549   11.354   27.771 -16.4359   27.524   29.187   12.610   23.344   11.005 5.843636 16.73689 
1 1 1    1    5   48 o   26.448   8.2635   6.1124   17.733   3.6736   25.079   8.5509   25.078   25.849   11.541   27.047   11.830 -1.197702 16.52702 
1 1 1    1    5   49 o   25.406   7.9139  -0.1771   17.168 -20.5746   23.828   21.843   24.758   20.416   9.7960   30.397   12.432 -9.980854 15.82790 
1 1 1    1    5   50 o   23.566   7.9592 -14.7689   21.698 -15.9993   30.627 -13.5289   30.745   23.371   11.185   23.761   11.326 -0.3899078 15.91844 
1 1 1    1    5   51 o   27.854   9.2416   8.1011   26.945   1.5725   38.393   14.438   37.826   26.966   12.797   28.741   13.336 -1.775566 18.48323 
1 1 1    1    5   52 o   26.521   8.9525  -1.7373   27.401   24.049   40.259 -23.9906   37.400   29.730   13.782   23.312   11.430 6.417976 17.90509 
1 1 1    1    6    0 o  361.103   3.9744  2691.94   83.665  2691.94   83.665  2691.94   83.665  361.103   5.6206  361.103   5.6206 0.000000 0.000000 
1 1 1    1    6    1 o  299.253   3.5098  1846.46   43.294  1884.46   62.530  1811.46   60.003  302.207   5.0167  296.299   4.9099 5.907562 7.019567 
1 1 1    1    6    2 o  238.640   2.8444  1158.63   26.910  1118.43   33.426  1232.66   45.365  232.850   3.4805  244.429   4.4999 -11.57884 5.688893 
1 1 1    1    6    3 o  637.751   4.8101  8407.85  125.704  8492.00  168.914  8303.40  188.190  641.376   6.3854  634.125   7.1954 7.250549 9.620132 
1 1 1    1    6    4 o  206.084   2.5560  874.397   20.327  871.141   24.692  881.243   35.806  205.504   2.9131  206.664   4.2007 -1.159729 5.111973 
1 1 1    1    6    5 o  256.144   2.2953  1353.32   24.246  1366.30   34.615  1340.83   33.972  257.348   3.2612  254.939   3.2308 2.409271 4.590600 
1 1 1    1    6    6 o  169.026   2.2588  589.173   15.743  602.164   22.571  576.865   21.969  170.840   3.2033  167.213   3.1855 3.626770 4.517581 
1 1 1    1    6    7 o  257.473   2.3281  1367.59   24.718  1383.71   35.362  1352.19   34.565  258.955   3.3109  255.991   3.2738 2.964554 4.656140 
1 1 1    1    6    8 o  181.939   2.0548  682.917   15.419  677.161   21.683  688.805   21.930  181.164   2.9019  182.714   2.9101 -1.550690 4.109693 
1 1 1    1    6    9 o  659.530   4.6239  8992.59  125.777  8970.78  177.192  9014.74  178.567  658.729   6.5219  660.332   6.5565 -1.603088 9.247828 
1 1 1    1    6   10 o  234.677   3.2276  1136.64   31.234  1117.46   43.633  1156.79   44.729  232.649   4.5473  236.705   4.5816 -4.056793 6.455146 
1 1 1    1    6   11 o  455.449   3.4101  4282.67   64.057  4294.86   90.969  4270.69   90.216  456.090   4.8359  454.808   4.8094 1.282410 6.820266 
1 1 1    1    6   12 o  178.165   2.2129  654.833   16.261  660.944   23.103  648.835   22.891  178.989   3.1295  177.342   3.1296 1.647141 4.425829 
1 1 1    1    6   13 f  173.141   2.2800  618.351   16.281  625.964   23.147  610.896   22.905  174.196   3.2218  172.086   3.2272 2.109421 4.560084 
1 1 1    1    6   14 o  422.771   3.7699  3688.43   65.734  3674.81   92.543  3702.29   93.387  421.985   5.3172  423.558   5.3457 -1.573090 7.539872 
1 1 1    1    6   15 o  404.875   3.6882  3382.13   61.570  3345.26   85.830  3421.20   88.372  402.605   5.1688  407.144   5.2626 -4.538300 7.376441 
1 1 1    1    6   16 o  285.404   3.4412  1676.18   39.555  1702.40   63.400  1659.47   50.613  287.207   5.3521  283.601   4.3270 3.606445 6.882481 
1 1 1    1    6   17 o  486.390   4.2130  4883.37   84.505  4915.67  120.718  4852.32  118.333  487.964   5.9981  484.816   5.9178 3.147675 8.426066 
1 1 1    1    6   18 o  561.146   4.0884  6488.83   94.410  6337.29  128.638  6665.76  138.994  554.073   5.6291  568.219   5.9308 -14.14655 8.176858 
1 1 1    1    6   19 o  182.286   2.7302  689.180   20.372  719.959   27.558  652.092   30.251  186.804   3.5768  177.769   4.1258 9.035843 5.460402 
1 1 1    1    6   20 o  202.302   3.5983  844.956   30.017  822.299   42.315  867.906   42.587  199.570   5.1409  205.035   5.0360 -5.464508 7.196517 
1 1 1    1    6   21 o  106.554   3.2580  234.676   14.297  247.904   20.145  221.251   20.295  109.587   4.4569  103.521   4.7533 6.065514 6.515980 
1 1 1    1    6   22 o  429.465   3.3950  3808.42   60.130  3832.31   85.700  3785.25   84.389  430.789   4.8234  428.141   4.7790 2.648315 6.789964 
1 1 1    1    6   23 o  113.362   3.4894  265.776   16.253  295.405   23.166  237.059   22.807  119.600   4.6963  107.123   5.1621 12.47624 6.978724 
1 1 1    1    6   24 o  231.145   3.2491  1102.03   30.949  1065.41   42.710  1142.52   44.910  227.111   4.5595  235.180   4.6300 -8.069565 6.498168 
1 1 1    1    6   25 o  158.214   2.9887  516.992   19.501  527.859   27.743  506.379   27.417  159.859   4.2077  156.570   4.2456 3.288559 5.977454 
1 1 1    1    6   26 o  206.522   2.8288  880.575   24.085  898.853   34.683  863.552   33.472  208.588   4.0315  204.456   3.9693 4.131424 5.657573 
1 1 1    1    6   27 o  111.469   3.6412  257.293   16.720  268.159   23.446  246.048   23.851  113.877   4.9920  109.062   5.3024 4.814919 7.282500 
1 1 1    1    6   28 o  193.837   2.8614  776.462   22.876  770.066   32.297  782.901   32.406  193.035   4.0565  194.639   4.0367 -1.604034 5.722796 
1 1 1    1    6   29 o   60.906   8.6104   80.836   21.105   64.412   30.596   95.744   29.151   54.173   13.688   67.640   10.449 -13.46771 17.22071 
1 1 1    1    6   30 o  169.968   3.0418  597.414   21.323  599.677   30.216  595.170   30.096  170.289   4.3022  169.648   4.3012 0.6409302 6.083539 
1 1 1    1    6   31 f   35.957   8.2458   22.725   15.523   43.396   22.218   3.0123   21.697   44.592   11.870   27.323   11.448 17.26887 16.49154 
1 1 1    1    6   32 o  129.010   3.6859  344.591   19.596  325.373   27.386  364.755   28.053  125.316   5.2986  132.704   5.1254 -7.387245 7.371835 
1 1 1    1    6   33 o  116.485   4.0633  281.940   19.466  307.638   27.611  256.549   27.446  121.800   5.4964  111.170   5.9859 10.62951 8.126559 
1 1 1    1    6   34 o   77.798   6.1518  127.963   19.423  154.590   27.564  101.701   27.375   86.036   7.7677   69.561   9.5416 16.47454 12.30364 
1 1 1    1    6   35 o   35.911   9.0347   22.692   17.441   35.381   24.945   10.555   24.395   40.836   13.085   30.986   12.462 9.849453 18.06942 
1 1 1    1    6   36 o   69.462   6.5881  102.480   18.695   85.984   26.267  119.415   26.615   63.639   10.007   75.285   8.5712 -11.64622 13.17623 
1 1 1    1    6   37 o   38.870   10.072   28.436   21.374   20.105   30.674   36.299   29.800   36.177   14.157   41.564   14.331 -5.387051 20.14429 
1 1 1    1    6   38 o   31.764   8.8227   14.769   16.980   18.958   24.044   10.600   23.984   33.240   12.658   30.287   12.294 2.953651 17.64542 
1 1 1    1    6   39 o   47.552   8.6220   52.288   17.362   67.725   24.941   37.775   24.184   54.378   11.481   40.725   12.866 13.65217 17.24391 
1 1 1    1    6   40 f   51.081   8.8563   60.335   21.104   97.764   29.735   22.345   29.957   66.390   10.859   35.772   13.993 30.61825 17.71252 
1 1 1    1    6   41 o   37.252   9.2755   29.310   18.404   15.565   25.529   44.181   26.554   31.697   12.748   42.807   13.477 -11.10988 18.55107 
1 1 1    1    6   42 o   35.342   8.9574   26.461   16.942   17.184   23.747   36.079   24.180   31.549   12.423   39.136   12.908 -7.586330 17.91473 
1 1 1    1    6   43 o   30.871   8.6843   15.676   16.876   7.3745   24.155   23.592   23.587   28.234   11.967   33.509   12.588 -5.275007 17.36859 
1 1 1    1    6   44 o   35.988   9.8142   26.378   21.325   11.809   30.004   41.248   30.314   31.353   13.316   40.622   14.420 -9.269032 19.62834 
1 1 1    1    6   45 o   33.857   9.1617   24.940   18.121   17.593   26.240   31.637   25.054   31.496   12.831   36.218   13.081 -4.721672 18.32342 
1 1 1    1    6   46 o   53.159   7.8924   71.587   17.257   98.326   24.470   45.132   24.340   65.165   9.1045   41.152   12.895 24.01287 15.78486 
1 1 1    1    6   47 o   26.091   8.3871  -1.7145   19.680  -0.5236   26.695  -3.1322   29.126   25.916   11.710   26.265   12.010 -0.3498783 16.77426 
1 1 1    1    6   48 o   49.916   8.8672   69.674   18.708   52.241   26.554   86.856   26.362   42.263   13.496   57.569   11.505 -15.30584 17.73436 
1 1 1    1    6   49 o   44.470   8.5943   56.098   18.362   88.730   26.425   25.630   25.533   57.423   11.557   31.516   12.723 25.90641 17.18854 
1 1 1    1    6   50 o   38.865   9.5579   43.010   22.793   87.224   32.725   1.3527   31.765   51.391   14.699   26.339   12.221 25.05229 19.11581 
1 1 1    1    6   51 o   34.187   10.654   43.118   29.406   68.683   44.235   22.875   39.362   38.336   16.219   30.037   13.818 8.298954 21.30723 
1 1 1    1    7    0 o  228.621   2.4702  1078.84   32.923  1078.84   32.923  1078.84   32.923  228.621   3.4934  228.621   3.4934 0.000000 0.000000 
1 1 1    1    7    1 o  220.528   2.7247  1000.10   24.165  988.747   30.832  1018.17   38.910  218.923   3.4147  222.133   4.2470 -3.210190 5.449471 
1 1 1    1    7    2 o  454.449   4.4039  4195.55   78.445  4050.47   96.121  4484.89  135.744  442.966   5.2612  465.931   7.0637 -22.96530 8.807708 
1 1 1    1    7    3 o  406.662   3.3251  3415.03   55.254  3425.71   73.382  3401.05   83.965  407.421   4.3670  405.903   5.0155 1.518188 6.650229 
1 1 1    1    7    4 o  265.471   3.0310  1454.51   32.466  1454.32   41.788  1454.79   51.568  265.472   3.8165  265.469   4.7098 0.3295898E-02 6.061976 
1 1 1    1    7    5 o  409.391   3.3582  3457.60   56.020  3442.72   73.647  3478.02   86.295  408.383   4.3724  410.398   5.0982 -2.015137 6.716357 
1 1 1    1    7    6 o  319.433   3.0159  2106.40   39.733  2111.67   56.368  2101.19   56.017  319.829   4.2731  319.036   4.2571 0.7933350 6.031807 
1 1 1    1    7    7 o  182.319   2.0432  685.827   15.364  685.163   21.701  686.494   21.756  182.231   2.8873  182.408   2.8918 -0.1767426 4.086448 
1 1 1    1    7    8 o  355.648   2.8281  2610.79   41.484  2603.15   58.466  2618.54   58.871  355.124   3.9917  356.171   4.0075 -1.046631 5.656287 
1 1 1    1    7    9 o  544.743   3.9218  6129.26   88.102  6091.20  123.460  6168.74  125.762  543.026   5.5124  546.460   5.5799 -3.434082 7.843564 
1 1 1    1    7   10 o  244.204   4.0939  1217.92   38.207  1195.41   45.861  1268.98   69.076  240.633   4.6209  247.775   6.7594 -7.141525 8.187897 
1 1 1    1    7   11 o  325.983   3.5156  2201.00   46.574  2149.97   71.871  2237.93   61.151  322.684   5.4002  329.281   4.5027 -6.597168 7.031134 
1 1 1    1    7   12 o  318.074   2.9170  2092.36   38.061  2037.90   56.437  2137.80   51.548  314.258   4.3542  321.889   3.8827 -7.630737 5.833948 
1 1 1    1    7   13 o  203.990   2.6822  858.354   22.565  846.763   31.740  870.199   32.086  202.598   3.7985  205.382   3.7878 -2.784744 5.364314 
1 1 1    1    7   14 o  624.791   4.7708  8074.62  122.641  7820.85  178.064  8303.64  169.160  615.403   7.0154  634.179   6.4673 -18.77606 9.541540 
1 1 1    1    7   15 o  255.910   2.5404  1350.87   26.812  1366.75   38.166  1335.40   37.675  257.394   3.5951  254.426   3.5903 2.968628 5.080822 
1 1 1    1    7   16 o  438.254   3.8907  3964.22   70.327  3963.90   99.419  3964.53   99.495  438.236   5.5004  438.271   5.5042 -0.3494263E-01 7.781407 
1 1 1    1    7   17 o   96.379   3.0006  191.663   11.927  192.170   16.950  191.165   16.786   96.505   4.2585   96.253   4.2284 0.2523880 6.001144 
1 1 1    1    7   18 o  256.102   2.5748  1352.41   27.187  1326.29   37.834  1380.30   39.094  253.547   3.6179  258.656   3.6646 -5.108826 5.149614 
1 1 1    1    7   19 o  148.262   2.6653  453.601   16.296  451.104   23.212  456.027   22.883  147.859   3.8063  148.665   3.7320 -0.8063202 5.330667 
1 1 1    1    7   20 o  439.452   3.6886  3989.57   66.263  4002.26   88.118  3973.06  100.522  440.294   4.8524  438.609   5.5567 1.684814 7.377188 
1 1 1    1    7   21 f  108.810   3.2691  244.529   14.662  241.619   21.045  247.273   20.438  108.178   4.7168  109.441   4.5277 -1.263519 6.538268 
1 1 1    1    7   22 o  228.292   2.6989  1074.45   25.396  1113.36   36.718  1038.77   35.163  232.248   3.8332  224.336   3.8004 7.912521 5.397799 
1 1 1    1    7   23 f  210.890   2.7551  918.154   23.964  923.878   33.887  912.429   33.892  211.548   3.8838  210.232   3.9087 1.316254 5.510182 
1 1 1    1    7   24 f  109.480   4.4200  247.622   19.923  227.590   27.663  269.208   28.716  104.878   6.3951  114.082   6.1031 -9.203728 8.839925 
1 1 1    1    7   25 o  118.872   3.8806  292.335   19.015  293.086   26.464  291.534   27.339  119.036   5.3904  118.708   5.5839 0.3285828 7.761148 
1 1 1    1    7   26 o   82.441   4.5331  140.897   15.402  136.830   22.002  144.804   21.567   81.265   6.5643   83.617   6.2536 -2.352409 9.066253 
1 1 1    1    7   27 o   93.802   4.0953  182.163   15.842  184.450   22.358  179.856   22.451   94.396   5.7426   93.207   5.8402 1.189026 8.190554 
1 1 1    1    7   28 o  101.553   3.9915  213.286   16.694  230.275   24.052  197.495   23.188  105.458   5.5297   97.647   5.7577 7.810837 7.983021 
1 1 1    1    7   29 o   93.830   4.1660  182.460   16.121  182.598   22.673  182.319   22.926   93.869   5.8564   93.792   5.9265 0.7733154E-01 8.331934 
1 1 1    1    7   30 o   80.856   5.1360  134.854   16.911  167.737   25.067  107.388   22.909   89.876   6.7623   71.837   7.7322 18.03914 10.27208 
1 1 1    1    7   31 o   50.779   7.6226   55.662   15.854   73.624   22.700   38.556   22.152   59.336   9.2754   42.222   12.099 17.11454 15.24514 
1 1 1    1    7   32 o   67.429   5.9874   95.018   16.606  103.755   23.624   86.483   23.349   70.529   8.1210   64.329   8.8002 6.200554 11.97472 
1 1 1    1    7   33 o   56.685   9.2000   71.249   21.244   87.791   30.109   54.848   29.980   63.440   11.945   49.930   13.995 13.51051 18.39996 
1 1 1    1    7   34 o   27.153   8.1203  -4.7550   16.944 -25.1297   24.169   14.939   23.762   22.009   10.357   32.298   12.510 -10.28872 16.24070 
1 1 1    1    7   35 o   78.235   5.7339  128.486   18.490  127.310   26.549  129.594   25.768   77.861   8.2671   78.610   7.9476 -0.7490692 11.46778 
1 1 1    1    7   36 o   77.177   6.0067  126.644   18.764   98.344   26.321  155.887   26.756   68.152   9.3640   86.202   7.5256 -18.05067 12.01332 
1 1 1    1    7   37 o   89.602   5.1022  169.314   18.837  174.807   26.379  163.598   26.908   91.138   7.0176   88.066   7.4082 3.071655 10.20435 
1 1 1    1    7   38 o   26.558   8.1492  -9.2917   18.003 -33.4754   25.674   14.102   25.251   21.213   10.176   31.904   12.731 -10.69110 16.29833 
1 1 1    1    7   39 o   33.340   8.5365   17.093   16.807  -4.0133   23.688   38.491   23.850   25.677   11.354   41.003   12.751 -15.32613 17.07298 
1 1 1    1    7   40 o   52.989   8.0089   65.114   16.976   68.205   24.090   62.065   23.926   54.366   11.119   51.613   11.530 2.752262 16.01787 
1 1 1    1    7   41 o   62.289   7.5050   88.669   18.751   78.917   26.520   98.417   26.516   58.016   11.490   66.562   9.6586 -8.546177 15.00992 
1 1 1    1    7   42 o   49.192   8.5886   58.539   17.628   72.544   24.761   44.145   25.102   55.674   11.172   42.711   13.048 12.96259 17.17717 
1 1 1    1    7   43 o   22.650   7.4458 -14.8751   16.817 -12.3655   23.423 -17.5452   24.160   22.956   10.596   22.345   10.464 0.6115131 14.89169 
1 1 1    1    7   44 o   28.867   8.5749   9.4935   17.481   16.152   24.467   2.5500   24.985   30.748   12.440   26.985   11.805 3.762926 17.14976 
1 1 1    1    7   45 o   34.257   9.2323   26.475   18.135   30.042   25.923   23.057   25.378   35.553   13.227   32.961   12.883 2.591343 18.46464 
1 1 1    1    7   46 o   26.049   7.9124   3.5669   16.081 -11.6164   23.309   17.357   22.214   22.407   10.421   29.691   11.909 -7.284630 15.82471 
1 1 1    1    7   47 f   31.197   9.1008   20.676   19.142   13.093   29.960   25.906   24.883   29.824   12.990   32.569   12.749 -2.744522 18.20159 
1 1 1    1    7   48 o   30.559   8.2327   10.674   17.578 -23.5805   24.335   48.048   25.419   20.378   9.8091   40.740   13.225 -20.36189 16.46547 
1 1 1    1    7   49 o   21.518   7.4107 -32.7977   21.427 -51.5855   30.931 -15.4633   29.711   19.668   9.7790   23.368   11.138 -3.699854 14.82142 
1 1 1    1    7   50 o   29.841   9.3122   20.076   22.453   17.331   31.949   22.754   31.561   29.270   13.050   30.413   13.287 -1.143518 18.62441 
1 1 1    1    7   51 o   26.308   8.8886  -1.3670   27.247 -10.3010   40.361   6.1136   36.932   25.587   12.394   27.030   12.745 -1.443237 17.77728 
1 1 1    1    8    0 o  462.298   3.3947  4411.36   91.516  4411.36   91.516  4411.36   91.516  462.298   4.8008  462.298   4.8008 0.000000 0.000000 
1 1 1    1    8    1 o  314.231   3.3248  2030.70   41.932  2005.04   53.303  2072.38   67.922  311.676   4.1465  316.786   5.1985 -5.110962 6.649651 
1 1 1    1    8    2 o  414.026   3.8629  3513.67   61.219  3469.11   73.680  3613.01  110.013  409.940   4.3578  418.113   6.3795 -8.172882 7.725781 
1 1 1    1    8    3 o  270.283   2.9122  1493.05   30.087  1468.94   36.139  1547.50   54.313  266.810   3.2840  273.756   4.8103 -6.945953 5.824440 
1 1 1    1    8    4 o  340.082   3.1392  2386.34   44.006  2428.45   63.535  2347.50   61.009  342.960   4.4917  337.205   4.3866 5.755402 6.278346 
1 1 1    1    8    5 o  187.958   3.2463  731.353   19.930  732.575   22.220  726.325   45.075  188.432   2.8591  187.483   5.8291 0.9481201 6.492531 
1 1 1    1    8    6 o  227.269   2.5492  1063.80   23.861  1105.70   34.892  1026.98   32.704  231.463   3.6549  223.076   3.5546 8.387192 5.098383 
1 1 1    1    8    7 o  218.325   2.3621  977.748   20.892  1014.10   33.057  953.570   26.959  221.672   3.6156  214.978   3.0404 6.694031 4.724104 
1 1 1    1    8    8 o  462.158   3.9637  4411.69   75.544  4440.17  107.836  4384.24  105.862  463.618   5.6395  460.698   5.5713 2.919464 7.927356 
1 1 1    1    8    9 o  119.118   2.6693  293.648   12.861  297.171   16.685  288.491   20.187  120.009   3.3709  118.226   4.1399 1.782463 5.338696 
1 1 1    1    8   10 o  244.540   2.3453  1233.68   23.653  1243.00   33.656  1224.59   33.249  245.452   3.3245  243.628   3.3089 1.823242 4.690562 
1 1 1    1    8   11 o  261.259   2.8260  1407.79   30.443  1385.72   42.452  1431.16   43.681  259.152   3.9717  263.366   4.0213 -4.213593 5.652032 
1 1 1    1    8   12 o  380.118   3.0146  2979.86   47.243  2941.65   65.710  3020.75   67.972  377.598   4.2192  382.638   4.3070 -5.039520 6.029275 
1 1 1    1    8   13 o   93.304   2.7359  179.599   10.528  180.251   14.954  178.958   14.826   93.472   3.8788   93.136   3.8596 0.3357162 5.471862 
1 1 1    1    8   14 o  166.801   2.3688  573.909   16.296  580.910   23.140  567.021   22.953  167.810   3.3433  165.792   3.3567 2.018448 4.737619 
1 1 1    1    8   15 o  278.683   3.0522  1600.85   35.056  1564.33   48.452  1640.98   50.783  275.352   4.2664  282.014   4.3660 -6.662445 6.104408 
1 1 1    1    8   16 o   99.619   2.8712  204.796   11.791  213.198   16.723  196.490   16.626  101.652   3.9888   97.586   4.1309 4.066269 5.742344 
1 1 1    1    8   17 o  170.032   2.4294  596.417   17.037  599.576   24.174  593.299   24.014  170.480   3.4380  169.585   3.4333 0.8946686 4.858736 
1 1 1    1    8   18 o  187.288   2.5024  723.692   19.330  725.976   27.359  721.414   27.314  187.583   3.5362  186.993   3.5416 0.5904083 5.004749 
1 1 1    1    8   19 o  357.368   3.4565  2636.52   50.947  2634.00   72.102  2639.04   71.998  357.197   4.8941  357.540   4.8824 -0.3425293 6.913040 
1 1 1    1    8   20 o  107.439   3.1916  238.259   14.140  236.880   19.770  239.704   20.232  107.122   4.4746  107.757   4.5522 -0.6346436 6.383145 
1 1 1    1    8   21 o  272.476   3.1294  1532.68   35.166  1516.91   49.438  1548.82   50.032  271.058   4.4222  273.893   4.4290 -2.835449 6.258710 
1 1 1    1    8   22 o  181.972   2.7647  683.475   20.744  686.960   29.724  680.166   28.964  182.423   3.9505  181.522   3.8687 0.9005432 5.529338 
1 1 1    1    8   23 o  124.217   3.2701  318.665   16.747  306.339   23.517  331.346   23.853  121.777   4.6823  126.656   4.5661 -4.878250 6.540145 
1 1 1    1    8   24 o  260.478   3.2866  1401.77   35.296  1397.77   49.202  1406.01   50.661  260.101   4.5865  260.854   4.7088 -0.7528687 6.573295 
1 1 1    1    8   25 f  127.990   3.6751  338.698   19.396  329.456   27.159  348.320   27.711  126.207   5.2175  129.773   5.1773 -3.565918 7.350278 
1 1 1    1    8   26 o  166.407   2.9112  572.177   19.974  590.630   28.313  553.891   28.183  169.083   4.0599  163.731   4.1733 5.351486 5.822319 
1 1 1    1    8   27 o  130.578   3.3334  352.539   17.950  348.757   25.161  356.459   25.617  129.867   4.6974  131.290   4.7307 -1.423569 6.666715 
1 1 1    1    8   28 o   87.427   5.1065  158.735   18.407  157.880   26.345  159.551   25.728   87.188   7.3261   87.665   7.1157 -0.4775696 10.21302 
1 1 1    1    8   29 o  106.387   3.8236  235.691   16.639  200.952   23.528  270.447   23.534   98.468   5.7932  114.306   4.9918 -15.83783 7.647181 
1 1 1    1    8   30 o  149.965   3.5837  465.526   22.152  489.241   31.602  442.619   31.059  153.729   4.9842  146.202   5.1507 7.527252 7.167453 
1 1 1    1    8   31 o   35.810   8.6585   24.995   15.440   21.461   22.161   28.329   21.525   34.378   12.316   37.242   12.174 -2.864208 17.31706 
1 1 1    1    8   32 o  105.507   4.1758  230.934   18.165  222.400   25.464  239.777   25.921  103.517   5.9641  107.498   5.8463 -3.981346 8.351653 
1 1 1    1    8   33 o   85.739   7.2530  154.765   25.640  151.573   36.443  157.895   36.081   84.836   10.415   86.642   10.097 -1.805435 14.50592 
1 1 1    1    8   34 o   76.263   5.8109  121.966   18.230  133.041   25.937  111.155   25.627   79.735   7.8870   72.791   8.5360 6.943474 11.62184 
1 1 1    1    8   35 o   77.912   5.8634  127.649   18.834  123.183   26.577  132.154   26.694   76.519   8.4210   79.304   8.1611 -2.785133 11.72675 
1 1 1    1    8   36 o  102.174   5.6772  219.867   23.922  221.990   34.124  217.815   33.545  102.651   8.0600  101.698   7.9974 0.9532547 11.35441 
1 1 1    1    8   37 o   59.545   7.3187   77.895   17.389   63.573   24.259   93.033   24.940   53.125   11.412   65.965   9.1667 -12.83965 14.63743 
1 1 1    1    8   38 o   40.144   9.4891   35.641   18.459   35.696   26.504   35.588   25.722   40.218   13.521   40.070   13.318 0.1478271 18.97820 
1 1 1    1    8   39 o   70.750   6.0802  107.871   17.686  117.956   25.106   97.936   24.918   74.169   8.2073   67.331   8.9730 6.837570 12.16034 
1 1 1    1    8   40 o   22.445   7.3587 -15.4952   16.271 -12.2078   22.973 -18.8042   23.048   23.088   10.597   21.803   10.213 1.285025 14.71741 
1 1 1    1    8   41 o   51.469   10.688   67.553   24.679   82.032   34.621   52.595   35.188   57.078   14.636   45.860   15.578 11.21790 21.37533 
1 1 1    1    8   42 o   41.176   8.9775   40.718   16.763   38.456   23.338   43.128   24.092   40.119   12.635   42.232   12.756 -2.113316 17.95500 
1 1 1    1    8   43 o   56.028   9.4298   78.969   21.479   76.962   30.720   80.889   30.042   55.110   13.599   56.947   13.068 -1.837990 18.85969 
1 1 1    1    8   44 o   44.205   9.0814   49.804   17.539   47.959   24.520   51.738   25.098   43.396   12.815   45.013   12.871 -1.616703 18.16287 
1 1 1    1    8   45 o   67.532   7.2536  110.050   18.786  145.576   26.697   75.207   26.440   80.559   8.0351   54.505   12.079 26.05397 14.50728 
1 1 1    1    8   46 o   49.009   8.2021   61.598   16.386   69.834   23.396   53.670   22.956   52.737   11.107   45.280   12.072 7.457306 16.40416 
1 1 1    1    8   47 o   47.008   8.9811   61.419   17.858   56.895   25.048   66.097   25.468   44.998   12.856   49.018   12.545 -4.020023 17.96214 
1 1 1    1    8   48 o   25.508   8.0054   1.4484   17.373 -12.9205   24.477   16.034   24.662   22.127   10.416   28.888   12.160 -6.760889 16.01081 
1 1 1    1    8   49 o   30.160   9.3024   16.935   22.406   36.629   32.578  -0.7432   30.865   34.388   14.186   25.932   12.038 8.456316 18.60480 
1 1 1    1    8   50 o   28.487   9.0702   12.888   22.541   28.068   33.280   0.0218   30.638   31.460   13.697   25.515   11.894 5.945017 18.14039 
1 1 1    1    8   51 o   23.369   8.0685 -22.1447   25.444  -9.5889   36.856 -33.5780   35.170   24.849   11.989   21.889   10.801 2.960522 16.13694 
1 1 1    1    9    0 f  324.000   2.6142  2166.56   49.389  2166.56   49.389  2166.56   49.389  324.000   3.6970  324.000   3.6970 0.000000 0.000000 
1 1 1    1    9    1 o  236.938   2.5321  1154.24   24.674  1213.95   36.609  1104.54   33.400  242.527   3.6598  231.348   3.5004 11.18001 5.064275 
1 1 1    1    9    2 o  238.176   2.7139  1162.35   24.799  1147.96   29.907  1194.01   44.369  235.871   3.0742  240.480   4.4734 -4.609055 5.427839 
1 1 1    1    9    3 o  200.476   2.9349  829.632   24.266  834.085   34.449  825.247   34.188  201.010   4.1552  199.942   4.1458 1.067322 5.869720 
1 1 1    1    9    4 o   66.206   2.2483   90.549   6.1312   85.718   8.7083   95.299   8.6340   64.451   3.2759   67.960   3.0803 -3.509056 4.496645 
1 1 1    1    9    5 o  247.426   3.6117  1264.31   29.010  1264.28   32.268  1264.43   66.256  247.532   3.1606  247.321   6.4953 0.2113953 7.223471 
1 1 1    1    9    6 o  174.021   2.0756  628.059   14.418  638.084   18.300  611.653   23.410  175.872   2.5228  172.170   3.2967 3.702179 4.151256 
1 1 1    1    9    7 o   67.297   2.2769   93.463   6.3174   92.811   9.0460   94.083   8.8264   67.068   3.2702   67.527   3.1691 -0.4590912 4.553889 
1 1 1    1    9    8 o  248.538   2.3157  1274.42   23.737  1266.84   33.393  1282.17   33.748  247.791   3.2674  249.286   3.2824 -1.494171 4.631415 
1 1 1    1    9    9 o  202.916   2.4931  849.031   20.858  829.602   29.056  869.687   29.960  200.522   3.5133  205.309   3.5381 -4.786514 4.986133 
1 1 1    1    9   10 o  181.512   2.1706  679.526   16.248  688.002   23.154  671.302   22.807  182.627   3.0739  180.397   3.0654 2.230026 4.341120 
1 1 1    1    9   11 o  235.154   2.7334  1140.56   26.508  1123.49   37.181  1158.21   37.803  233.365   3.8630  236.943   3.8682 -3.578568 5.466794 
1 1 1    1    9   12 o  350.626   2.8716  2535.02   41.506  2495.76   57.604  2577.42   59.857  347.806   4.0156  353.447   4.1061 -5.640472 5.743225 
1 1 1    1    9   13 o  395.364   3.1197  3225.05   50.868  3206.31   71.411  3244.35   72.477  394.199   4.3922  396.528   4.4316 -2.329376 6.239447 
1 1 1    1    9   14 o  156.383   2.3691  504.498   15.279  503.382   21.744  505.586   21.474  156.212   3.3749  156.554   3.3256 -0.3421783 4.738139 
1 1 1    1    9   15 o  153.330   3.3834  484.280   21.374  466.425   29.402  504.290   31.126  150.339   4.7417  156.321   4.8277 -5.981354 6.766842 
1 1 1    1    9   16 o  442.045   3.3858  4031.97   61.720  4065.15   88.218  4000.16   86.382  443.824   4.8192  440.266   4.7571 3.558167 6.771646 
1 1 1    1    9   17 o  161.340   2.4754  537.042   16.472  535.884   23.325  538.194   23.265  161.166   3.5091  161.514   3.4924 -0.3474121 4.950820 
1 1 1    1    9   18 o   66.201   4.2260   90.568   11.478  103.156   16.476   78.698   15.998   70.678   5.6518   61.724   6.2843 8.954517 8.451956 
1 1 1    1    9   19 o  690.831   5.6235  9871.01  160.207  9934.18  228.854  9810.29  224.347  692.984   8.0070  688.679   7.8984 4.305969 11.24705 
1 1 1    1    9   20 o  392.458   3.1834  3179.50   51.523  3203.52   73.528  3156.34   72.219  393.912   4.5258  391.005   4.4782 2.906982 6.366832 
1 1 1    1    9   21 o  238.844   3.0894  1177.62   30.431  1155.94   42.730  1199.93   43.349  236.614   4.3785  241.075   4.3597 -4.461411 6.178861 
1 1 1    1    9   22 o  251.297   2.7438  1303.32   28.433  1286.59   39.716  1320.92   40.723  249.644   3.8573  252.950   3.9034 -3.305435 5.487691 
1 1 1    1    9   23 f   59.797   6.1254   76.937   14.111   51.861   19.765  103.006   20.152   49.058   10.104   70.536   6.9271 -21.47712 12.25089 
1 1 1    1    9   24 o   81.898   4.5070  139.201   15.153  155.810   21.548  122.954   21.312   86.760   6.0218   77.037   6.7075 9.723145 9.014028 
1 1 1    1    9   25 o   59.832   7.5141   75.614   18.011   62.340   24.612   90.920   26.428   53.603   11.479   66.060   9.6998 -12.45716 15.02810 
1 1 1    1    9   26 o   66.518   5.2944   91.842   14.511   97.034   20.628   86.756   20.418   68.389   7.3134   64.647   7.6576 3.741997 10.58889 
1 1 1    1    9   27 o   80.440   4.5644  134.416   15.093  147.529   21.402  121.442   21.288   84.370   6.1502   76.510   6.7460 7.860382 9.128745 
1 1 1    1    9   28 o  106.028   4.4873  233.229   19.591  216.238   27.529  250.662   27.885  102.096   6.5376  109.960   6.1485 -7.864151 8.974691 
1 1 1    1    9   29 o   79.827   4.7076  132.639   15.423  148.525   21.893  116.988   21.730   84.614   6.2732   75.040   7.0210 9.574593 9.415278 
1 1 1    1    9   30 o  129.184   3.9436  343.222   20.891  399.921   30.945  295.744   28.317  138.932   5.4004  119.437   5.7484 19.49519 7.887220 
1 1 1    1    9   31 o  146.498   3.3629  444.397   20.314  452.862   28.597  435.774   28.862  147.915   4.6875  145.081   4.8233 2.833237 6.725829 
1 1 1    1    9   32 o  150.669   3.4182  470.433   21.229  454.324   30.148  486.277   29.898  148.095   4.9357  153.242   4.7304 -5.147186 6.836488 
1 1 1    1    9   33 o   80.233   7.8011  135.821   25.775  129.845   35.273  142.669   37.757   78.366   10.913   82.100   11.150 -3.734375 15.60219 
1 1 1    1    9   34 o   77.814   5.8049  129.040   18.206  158.605   25.601   98.788   25.897   87.140   7.1231   68.488   9.1679 18.65256 11.60987 
1 1 1    1    9   35 o   43.502   8.6778   40.293   17.640   63.722   25.109   17.458   24.788   53.558   11.695   33.445   12.824 20.11245 17.35568 
1 1 1    1    9   36 o  106.081   5.3344  237.344   23.279  216.836   32.773  258.224   33.070  101.362   7.8394  110.800   7.2365 -9.438881 10.66880 
1 1 1    1    9   37 o   49.000   8.0252   53.689   16.908   30.196   23.620   78.377   24.214   37.677   12.763   60.324   9.7320 -22.64766 16.05044 
1 1 1    1    9   38 o   26.243   7.9864 -12.7510   17.579 -41.3370   24.345   18.396   25.412   19.253   9.3934   33.233   12.919 -13.97940 15.97283 
1 1 1    1    9   39 o   57.726   7.3980   74.671   17.155   66.019   24.338   83.214   24.183   53.628   11.357   61.825   9.4839 -8.197060 14.79607 
1 1 1    1    9   40 o   35.092   8.7199   24.998   16.737   8.6482   24.010   40.452   23.344   28.948   12.079   41.235   12.580 -12.28683 17.43987 
1 1 1    1    9   41 o   24.940   8.1834 -17.2588   20.175 -20.9770   28.466 -13.5056   28.599   24.235   11.351   25.646   11.791 -1.411081 16.36687 
1 1 1    1    9   42 o   40.965   8.9235   40.683   16.589   36.985   23.045   44.659   23.899   39.224   12.578   42.706   12.662 -3.481926 17.84706 
1 1 1    1    9   43 o   45.981   9.4015   51.759   20.663   24.176   28.622   81.776   29.859   34.661   13.642   57.301   12.940 -22.63941 18.80293 
1 1 1    1    9   44 o   43.313   8.3533   46.047   17.220   18.475   24.256   74.062   24.450   31.312   12.483   55.314   11.103 -24.00249 16.70666 
1 1 1    1    9   45 o   22.638   7.3484  -9.0967   15.779 -16.7278   22.352  -1.5159   22.278   21.031   9.9160   24.245   10.847 -3.213684 14.69677 
1 1 1    1    9   46 f   28.336   8.0601   12.013   15.503   27.660   21.724  -4.2263   22.131   33.375   12.161   23.296   10.581 10.07853 16.12011 
1 1 1    1    9   47 o   53.984   8.3310   77.823   18.054   69.541   25.735   85.850   25.335   50.271   12.472   57.697   11.049 -7.425995 16.66202 
1 1 1    1    9   48 o   26.564   8.6812  -3.5396   22.678 -17.3309   32.476   9.5849   31.681   24.396   11.632   28.733   12.890 -4.336893 17.36235 
1 1 1    1    9   49 o   32.731   9.6955   29.094   23.048   10.101   33.289   46.579   31.942   28.323   12.908   37.140   14.471 -8.816744 19.39107 
1 1 1    1    9   50 o   33.661   9.8282   37.545   22.733   23.902   32.364   50.832   31.938   30.111   13.295   37.210   14.478 -7.099020 19.65643 
1 1 1    1    9   51 o   32.446   9.9509   34.218   24.197   17.405   30.881   60.960   38.946   27.859   12.591   37.034   15.413 -9.174984 19.90189 
1 1 1    1   10    0 o   83.764   2.1069  145.279   10.265  145.279   10.265  145.279   10.265   83.764   2.9797   83.764   2.9797 0.000000 0.000000 
1 1 1    1   10    1 o   95.419   2.5090  186.275   9.8219  215.357   14.611  162.302   13.266  102.157   3.4678   88.682   3.6270 13.47466 5.018084 
1 1 1    1   10    2 o  355.124   3.5079  2545.88   46.493  2470.96   54.692  2741.09   88.283  346.011   3.8324  364.236   5.8766 -18.22476 7.015855 
1 1 1    1   10    3 o  124.588   3.2476  317.230   15.317  312.445   18.261  328.586   28.130  123.046   3.5982  126.129   5.4075 -3.083168 6.495229 
1 1 1    1   10    4 o  271.406   3.3704  1520.91   37.727  1537.04   53.335  1504.75   53.372  272.848   4.7394  269.963   4.7934 2.884949 6.740829 
1 1 1    1   10    6 o   68.984   2.2010   97.745   5.9311   96.839   7.2818   99.530   10.223   68.516   2.5768   69.452   3.5690 -0.9356995 4.402029 
1 1 1    1   10    7 o  203.531   2.3162  858.376   19.332  897.188   26.349  813.123   28.452  208.541   3.0635  198.520   3.4749 10.02100 4.632444 
1 1 1    1   10    8 o  212.245   2.2017  929.103   19.271  939.759   27.552  918.897   26.963  213.436   3.1298  211.054   3.0975 2.381714 4.403408 
1 1 1    1   10    9 o  227.346   2.6029  1066.27   24.407  1064.07   34.510  1068.47   34.522  227.111   3.6842  227.581   3.6779 -0.4698944 5.205804 
1 1 1    1   10   10 o  202.059   2.2352  842.138   18.627  846.049   26.477  838.305   26.211  202.523   3.1698  201.595   3.1524 0.9287109 4.470436 
1 1 1    1   10   11 o  454.742   3.6969  4267.77   68.599  4267.53   90.639  4268.09  104.953  454.753   4.8325  454.732   5.5960 0.2166748E-01 7.393799 
1 1 1    1   10   12 o  330.134   3.0126  2251.51   40.658  2227.45   61.568  2270.11   54.143  328.557   4.5433  331.711   3.9574 -3.154266 6.025212 
1 1 1    1   10   13 o  128.449   2.4211  340.296   12.825  333.338   18.012  347.451   18.265  127.117   3.4355  129.781   3.4123 -2.663353 4.842144 
1 1 1    1   10   14 o  202.486   2.3450  845.785   19.584  849.932   27.798  841.699   27.594  202.979   3.3205  201.993   3.3121 0.9853058 4.689973 
1 1 1    1   10   15 o  455.793   4.4302  4303.44   82.280  4196.37  125.707  4383.70  108.831  450.771   6.7614  460.816   5.7261 -10.04565 8.860316 
1 1 1    1   10   16 o  329.060   2.8168  2233.39   38.217  2203.73   53.248  2264.90   54.882  326.809   3.9504  331.311   4.0163 -4.501770 5.633528 
1 1 1    1   10   17 o  114.565   2.7980  270.769   13.219  266.822   18.498  274.890   18.898  113.712   3.9441  115.418   3.9698 -1.705872 5.595962 
1 1 1    1   10   18 o  250.366   2.5965  1293.38   26.811  1280.84   37.697  1306.21   38.141  249.139   3.6686  251.594   3.6755 -2.454849 5.193071 
1 1 1    1   10   19 o  604.833   4.3528  7558.77  108.574  7519.80  152.309  7599.03  154.815  603.255   6.1215  606.412   6.1898 -3.156067 8.705578 
1 1 1    1   10   20 o  120.013   3.0913  297.438   15.298  291.270   21.699  303.534   21.570  118.773   4.4295  121.252   4.3131 -2.478561 6.182519 
1 1 1    1   10   21 o  187.953   2.9420  729.302   22.658  728.860   30.360  729.856   34.043  187.901   3.9175  188.005   4.3902 -0.1035156 5.883926 
1 1 1    1   10   22 o  412.232   3.3229  3510.01   56.489  3477.09   79.125  3544.22   80.672  410.264   4.6761  414.199   4.7222 -3.934570 6.645737 
1 1 1    1   10   23 o  108.431   3.5370  242.830   15.810  232.423   22.034  253.876   22.699  106.036   5.0381  110.826   4.9659 -4.789558 7.074075 
1 1 1    1   10   24 o  162.611   3.2641  546.357   21.887  534.131   30.595  559.172   31.324  160.749   4.6147  164.474   4.6175 -3.724762 6.528145 
1 1 1    1   10   25 f   80.541   5.5829  135.152   18.466  148.309   25.977  121.711   26.256   84.547   7.4494   76.535   8.3176 8.012596 11.16583 
1 1 1    1   10   26 o   69.060   5.2198  100.502   14.460  128.663   20.615   73.223   20.289   78.789   6.3438   59.332   8.2911 19.45652 10.43967 
1 1 1    1   10   27 o  213.367   3.0474  939.265   26.613  926.326   35.396  956.091   40.364  211.710   4.0536  215.023   4.5514 -3.313538 6.094814 
1 1 1    1   10   28 o  134.055   3.2612  371.790   18.024  372.612   25.153  370.923   25.840  134.213   4.5439  133.896   4.6791 0.3170624 6.522388 
1 1 1    1   10   29 o  168.492   3.0801  587.149   21.404  580.371   30.167  594.019   30.373  167.511   4.3664  169.472   4.3453 -1.960602 6.160119 
1 1 1    1   10   30 o  296.603   3.4047  1820.81   41.645  1837.47   59.480  1804.79   58.326  297.927   4.8406  295.278   4.7892 2.649139 6.809412 
1 1 1    1   10   31 o   31.865   8.1017   10.301   15.766   35.449   22.548 -13.7506   22.052   40.733   12.349   22.997   10.490 17.73605 16.20336 
1 1 1    1   10   32 o  100.427   4.4604  209.914   18.426  227.579   26.074  192.290   26.043  104.687   6.0388   96.168   6.5660 8.518883 8.920710 
1 1 1    1   10   33 o   37.143   9.0054   27.362   16.674   24.591   23.845   30.014   23.324   36.054   12.790   38.231   12.680 -2.177315 18.01079 
1 1 1    1   10   34 o  120.650   4.5833  305.876   22.434  317.256   29.528  290.335   34.505  123.462   5.7987  117.838   7.0995 5.624077 9.166659 
1 1 1    1   10   35 o   72.801   6.1425  112.237   18.204  135.489   26.165   90.424   25.342   80.278   7.9025   65.323   9.4061 14.95518 12.28509 
1 1 1    1   10   36 o  114.815   4.1973  276.106   19.860  265.996   28.265  285.965   27.911  112.696   6.0809  116.934   5.7872 -4.238396 8.394620 
1 1 1    1   10   37 o   79.393   5.4685  134.072   17.879  125.452   25.249  142.740   25.320   76.757   7.9756   82.030   7.4838 -5.272781 10.93696 
1 1 1    1   10   38 o   41.053   8.9517   38.273   16.780   45.521   24.280   31.645   23.218   44.234   12.664   37.873   12.655 6.360699 17.90330 
1 1 1    1   10   39 o   35.708   8.9853   26.973   16.694   23.001   23.150   31.276   24.095   33.915   12.523   37.502   12.889 -3.587498 17.97068 
1 1 1    1   10   40 o   25.487   8.0397  -5.0789   17.278 -11.0317   24.447   0.8616   24.421   24.083   11.009   26.890   11.720 -2.806200 16.07941 
1 1 1    1   10   41 o   44.140   9.4381   48.425   19.411   32.132   29.802   60.430   25.581   38.240   14.191   50.040   12.446 -11.80014 18.87611 
1 1 1    1   10   42 o   20.782   6.9947 -24.7179   16.602 -16.3608   22.929 -33.9270   24.069   21.899   10.235   19.666   9.5366 2.232840 13.98942 
1 1 1    1   10   43 o   42.362   9.1081   45.222   17.406   49.830   24.479   40.510   24.755   44.476   12.710   40.247   13.050 4.229610 18.21621 
1 1 1    1   10   44 o   48.295   8.5023   58.712   17.027   69.004   24.198   48.620   23.962   53.001   11.408   43.588   12.610 9.412334 17.00456 
1 1 1    1   10   45 o   23.423   7.4293  -8.6106   15.916   11.162   22.269 -29.2573   22.756   27.689   11.600   19.156   9.2855 8.533253 14.85853 
1 1 1    1   10   46 o   28.561   8.6544   11.229   18.365   18.018   26.045   4.5156   25.900   30.388   12.622   26.735   11.844 3.653496 17.30890 
1 1 1    1   10   47 o   36.147   7.3939   16.470   17.494   77.337   25.355 -38.8238   24.167   53.994   11.722   18.300   9.0153 35.69329 14.78781 
1 1 1    1   10   48 o   31.601   10.541   4.4597   36.347   35.237   51.848 -25.2826   50.969   35.183   16.063   28.019   13.653 7.163887 21.08110 
1 1 1    1   10   49 o   25.535   8.4472  -6.1290   22.564 -24.0072   31.663   12.318   32.163   22.628   10.965   28.442   12.853 -5.813910 16.89438 
1 1 1    1   10   50 o   22.258   7.6167 -28.8044   22.016   7.3108   31.207 -64.5926   31.065   26.401   12.202   18.116   9.1201 8.284992 15.23348 
1 1 1    1   11    0 o  254.287   2.6261  1334.75   38.933  1334.75   38.933  1334.75   38.933  254.287   3.7139  254.287   3.7139 0.000000 0.000000 
1 1 1    1   11    1 o  275.024   2.5667  1560.48   28.797  1562.91   44.120  1558.67   38.010  275.199   3.8871  274.850   3.3530 0.3488464 5.133435 
1 1 1    1   11    2 o  191.622   2.4088  768.217   17.205  782.933   20.463  732.719   31.781  194.819   2.5466  188.424   4.0894 6.394501 4.817515 
1 1 1    1   11    3 o  434.839   4.2080  3904.89   73.891  3903.12   95.251  3907.57  117.093  434.783   5.3117  434.895   6.5280 -0.1124268 8.416017 
1 1 1    1   11    4 o  269.642   3.9233  1498.62   37.585  1496.09   43.270  1506.39   75.851  269.264   3.8962  270.019   6.8109 -0.7545166 7.846569 
1 1 1    1   11    5 f  324.516   4.4851  2198.89   58.665  2054.03   91.689  2299.30   76.336  315.311   7.0504  333.722   5.5460 -18.41095 8.970270 
1 1 1    1   11    6 o  453.260   5.3125  4271.02   80.130  4289.75   89.956  4199.09  176.315  455.922   4.7838  450.598   9.4871 5.323578 10.62501 
1 1 1    1   11    7 o  406.620   3.7219  3376.58   55.166  3336.95   64.211  3488.29  107.796  402.180   3.8710  411.059   6.3582 -8.879547 7.443875 
1 1 1    1   11    8 o  777.574   9.3767 12446.60  279.168 12318.94  336.327 12729.41  500.580  771.821   10.565  783.327   15.494 -11.50592 18.75338 
1 1 1    1   11    9 o  287.597   2.7219  1703.79   31.916  1723.48   49.125  1689.40   41.983  289.025   4.1210  286.170   3.5570 2.854736 5.443816 
1 1 1    1   11   10 o  736.037   5.1096 11188.42  155.102 11142.10  217.861 11236.03  220.866  734.497   7.1916  737.576   7.2603 -3.078918 10.21915 
1 1 1    1   11   11 o  183.085   2.4900  687.907   18.489  672.475   23.926  710.780   29.129  180.555   3.2129  185.616   3.8049 -5.060730 4.979970 
1 1 1    1   11   12 o  376.551   3.4817  2926.00   54.073  2930.01   76.699  2922.03   76.245  376.806   4.9352  376.295   4.9127 0.5117493 6.963490 
1 1 1    1   11   13 o  432.174   3.3081  3852.37   58.935  3798.10   81.780  3911.00   85.006  429.013   4.6218  435.336   4.7343 -6.322174 6.616277 
1 1 1    1   11   14 o  334.558   3.0551  2300.32   41.504  2258.30   53.912  2361.45   65.031  330.838   3.9510  338.277   4.6611 -7.438538 6.110277 
1 1 1    1   11   15 o  445.232   3.3971  4088.93   62.343  4029.44   86.406  4153.51   90.039  441.861   4.7413  448.603   4.8663 -6.741882 6.794156 
1 1 1    1   11   16 o  379.943   3.5596  2979.82   55.778  2995.87   79.413  2964.19   78.361  380.951   5.0542  378.935   5.0138 2.015991 7.119270 
1 1 1    1   11   17 o  383.259   3.0931  3031.85   48.893  3023.95   68.939  3039.86   69.353  382.757   4.3669  383.762   4.3817 -1.004486 6.186218 
1 1 1    1   11   18 o  363.645   3.4835  2730.18   52.240  2750.61   74.540  2710.47   73.235  364.979   4.9517  362.311   4.9008 2.668488 6.966911 
1 1 1    1   11   19 f  115.198   3.0836  273.925   14.649  277.194   20.945  270.794   20.495  115.870   4.3827  114.526   4.3389 1.344254 6.167203 
1 1 1    1   11   20 o   90.828   3.7121  170.427   13.906  171.617   19.757  169.258   19.575   91.142   5.2558   90.514   5.2435 0.6282349 7.424168 
1 1 1    1   11   21 o   67.242   5.2352   95.902   14.054   69.029   20.031  121.952   19.722   57.699   8.4173   76.786   6.2274 -19.08674 10.47050 
1 1 1    1   11   22 o  130.848   3.5141  353.883   18.962  348.250   26.869  359.473   26.764  129.807   5.0186  131.888   4.9202 -2.080627 7.028178 
1 1 1    1   11   23 o  167.824   3.1842  586.424   21.624  606.184   28.256  558.495   33.594  171.300   3.9994  164.347   4.9560 6.952484 6.368422 
1 1 1    1   11   24 o  262.036   3.5199  1402.17   36.927  1349.69   46.502  1491.74   60.754  255.557   4.4119  268.514   5.4858 -12.95651 7.039812 
1 1 1    1   11   25 o   47.411   8.6299   48.717   17.198   37.606   24.040   60.365   24.614   42.135   12.746   52.686   11.638 -10.55114 17.25985 
1 1 1    1   11   26 o  147.560   3.0353  450.083   18.455  424.275   25.893  476.732   26.311  143.254   4.3824  151.867   4.2006 -8.613464 6.070517 
1 1 1    1   11   27 o  186.165   3.3356  714.178   25.560  660.982   34.965  775.233   37.459  178.745   4.7428  193.584   4.6916 -14.83922 6.671201 
1 1 1    1   11   28 o  177.903   3.3390  659.878   24.015  682.042   31.320  628.260   37.408  181.620   4.1812  174.186   5.2070 7.434372 6.677982 
1 1 1    1   11   29 o  115.637   3.6541  276.943   17.424  285.167   24.743  268.853   24.540  117.346   5.1122  113.929   5.2224 3.416428 7.308128 
1 1 1    1   11   30 o  128.993   3.5730  344.584   19.008  348.523   27.045  340.738   26.722  129.722   5.0548  128.265   5.0511 1.456451 7.145982 
1 1 1    1   11   31 o   55.452   7.7695   66.908   17.357   94.133   25.055   41.782   24.069   67.057   9.0591   43.847   12.625 23.21013 15.53899 
1 1 1    1   11   32 o   64.738   7.1679   89.783   18.539   76.316   26.019  103.670   26.422   59.183   11.066   70.292   9.1136 -11.10825 14.33579 
1 1 1    1   11   33 o  147.611   3.5540  452.310   21.630  441.634   30.707  462.824   30.474  145.867   5.1041  149.355   4.9470 -3.487564 7.108018 
1 1 1    1   11   34 o   38.752   9.6519   23.278   21.317  -3.2586   29.865   50.838   30.436   29.695   12.951   47.810   14.315 -18.11515 19.30381 
1 1 1    1   11   35 o  123.952   4.7313  321.601   24.172  309.008   33.492  335.292   34.922  121.424   6.6877  126.481   6.6944 -5.056709 9.462589 
1 1 1    1   11   36 o   33.224   8.2453   14.367   16.425   41.396   23.404 -11.8626   23.056   42.777   12.488   23.670   10.770 19.10668 16.49053 
1 1 1    1   11   37 o   58.657   7.5048   77.330   17.488   77.276   24.700   77.385   24.763   58.641   10.603   58.674   10.624 -0.3288651E-01 15.00956 
1 1 1    1   11   38 o   57.217   7.5267   74.662   17.063   98.114   24.161   51.330   24.100   67.477   8.6815   46.957   12.298 20.52040 15.05339 
1 1 1    1   11   39 o   36.455   8.9201   27.685   17.598   9.4779   25.371   44.564   24.429   29.788   12.422   43.122   12.805 -13.33462 17.84021 
1 1 1    1   11   40 o   29.362   8.3835   10.193   16.225  -1.3258   22.636   22.365   23.268   25.385   11.168   33.339   12.507 -7.953814 16.76693 
1 1 1    1   11   41 o   36.881   8.8552   30.433   16.594   41.921   23.631   19.257   23.307   41.671   12.644   32.091   12.401 9.580585 17.71041 
1 1 1    1   11   42 f   28.990   9.0046   2.6107   20.746   3.4997   29.006   1.6796   29.685   29.071   12.719   28.909   12.750 0.1621437 18.00921 
1 1 1    1   11   43 o   27.484   8.3242   6.4724   16.836   5.0228   23.564   7.9842   24.064   26.965   11.633   28.003   11.910 -1.038742 16.64842 
1 1 1    1   11   44 o   26.347   8.0319   1.5665   16.653 -14.1068   23.405   17.639   23.701   22.175   10.356   30.519   12.280 -8.344830 16.06371 
1 1 1    1   11   45 f   32.273   8.6252   24.374   15.770   27.928   22.412   20.888   22.195   33.659   12.339   30.888   12.055 2.770859 17.25034 
1 1 1    1   11   46 o   31.162   9.0863   21.399   18.908   22.687   26.650   20.094   26.830   31.535   12.898   30.790   12.801 0.7447090 18.17264 
1 1 1    1   11   47 o   33.334   8.7786   28.089   17.061   13.354   24.237   42.563   24.021   28.043   11.941   38.625   12.871 -10.58174 17.55720 
1 1 1    1   11   48 o   29.230   10.048 -20.3494   38.502 -58.2734   53.426   20.628   55.535   25.587   12.743   32.873   15.539 -7.285872 20.09589 
1 1 1    1   11   49 o   19.561   6.9033 -54.4214   22.675 -53.0165   31.625 -55.9077   32.528   19.518   9.7336   19.605   9.7919 -0.8700752E-01 13.80667 
1 1 1    1   11   50 o   26.421   8.8876  -3.1515   25.296   27.602   41.034 -22.0027   32.127   30.582   14.083   22.260   10.845 8.321321 17.77523 
1 1 1    1   12    0 o  299.747   2.5034  1854.03   43.754  1854.03   43.754  1854.03   43.754  299.747   3.5403  299.747   3.5403 0.000000 0.000000 
1 1 1    1   12    1 o  439.996   3.2749  3994.46   59.421  4026.93   84.962  3963.38   83.137  441.743   4.6633  438.248   4.5995 3.495270 6.549894 
1 1 1    1   12    2 o  222.963   2.6796  1011.33   22.738  989.374   27.179  1062.53   41.506  219.005   3.0089  226.921   4.4348 -7.916245 5.359212 
1 1 1    1   12    3 o  434.558   4.2024  3903.05   73.978  3924.23   96.126  3872.29  115.854  436.047   5.3449  433.069   6.4862 2.978516 8.404708 
1 1 1    1   12    4 o  504.847   5.9733  5287.46  108.721  5310.71  126.298  5220.96  213.643  507.227   6.0371  502.466   10.309 4.760193 11.94665 
1 1 1    1   12    5 o  374.312   3.8026  2888.64   57.322  2878.46   73.458  2904.48   91.663  373.499   4.7685  375.125   5.9245 -1.626831 7.605172 
1 1 1    1   12    6 o  306.433   2.7915  1937.45   34.904  1938.82   46.122  1935.61   53.396  306.569   3.6477  306.297   4.2267 0.2715454 5.583057 
1 1 1    1   12    7 o  531.261   4.1372  5834.62   90.139  5911.12  121.618  5741.39  134.271  535.159   5.5099  527.363   6.1732 7.796021 8.274498 
1 1 1    1   12    8 o  322.431   3.4529  2147.13   45.056  2154.42   58.393  2136.41   70.830  323.129   4.3815  321.732   5.3378 1.397034 6.905723 
1 1 1    1   12    9 f  442.442   3.3389  4037.81   60.903  3989.93   84.682  4089.11   87.654  439.729   4.6692  445.155   4.7741 -5.426025 6.677834 
1 1 1    1   12   10 o   91.720   2.8483  173.396   10.768  169.233   14.903  177.944   15.575   90.569   3.9896   92.870   4.0663 -2.300858 5.696635 
1 1 1    1   12   11 o  418.962   3.7117  3622.67   64.134  3609.51   90.209  3636.11   91.198  418.194   5.2300  419.730   5.2680 -1.536041 7.423306 
1 1 1    1   12   12 o  299.785   3.2354  1842.11   37.398  1819.96   45.305  1889.50   66.259  297.009   3.6983  302.561   5.3097 -5.552185 6.470738 
1 1 1    1   12   13 o  355.356   3.3352  2603.97   48.846  2556.76   67.552  2655.71   70.713  351.987   4.6531  358.726   4.7794 -6.739227 6.670377 
1 1 1    1   12   14 o  298.758   3.0346  1841.88   37.393  1840.15   52.871  1843.62   52.893  298.617   4.2927  298.899   4.2905 -0.2817383 6.069252 
1 1 1    1   12   15 o  186.062   2.3935  714.294   18.366  710.844   26.069  717.694   25.880  185.615   3.4052  186.509   3.3644 -0.8932953 4.786912 
1 1 1    1   12   16 o  306.922   3.1924  1944.14   40.405  1924.52   56.534  1964.62   57.768  305.341   4.4891  308.502   4.5401 -3.161652 6.384706 
1 1 1    1   12   17 o  310.423   2.7693  1988.40   35.451  2011.44   50.674  1966.31   49.614  312.183   3.9356  308.664   3.8972 3.519165 5.538682 
1 1 1    1   12   18 o  191.099   2.9211  753.464   23.015  768.448   33.105  739.447   32.018  192.936   4.1602  189.263   4.1016 3.672882 5.842107 
1 1 1    1   12   19 o   91.438   3.5477  172.889   13.365  166.198   19.081  179.332   18.725   89.696   5.1579   93.181   4.8723 -3.485413 7.095339 
1 1 1    1   12   20 o  257.155   2.6854  1365.19   28.481  1358.55   40.240  1371.85   40.318  256.528   3.8033  257.781   3.7921 -1.253387 5.370753 
1 1 1    1   12   21 o  111.741   3.3043  258.047   15.222  249.126   21.532  266.958   21.520  109.806   4.7545  113.675   4.5901 -3.869446 6.608627 
1 1 1    1   12   22 o  110.905   3.8627  254.436   17.668  253.127   24.835  255.779   25.140  110.617   5.4434  111.193   5.4818 -0.5754776 7.725333 
1 1 1    1   12   23 o   77.922   4.9438  126.317   15.722  103.974   21.948  149.866   22.532   70.788   7.5174   85.056   6.4229 -14.26852 9.887571 
1 1 1    1   12   24 o  235.666   2.7436  1146.75   26.660  1168.09   38.269  1126.63   37.160  237.793   3.9020  233.539   3.8579 4.253418 5.487143 
1 1 1    1   12   25 o  109.989   3.4988  250.256   15.871  251.738   22.630  248.821   22.263  110.308   4.9741  109.670   4.9219 0.6373367 6.997604 
1 1 1    1   12   26 f   99.224   4.4253  209.610   17.369  226.891   22.226  182.498   27.839  104.704   5.1467   93.743   7.2003 10.96043 8.850539 
1 1 1    1   12   27 o  138.548   3.7597  397.563   21.480  387.377   30.314  407.835   30.441  136.759   5.3742  140.337   5.2593 -3.577591 7.519474 
1 1 1    1   12   28 o   90.612   4.3390  170.290   16.206  171.276   23.354  169.375   22.508   90.856   6.2322   90.367   6.0388 0.4888229 8.677961 
1 1 1    1   12   29 o  109.350   3.8540  247.526   17.367  233.339   24.164  262.684   24.977  106.106   5.5215  112.595   5.3783 -6.488914 7.708035 
1 1 1    1   12   30 o  145.182   3.3938  436.559   20.316  425.311   28.749  447.781   28.714  143.305   4.8640  147.059   4.7342 -3.753220 6.787550 
1 1 1    1   12   31 o  177.211   3.4920  649.368   25.497  682.628   37.056  619.461   35.138  181.510   4.9498  172.912   4.9271 8.598083 6.984023 
1 1 1    1   12   32 o   30.061   8.6852   7.8613   17.099   10.496   23.937   5.1157   24.434   30.801   12.359   29.322   12.206 1.479036 17.37044 
1 1 1    1   12   33 o   46.530   8.5542   48.323   16.760   38.662   23.999   57.520   23.417   42.103   12.735   50.957   11.424 -8.853413 17.10833 
1 1 1    1   12   34 o  104.076   5.4990  227.728   23.588  235.451   33.165  219.824   33.554  105.908   7.5926  102.245   7.9567 3.663254 10.99802 
1 1 1    1   12   35 o   44.291   10.345   42.134   21.798   35.109   28.561   51.936   33.736   40.759   14.031   47.822   15.206 -7.062504 20.69006 
1 1 1    1   12   36 o  108.752   4.2555  248.687   19.009  221.254   26.687  276.940   27.083  102.559   6.3089  114.945   5.7127 -12.38607 8.511005 
1 1 1    1   12   37 o   33.777   8.7933   21.082   16.669   31.186   23.078   10.063   24.101   37.654   12.617   29.899   12.252 7.754272 17.58669 
1 1 1    1   12   38 o   31.134   8.4718   12.363   16.436   30.645   23.876  -4.1031   22.659   37.307   12.829   24.961   11.068 12.34561 16.94351 
1 1 1    1   12   39 o   22.499   7.5064 -23.1812   18.187 -26.4165   25.620 -19.8953   25.820   21.890   10.408   23.108   10.820 -1.217842 15.01281 
1 1 1    1   12   40 o   38.741   8.8219   34.403   16.600   47.417   23.761   21.997   23.200   44.315   12.473   33.166   12.479 11.14865 17.64378 
1 1 1    1   12   41 o   55.622   7.7265   73.016   17.278   54.493   24.242   92.138   24.631   47.102   12.333   64.142   9.3107 -17.03964 15.45310 
1 1 1    1   12   42 o   49.111   12.118   67.427   30.524   55.538   43.241   79.236   43.095   45.457   17.050   52.766   17.224 -7.308567 24.23546 
1 1 1    1   12   43 o   24.765   7.7980  -3.1286   16.315   5.7889   23.162 -11.9103   22.985   26.952   11.579   22.578   10.448 4.374346 15.59606 
1 1 1    1   12   44 o   41.977   8.5701   45.201   16.488   63.195   23.743   28.442   22.914   49.816   11.747   34.138   12.482 15.67886 17.14028 
1 1 1    1   12   45 o   32.971   8.1356   21.764   15.731  -1.9100   21.755   47.708   22.774   23.650   10.639   42.292   12.311 -18.64227 16.27121 
1 1 1    1   12   46 o   39.528   9.1727   41.426   20.079   10.088   28.085   74.195   28.719   28.272   12.438   50.784   13.485 -22.51176 18.34540 
1 1 1    1   12   47 o   35.354   9.9873   35.359   22.736   20.494   32.544   49.531   31.776   31.256   13.577   39.452   14.651 -8.196144 19.97458 
1 1 1    1   12   48 o   32.377   10.136   27.457   27.314   13.587   40.704   38.820   36.840   30.113   13.924   34.642   14.735 -4.528988 20.27291 
1 1 1    1   12   49 o   23.486   7.8620 -16.7551   21.297 -49.2166   30.541   13.969   29.712   19.271   9.6035   27.701   12.451 -8.429684 15.72400 
1 1 1    1   12   50 o   20.920   7.2585 -31.1922   21.583 -51.7835   30.677 -11.0110   30.370   18.807   9.4110   23.032   11.053 -4.224688 14.51709 
1 1 1    1   13    0 o  842.289   5.7580 14646.93  282.828 14646.93  282.828 14646.93  282.828  842.289   8.1431  842.289   8.1431 0.000000 0.000000 
1 1 1    1   13    1 o  515.207   3.7223  5476.77   79.079  5524.76  113.253  5431.10  110.469  517.406   5.3070  513.007   5.2210 4.398804 7.444680 
1 1 1    1   13    2 o  625.509   4.7270  8092.75  121.612  8304.65  167.221  7854.86  177.182  634.247   6.3924  616.770   6.9651 17.47717 9.453908 
1 1 1    1   13    3 f  112.770   2.6474  262.284   11.893  262.086   14.986  262.621   19.546  112.718   3.2234  112.821   4.2006 -0.1035233 5.294859 
1 1 1    1   13    4 o  311.454   4.5157  2010.00   54.799  2025.04   67.382  1980.62   94.171  313.242   5.2155  309.667   7.3732 3.574677 9.031390 
1 1 1    1   13    5 o  375.584   3.6118  2920.38   52.975  2939.91   65.278  2882.72   90.660  377.475   4.1929  373.693   5.8821 3.781860 7.223581 
1 1 1    1   13    6 o  471.174   4.5201  4585.31   86.065  4592.57  111.157  4574.46  135.992  471.694   5.7136  470.654   7.0056 1.039917 9.040125 
1 1 1    1   13    7 o  170.511   2.6751  604.188   17.344  611.288   20.886  588.421   31.127  172.149   2.9417  168.873   4.4690 3.276215 5.350247 
1 1 1    1   13    8 o  180.875   2.7145  668.390   19.701  647.752   24.932  702.697   32.146  177.202   3.4114  184.548   4.2232 -7.346893 5.428923 
1 1 1    1   13    9 o  182.538   2.3597  683.330   17.455  666.506   22.539  708.544   27.592  179.752   3.0401  185.324   3.6099 -5.571548 4.719474 
1 1 1    1   13   10 f  531.885   3.8584  5838.96   84.634  5803.86  118.647  5875.32  120.761  530.261   5.4250  533.510   5.4881 -3.248718 7.716851 
1 1 1    1   13   11 o  345.205   2.8292  2458.43   40.278  2439.65   56.480  2477.87   57.456  343.865   3.9824  346.545   4.0199 -2.680817 5.658476 
1 1 1    1   13   12 o  156.513   2.4493  503.554   15.598  494.606   20.365  516.253   24.261  154.842   3.1888  158.184   3.7187 -3.342499 4.898661 
1 1 1    1   13   13 o  404.563   3.6602  3378.03   61.058  3406.70   87.468  3350.78   85.273  406.233   5.2204  402.892   5.1316 3.340515 7.320305 
1 1 1    1   13   14 o  386.548   3.5363  3082.80   56.344  3032.74   78.074  3137.20   81.394  383.281   4.9388  389.815   5.0625 -6.534119 7.072550 
1 1 1    1   13   15 o  299.317   2.6931  1848.04   33.234  1877.10   47.799  1820.83   46.238  301.593   3.8427  297.042   3.7741 4.551086 5.386120 
1 1 1    1   13   16 o  348.533   3.8101  2488.97   52.825  2583.87   87.859  2435.24   66.108  353.627   6.0239  343.439   4.6670 10.18848 7.620235 
1 1 1    1   13   17 o  381.555   4.0188  3015.95   62.131  3050.85   80.906  2965.76   97.002  384.326   5.1040  378.785   6.2090 5.540924 8.037582 
1 1 1    1   13   18 o   25.079   7.2415   0.7110   12.569   13.842   18.231 -11.1835   17.352   29.700   11.084   20.458   9.3217 9.241356 14.48299 
1 1 1    1   13   19 o  152.016   3.0675  477.105   19.229  483.646   27.513  470.859   26.886  153.034   4.3591  150.999   4.3171 2.034576 6.135027 
1 1 1    1   13   20 o  325.337   2.8976  2185.64   38.877  2197.02   55.466  2174.64   54.508  326.167   4.1230  324.507   4.0726 1.659729 5.795275 
1 1 1    1   13   21 o   50.746   6.3072   54.957   12.753   44.336   18.030   65.591   18.041   45.272   9.9294   56.221   7.7803 -10.94974 12.61450 
1 1 1    1   13   22 o  217.498   2.8731  975.180   25.584  960.342   34.049  994.417   38.770  215.624   3.8287  219.372   4.2850 -3.747620 5.746284 
1 1 1    1   13   23 o  129.863   3.4743  348.315   18.598  361.339   26.850  336.304   25.785  132.193   4.9247  127.533   4.9021 4.660095 6.948590 
1 1 1    1   13   24 o  127.607   3.1217  336.672   16.428  331.609   23.264  341.707   23.202  126.647   4.4537  128.567   4.3755 -1.919380 6.243454 
1 1 1    1   13   25 o  156.827   2.9227  508.208   18.899  526.192   26.954  490.816   26.507  159.559   4.0958  154.096   4.1706 5.463196 5.845501 
1 1 1    1   13   26 o  152.992   4.8158  484.879   30.345  522.029   44.035  451.286   41.874  158.571   6.7330  147.413   6.8873 11.15816 9.631647 
1 1 1    1   13   27 o   94.290   4.1017  184.973   15.865  163.145   22.459  206.717   22.415   88.687   6.1398   99.893   5.4405 -11.20514 8.203463 
1 1 1    1   13   28 o   43.330   7.7787   41.040   14.513   24.497   20.633   57.241   20.418   35.235   11.929   51.424   9.9866 -16.18944 15.55743 
1 1 1    1   13   29 o   32.224   7.7311   12.405   14.825   38.821   20.942 -14.1277   20.988   42.234   11.646   22.213   10.171 20.02114 15.46214 
1 1 1    1   13   30 o   36.335   8.3159   25.188   15.353   8.4938   21.917   41.274   21.513   29.219   11.790   43.450   11.731 -14.23131 16.63184 
1 1 1    1   13   31 o   47.381   8.5255   49.876   16.746   54.887   22.811   44.018   24.662   49.950   11.332   44.812   12.740 5.138004 17.05099 
1 1 1    1   13   32 o   34.162   8.2750   17.788   16.075  -5.5688   22.890   40.517   22.580   25.395   11.198   42.928   12.186 -17.53377 16.54994 
1 1 1    1   13   33 o   63.936   6.8246   88.280   17.306   71.230   24.290  105.858   24.663   56.964   10.732   70.909   8.4329 -13.94521 13.64919 
1 1 1    1   13   34 o  111.927   4.7953  267.126   21.612  239.214   33.349  287.336   28.377  106.565   7.5875  117.290   5.8661 -10.72445 9.590662 
1 1 1    1   13   35 o   33.486   8.7937   18.928   16.713   7.9803   23.512   30.109   23.761   29.270   12.060   37.702   12.801 -8.432711 17.58743 
1 1 1    1   13   36 o   58.064   7.0658   74.547   16.513   79.223   23.143   69.696   23.569   60.532   9.2697   55.596   10.667 4.935760 14.13163 
1 1 1    1   13   37 o   49.883   8.1923   57.315   16.530   58.355   23.628   56.318   23.134   50.322   11.619   49.445   11.552 0.8767624 16.38454 
1 1 1    1   13   38 o   60.355   6.8827   81.722   16.723   75.979   23.724   87.394   23.575   57.626   10.363   63.084   9.0608 -5.458210 13.76533 
1 1 1    1   13   39 o   65.832   7.3485   98.435   19.325  114.824   27.879   83.278   26.811   71.981   9.3906   59.683   11.306 12.29808 14.69695 
1 1 1    1   13   40 o   28.431   8.3359   8.3976   16.210   15.272   23.069   1.6929   22.781   30.618   12.184   26.244   11.379 4.373674 16.67178 
1 1 1    1   13   41 o   56.727   7.7702   76.077   17.729   89.640   25.107   62.587   25.039   62.953   9.6698   50.501   12.166 12.45129 15.54048 
1 1 1    1   13   42 o   31.703   9.4130   14.581   20.809   13.878   29.042   15.322   29.830   31.394   13.204   32.013   13.419 -0.6188202 18.82603 
1 1 1    1   13   43 o   39.003   9.0051   38.831   16.705   42.132   23.593   35.513   23.656   40.472   12.697   37.534   12.773 2.937443 18.01011 
1 1 1    1   13   44 o   40.063   9.0108   42.727   16.953   49.515   23.799   35.736   24.154   43.150   12.592   36.977   12.893 6.173187 18.02167 
1 1 1    1   13   45 o   27.116   8.7934 -12.0036   23.620   20.479   33.626 -43.6394   33.185   32.313   13.918   21.919   10.751 10.39330 17.58689 
1 1 1    1   13   46 o   24.979   8.0451  -1.2870   18.195  -0.7027   24.601  -1.9925   27.033   24.667   11.185   25.291   11.567 -0.6241074 16.09019 
1 1 1    1   13   47 o   28.061   8.7368  -0.1738   21.987 -37.9063   31.205   37.030   30.986   21.161   10.389   34.962   14.050 -13.80087 17.47356 
1 1 1    1   13   48 o   27.863   8.9465   10.150   22.347   11.485   32.088   8.8919   31.140   28.206   12.784   27.520   12.519 0.6857758 17.89293 
1 1 1    1   13   49 o   28.822   9.6903   8.5764   27.831  -3.6001   32.833   39.656   52.456   24.952   11.840   32.692   15.344 -7.739195 19.38056 
1 1 1    1   14    0 o  208.139   2.1214  894.058   25.743  894.058   25.743  894.058   25.743  208.139   3.0001  208.139   3.0001 0.000000 0.000000 
1 1 1    1   14    1 f  256.900   2.3175  1361.35   24.555  1368.67   34.915  1354.19   34.540  257.583   3.2865  256.217   3.2685 1.365601 4.635090 
1 1 1    1   14    2 o  200.191   2.4310  824.541   20.038  863.149   29.411  791.096   27.374  204.552   3.4861  195.830   3.3892 8.721893 4.862036 
1 1 1    1   14    3 o  643.128   5.8652  8528.05  151.596  8468.98  193.407  8622.16  244.120  640.377   7.3227  645.879   9.1640 -5.502502 11.73034 
1 1 1    1   14    4 o  188.771   3.7223  730.457   27.370  750.404   47.552  720.575   33.470  190.663   6.0469  186.880   4.3424 3.783493 7.444545 
1 1 1    1   14    5 o  572.116   5.7985  6762.44  136.823  6776.40  194.111  6748.65  192.888  572.701   8.2178  571.531   8.1828 1.169617 11.59698 
1 1 1    1   14    6 o  235.011   2.8579  1105.65   24.932  1064.49   29.174  1217.11   48.011  227.165   3.1138  242.857   4.7932 -15.69211 5.715773 
1 1 1    1   14    7 o  128.256   3.0141  337.711   15.713  329.741   20.438  349.235   24.574  126.420   3.9196  130.092   4.5800 -3.672195 6.028285 
1 1 1    1   14    8 o  188.849   2.8851  738.916   21.893  749.796   28.077  722.041   34.969  190.641   3.5709  187.056   4.5326 3.584656 5.770200 
1 1 1    1   14    9 o  189.427   2.3436  742.969   18.165  763.973   24.403  716.871   27.202  192.445   3.0745  186.409   3.5381 6.035858 4.687294 
1 1 1    1   14   10 o  107.858   2.4493  240.210   10.799  241.596   14.371  238.412   16.368  108.219   3.2197  107.497   3.6919 0.7213669 4.898601 
1 1 1    1   14   11 o  358.432   2.8924  2650.72   42.755  2630.78   59.949  2671.37   60.995  357.061   4.0707  359.804   4.1102 -2.742401 5.784848 
1 1 1    1   14   12 o  265.847   2.4782  1458.13   27.172  1447.59   38.251  1468.86   38.606  264.877   3.5013  266.816   3.5081 -1.938965 4.956435 
1 1 1    1   14   13 o  307.345   3.7499  1950.52   47.534  1943.52   67.075  1957.59   67.372  306.790   5.3010  307.899   5.3053 -1.108551 7.499734 
1 1 1    1   14   14 o  108.661   2.6838  243.743   12.021  241.197   17.237  246.153   16.773  108.107   3.8659  109.216   3.7236 -1.108078 5.367543 
1 1 1    1   14   15 o  184.242   2.4155  700.503   18.354  696.031   25.994  704.950   25.920  183.655   3.4317  184.829   3.4002 -1.174164 4.830900 
1 1 1    1   14   16 o  132.358   2.6532  361.685   14.480  352.798   20.528  370.486   20.428  130.738   3.8069  133.978   3.6968 -3.240601 5.306500 
1 1 1    1   14   17 o  282.603   3.8840  1647.94   45.220  1697.64   65.857  1603.60   62.202  286.620   5.5709  278.585   5.4136 8.035034 7.767990 
1 1 1    1   14   18 o  251.702   2.6156  1307.74   27.152  1292.56   38.194  1323.24   38.607  250.225   3.7009  253.178   3.6972 -2.952072 5.231235 
1 1 1    1   14   19 o  243.881   2.6203  1226.99   26.341  1255.25   38.075  1201.05   36.480  246.570   3.7439  241.193   3.6671 5.377075 5.240696 
1 1 1    1   14   20 o   57.676   5.5360   70.698   12.412   93.438   17.939   49.811   17.192   67.166   6.4755   48.187   8.9809 18.97953 11.07195 
1 1 1    1   14   21 o  139.459   3.1432  403.392   17.855  392.348   27.294  411.654   23.608  137.759   4.8038  141.159   4.0550 -3.399689 6.286400 
1 1 1    1   14   22 o  121.381   3.6046  304.618   18.032  320.922   25.739  288.902   25.271  124.575   5.0095  118.186   5.1843 6.389473 7.209163 
1 1 1    1   14   23 o  113.282   4.7849  260.087   21.906  237.946   27.853  295.992   35.468  107.149   6.3025  119.415   7.2013 -12.26605 9.569739 
1 1 1    1   14   24 o  181.475   3.6664  681.675   27.436  664.651   38.800  698.699   38.800  179.201   5.2496  183.750   5.1197 -4.548981 7.332736 
1 1 1    1   14   25 o  196.311   2.9776  797.755   24.012  785.638   35.440  808.037   32.648  194.907   4.4086  197.715   4.0036 -2.807922 5.955231 
1 1 1    1   14   26 o   66.268   9.6024   98.103   25.800   60.620   37.040  133.430   35.959   52.821   15.786   79.715   10.937 -26.89323 19.20478 
1 1 1    1   14   27 o  148.525   3.1458  455.585   19.239  494.176   27.793  420.083   26.658  154.563   4.3598  142.488   4.5361 12.07536 6.291534 
1 1 1    1   14   28 o  190.680   2.9411  751.966   23.130  757.282   32.823  746.721   32.599  191.350   4.1589  190.011   4.1597 1.339096 5.882130 
1 1 1    1   14   29 o  101.459   4.1789  213.660   17.447  233.086   24.943  195.049   24.414  105.997   5.7054   96.921   6.1073 9.075584 8.357701 
1 1 1    1   14   30 o  142.100   3.3986  418.485   19.910  413.864   28.476  422.905   27.850  141.321   4.8854  142.878   4.7259 -1.557495 6.797213 
1 1 1    1   14   31 o  123.565   4.1226  316.818   20.971  345.419   30.338  290.648   29.020  128.916   5.7058  118.214   5.9520 10.70215 8.245173 
1 1 1    1   14   32 o   94.556   5.0722  186.899   19.771  194.093   28.490  180.215   27.460   96.310   7.1722   92.803   7.1742 3.507477 10.14443 
1 1 1    1   14   33 o  103.420   4.2934  223.253   18.310  218.270   25.914  228.221   25.874  102.252   6.1446  104.587   5.9981 -2.334953 8.586809 
1 1 1    1   14   34 o   95.088   5.5908  190.809   21.875  210.028   31.878  173.705   30.072   99.645   7.7565   90.531   8.0539 9.114029 11.18161 
1 1 1    1   14   35 o   34.876   9.7276   18.786   20.728   23.464   28.685   13.675   29.985   36.194   13.815   33.558   13.699 2.636047 19.45521 
1 1 1    1   14   36 o   86.716   5.0097  159.728   17.904  160.254   24.879  159.163   25.786   86.915   6.9403   86.517   7.2263 0.3976974 10.01935 
1 1 1    1   14   37 o   72.356   5.6920  113.078   16.934  121.907   23.820  104.057   24.079   75.364   7.6633   69.348   8.4185 6.016281 11.38410 
1 1 1    1   14   38 o   93.209   4.8105  186.441   18.346  158.631   25.707  215.301   26.189   85.871   7.2585  100.547   6.3150 -14.67653 9.621066 
1 1 1    1   14   39 o   28.749   8.4484   9.1908   16.516   8.5187   23.329   9.8661   23.386   28.526   11.905   28.971   11.991 -0.4455376 16.89689 
1 1 1    1   14   40 o   38.869   9.3340   35.698   18.760   20.305   27.483   49.127   25.670   33.334   13.288   44.405   13.112 -11.07147 18.66804 
1 1 1    1   14   41 o   31.054   9.2693   11.316   20.508   18.363   29.113   4.3760   28.893   32.951   13.480   29.158   12.727 3.793114 18.53855 
1 1 1    1   14   42 o   40.459   10.204   42.016   21.515   38.421   30.023   45.810   30.848   39.123   14.291   41.795   14.571 -2.672516 20.40891 
1 1 1    1   14   43 o   27.605   8.3482   7.7540   16.860   15.126   25.320   1.8816   22.598   29.961   12.445   25.249   11.131 4.711723 16.69630 
1 1 1    1   14   44 o   24.886   7.7580   1.3279   15.820  -7.6964   22.945   9.5057   21.842   22.924   10.547   26.848   11.380 -3.923912 15.51606 
1 1 1    1   14   45 o   26.517   8.1688   8.1155   16.761   8.5313   23.896   7.7127   23.516   26.687   11.613   26.347   11.492 0.3399506 16.33761 
1 1 1    1   14   46 o   27.796   8.4002   12.347   17.137   19.161   25.016   6.3221   23.525   29.789   12.371   25.803   11.367 3.986616 16.80039 
1 1 1    1   14   47 o   28.503   9.0675   0.5412   25.686 -55.8361   40.841   37.434   33.038   22.519   11.203   34.488   14.261 -11.96928 18.13509 
1 1 1    1   14   48 o   27.382   8.7704   10.289   21.597   0.1306   31.215   19.617   29.913   25.604   11.959   29.159   12.833 -3.555422 17.54086 
1 1 1    1   14   49 o   32.305   10.850   39.599   39.699   57.099   54.333   19.557   58.146   34.321   15.945   30.290   14.719 4.031446 21.70016 
1 1 1    1   15    0 o  102.513   2.7590  217.710   16.443  217.710   16.443  217.710   16.443  102.513   3.9018  102.513   3.9018 0.000000 0.000000 
1 1 1    1   15    1 o  217.448   2.0340  977.706   18.194  1020.15   25.207  931.546   26.288  222.389   2.7481  212.508   2.9993 9.881271 4.067944 
1 1 1    1   15    2 o  119.897   2.0427  296.499   9.9664  296.351   13.068  296.705   15.408  119.864   2.6434  119.931   3.1150 -0.6664276E-01 4.085413 
1 1 1    1   15    3 o   77.168   2.7480  122.920   8.7314  121.800   12.691  123.927   12.031   76.833   4.0049   77.503   3.7638 -0.6702652 5.495948 
1 1 1    1   15    4 o   78.228   3.5575  126.055   11.444  113.013   15.832  140.329   16.563   73.997   5.1874   82.460   4.8699 -8.463425 7.115085 
1 1 1    1   15    5 o  337.496   3.9203  2350.92   54.563  2332.82   76.464  2369.70   77.884  336.174   5.5148  338.818   5.5733 -2.643280 7.840576 
1 1 1    1   15    6 o  406.071   4.4449  3404.66   74.443  3414.27  105.692  3395.20  104.869  406.638   6.3019  405.504   6.2703 1.134674 8.889861 
1 1 1    1   15    7 f  212.216   3.7001  944.792   27.689  959.416   31.904  900.161   55.737  215.648   3.5870  208.784   6.4726 6.863846 7.400104 
1 1 1    1   15    8 o  344.185   2.7920  2444.29   39.634  2447.86   56.060  2440.72   56.043  344.436   3.9462  343.933   3.9508 0.5030823 5.584011 
1 1 1    1   15    9 o  437.416   3.5695  3950.76   63.778  3958.95   84.584  3939.97   97.097  437.970   4.6825  436.861   5.3888 1.109070 7.139018 
1 1 1    1   15   10 o  219.574   2.3566  993.562   20.522  990.519   25.689  998.929   34.117  219.124   2.8424  220.025   3.7595 -0.9006195 4.713121 
1 1 1    1   15   11 o  202.411   2.3217  842.634   18.546  836.169   23.045  854.519   31.245  201.327   2.7752  203.495   3.7227 -2.168365 4.643361 
1 1 1    1   15   12 o  208.049   2.3057  892.993   19.784  881.464   27.825  904.781   28.135  206.691   3.2640  209.407   3.2576 -2.716171 4.611478 
1 1 1    1   15   13 o  198.306   2.6206  810.914   21.420  793.923   29.672  829.405   30.954  196.140   3.6679  200.472   3.7437 -4.331970 5.241101 
1 1 1    1   15   14 o  167.895   2.5872  579.745   17.646  593.336   27.590  570.336   22.956  169.543   3.9455  166.247   3.3479 3.296951 5.174471 
1 1 1    1   15   15 o  117.771   2.6749  286.353   12.983  284.514   18.699  288.066   18.041  117.403   3.8616  118.138   3.7026 -0.7350845 5.349883 
1 1 1    1   15   16 o   74.093   3.9245  114.766   11.731  106.626   18.254  120.492   15.311   71.811   6.1631   76.376   4.8604 -4.564758 7.849007 
1 1 1    1   15   17 o  202.412   3.6881  846.716   30.789  841.270   43.506  852.181   43.580  201.759   5.2281  203.065   5.2033 -1.306274 7.376193 
1 1 1    1   15   18 o  184.815   2.5470  704.854   19.407  716.646   27.911  693.815   27.004  186.309   3.6322  183.321   3.5714 2.988235 5.093930 
1 1 1    1   15   19 o   73.814   4.1377  112.922   12.579  108.673   18.042  116.940   17.547   72.452   6.0378   75.175   5.6594 -2.722870 8.275462 
1 1 1    1   15   20 o  185.326   2.6140  709.300   19.979  713.693   28.422  705.009   28.091  185.892   3.7070  184.760   3.6863 1.132797 5.227932 
1 1 1    1   15   21 o  188.494   2.8093  732.637   21.686  722.945   28.908  745.111   32.796  187.089   3.7464  189.899   4.1872 -2.809982 5.618547 
1 1 1    1   15   22 o  151.461   3.1040  474.108   19.387  480.310   27.740  468.188   27.105  152.427   4.4125  150.495   4.3667 1.931900 6.207937 
1 1 1    1   15   23 o  107.101   3.7374  237.855   16.478  227.551   23.696  247.503   22.930  104.837   5.4801  109.366   5.0833 -4.529747 7.474761 
1 1 1    1   15   24 o   57.927   5.5865   69.457   13.251   82.044   19.463   58.580   18.092   62.819   7.5118   53.036   8.2710 9.783283 11.17303 
1 1 1    1   15   25 o  130.399   3.2001  351.404   17.201  367.540   24.738  336.298   23.934  133.297   4.4997  127.501   4.5514 5.795609 6.400149 
1 1 1    1   15   26 o  151.502   3.4048  473.522   21.101  463.221   27.968  487.135   32.151  149.627   4.5320  153.376   5.0824 -3.748703 6.809522 
1 1 1    1   15   27 o   44.889   8.8072   44.779   16.811   49.829   21.301   36.438   27.374   47.749   11.037   42.028   13.728 5.720791 17.61439 
1 1 1    1   15   28 o  184.893   3.5128  708.140   26.785  694.944   37.783  721.474   37.979  183.156   5.0016  186.630   4.9339 -3.474731 7.025603 
1 1 1    1   15   29 o  117.349   4.2258  287.931   20.154  298.732   26.635  273.463   30.827  120.018   5.3808  114.679   6.5176 5.338783 8.451693 
1 1 1    1   15   30 o   78.773   5.7725  130.756   18.557  109.052   26.199  152.608   26.288   72.072   8.8137   85.474   7.4570 -13.40204 11.54508 
1 1 1    1   15   31 o   31.998   8.4362   10.753   16.986 -13.9676   24.601   33.274   23.481   24.406   11.112   39.591   12.696 -15.18440 16.87239 
1 1 1    1   15   32 o  114.939   4.5130  275.612   21.385  282.933   30.788  268.787   29.727  116.407   6.4126  113.472   6.3519 2.934227 9.025965 
1 1 1    1   15   33 o   98.482   4.5601  203.861   18.466  187.158   26.242  220.244   25.990   94.401   6.7400  102.563   6.1440 -8.161453 9.120102 
1 1 1    1   15   34 o   41.095   9.3756   37.159   17.998   33.715   24.034   41.558   27.158   39.241   12.865   42.950   13.642 -3.709972 18.75114 
1 1 1    1   15   35 o   34.657   9.2070   10.733   20.907 -23.0800   29.244   46.081   29.901   24.744   11.563   44.569   14.331 -19.82438 18.41393 
1 1 1    1   15   36 o   36.545   8.9893   28.582   16.594   29.142   23.042   27.978   23.917   36.708   12.604   36.382   12.820 0.3257523 17.97854 
1 1 1    1   15   37 o   44.911   8.3538   47.808   16.421   66.398   23.338   29.579   23.110   53.449   10.955   36.372   12.615 17.07692 16.70761 
1 1 1    1   15   38 o   28.684   8.5482   6.5895   17.571  -2.4452   25.746   14.467   24.040   26.642   11.806   30.725   12.366 -4.082605 17.09648 
1 1 1    1   15   39 o   52.410   7.9451   64.355   17.138   44.340   23.799   85.913   24.699   42.779   12.622   62.041   9.6525 -19.26142 15.89020 
1 1 1    1   15   40 o   65.053   9.5960  106.345   25.313  120.931   34.947   90.246   36.714   71.565   11.840   58.542   15.105 13.02230 19.19192 
1 1 1    1   15   41 o   48.991   9.4662   63.676   20.344   77.497   27.162   46.014   30.704   55.946   12.121   42.037   14.543 13.90973 18.93236 
1 1 1    1   15   42 o   61.441   6.7388   87.063   17.074   85.220   23.893   88.987   24.408   60.775   9.5319   62.107   9.5284 -1.331322 13.47765 
1 1 1    1   15   43 o   28.556   8.4948   11.198   17.572   20.744   22.992  -2.2075   27.247   31.052   12.225   26.060   11.798 4.991680 16.98966 
1 1 1    1   15   44 o   59.106   6.7463   84.308   15.977   75.827   22.704   92.626   22.486   55.194   10.354   63.017   8.6513 -7.822971 13.49255 
1 1 1    1   15   45 o   25.937   7.9898   6.0903   16.228   14.781   23.386  -1.9817   22.538   28.316   11.876   23.558   10.691 4.757990 15.97965 
1 1 1    1   15   46 o   26.758   8.2092   10.847   16.799   12.431   23.584   9.2162   23.933   27.145   11.674   26.371   11.545 0.7737408 16.41838 
1 1 1    1   15   47 o   29.429   9.5118   7.1876   27.320 -25.8552   39.659   37.028   37.688   24.779   12.067   34.080   14.707 -9.300585 19.02369 
1 1 1    1   15   48 o   25.236   8.3003  -6.4734   21.458   26.528   32.108 -33.1088   28.846   30.381   13.334   20.091   9.8880 10.28979 16.60053 
1 1 1    1   15   49 o   27.019   9.4638 -28.5977   39.795   29.996   55.304 -91.5137   57.307   30.985   14.882   23.052   11.695 7.932875 18.92760 
1 1 1    1   16    0 o  612.939   4.3212  7754.65  154.457  7754.65  154.457  7754.65  154.457  612.939   6.1111  612.939   6.1111 0.000000 0.000000 
1 1 1    1   16    1 o  136.145   2.2073  382.114   12.390  395.992   17.767  368.974   17.288  138.550   3.1091  133.740   3.1341 4.810440 4.414670 
1 1 1    1   16    2 o  503.049   4.2269  5217.93   87.567  5341.83  127.997  5108.92  120.060  508.642   6.1013  497.455   5.8517 11.18787 8.453859 
1 1 1    1   16    3 o  512.947   5.2875  5429.64  111.698  5323.86  153.248  5549.52  163.147  507.644   7.3193  518.251   7.6326 -10.60690 10.57492 
1 1 1    1   16    4 f  278.049   3.5070  1595.28   40.211  1615.36   57.543  1576.12   56.214  279.757   4.9871  276.341   4.9321 3.415558 7.014037 
1 1 1    1   16    5 o  554.585   5.6544  6353.52  129.243  6451.86  186.894  6263.40  178.922  558.677   8.1109  550.493   7.8804 8.183777 11.30871 
1 1 1    1   16    6 o  202.257   3.2056  844.102   26.738  832.845   37.473  855.778   38.163  200.884   4.5228  203.630   4.5440 -2.746277 6.411179 
1 1 1    1   16    7 o  252.454   4.9301  1315.91   51.303  1344.59   74.125  1289.53   71.077  255.087   7.0455  249.821   6.8982 5.266800 9.860227 
1 1 1    1   16    8 o  219.622   2.9934  1000.60   26.506  1020.74   34.252  970.529   41.850  222.411   3.7340  216.833   4.6796 5.577576 5.986722 
1 1 1    1   16    9 o  132.673   2.2771  365.448   12.303  379.004   16.336  347.683   18.701  135.540   2.9222  129.807   3.4930 5.732452 4.554145 
1 1 1    1   16   10 o  186.174   2.3852  718.106   18.101  735.555   24.002  695.096   27.563  188.815   3.0820  183.532   3.6412 5.283356 4.770433 
1 1 1    1   16   11 o  448.382   3.5012  4144.65   62.359  4126.30   78.198  4176.70  103.348  447.099   4.2406  449.665   5.5725 -2.565918 7.002481 
1 1 1    1   16   12 o  208.151   2.3932  895.443   19.732  898.961   24.704  889.243   32.795  208.736   2.8695  207.566   3.8308 1.170547 4.786342 
1 1 1    1   16   13 o   89.614   3.2268  165.157   11.786  161.613   15.449  170.094   18.231   88.476   4.2336   90.752   4.8708 -2.275490 6.453525 
1 1 1    1   16   14 o  229.558   2.8419  1087.34   26.896  1105.89   38.722  1070.04   37.385  231.447   4.0564  227.669   3.9813 3.777588 5.683791 
1 1 1    1   16   15 o  325.723   2.8100  2190.09   37.745  2167.77   52.847  2213.34   53.927  324.031   3.9543  327.415   3.9934 -3.384186 5.619936 
1 1 1    1   16   16 o  290.261   3.0755  1739.64   36.804  1756.99   52.907  1723.36   51.232  291.659   4.3982  288.864   4.3001 2.794983 6.151015 
1 1 1    1   16   17 o  206.493   2.4979  880.366   21.274  877.620   30.169  883.081   30.003  206.172   3.5478  206.814   3.5174 -0.6424866 4.995894 
1 1 1    1   16   18 o   48.009   7.4921   50.192   14.520   39.084   20.469   61.443   20.601   42.510   11.428   53.508   9.6916 -10.99799 14.98416 
1 1 1    1   16   19 o  227.505   2.5665  1068.66   24.077  1080.42   34.479  1057.47   33.637  228.724   3.6550  226.286   3.6040 2.437775 5.133020 
1 1 1    1   16   20 o  164.341   2.6371  557.939   17.871  547.734   25.355  568.014   25.194  162.844   3.7750  165.838   3.6833 -2.993713 5.274251 
1 1 1    1   16   21 o   74.510   4.0407  114.926   12.414  116.520   17.814  113.421   17.309   75.010   5.7581   74.010   5.6703 0.9997864 8.081317 
1 1 1    1   16   22 o  202.725   3.2161  848.218   26.519  840.201   34.660  859.537   41.185  201.616   4.1681  203.834   4.8989 -2.217789 6.432132 
1 1 1    1   16   23 o   78.769   4.1487  128.577   13.475  129.165   19.288  128.017   18.833   78.941   5.9242   78.597   5.8096 0.3439941 8.297425 
1 1 1    1   16   24 f  155.376   3.0685  495.118   19.444  526.121   30.189  473.139   25.418  159.472   4.5898  151.280   4.0737 8.191635 6.136916 
1 1 1    1   16   25 o   23.732   7.4233  -8.7672   14.869 -22.4848   22.149   2.4849   20.060   21.268   9.9783   26.195   10.993 -4.926645 14.84668 
1 1 1    1   16   26 o  178.390   2.8845  658.036   21.222  662.031   30.156  654.117   29.871  178.925   4.0864  177.855   4.0721 1.070801 5.768927 
1 1 1    1   16   27 o  163.685   3.7426  554.746   25.253  577.743   36.373  533.344   35.089  166.959   5.2821  160.412   5.3036 6.546799 7.485216 
1 1 1    1   16   28 o  119.350   3.6449  295.165   17.938  304.881   25.577  285.760   25.163  121.287   5.1129  117.413   5.1962 3.874641 7.289892 
1 1 1    1   16   29 o   99.092   4.3229  204.483   17.400  253.203   25.248  160.406   24.015  110.425   5.5436   87.760   6.6346 22.66478 8.645724 
1 1 1    1   16   30 o   88.505   5.1623  164.732   18.716  144.811   26.719  183.922   26.225   83.137   7.7922   93.874   6.7733 -10.73707 10.32454 
1 1 1    1   16   31 o   41.238   8.4505   36.785   15.925   21.769   22.616   51.550   22.427   34.326   12.424   48.151   11.459 -13.82489 16.90108 
1 1 1    1   16   32 o  108.904   4.3548  246.375   19.490  221.610   26.406  276.014   28.887  102.918   6.2207  114.891   6.0960 -11.97308 8.709685 
1 1 1    1   16   33 o   50.147   9.3825   57.727   19.713   63.602   28.733   52.502   27.097   52.503   13.264   47.790   13.274 4.713276 18.76494 
1 1 1    1   16   34 o   88.290   5.5477  163.141   19.896  183.966   31.599  149.462   25.611   92.711   8.2638   83.868   7.4039 8.843163 11.09540 
1 1 1    1   16   35 o   93.728   6.0041  190.340   22.990  174.048   33.911  204.196   31.273   89.670   9.1691   97.787   7.7540 -8.117111 12.00826 
1 1 1    1   16   36 o   75.197   6.6966  120.320   20.241  106.837   25.413  143.711   33.473   69.954   8.8082   80.440   10.089 -10.48618 13.39320 
1 1 1    1   16   37 o   30.865   9.6203   1.1056   23.779   1.8838   32.034   0.1506   35.489   30.398   13.331   31.332   13.874 -0.9344082 19.24056 
1 1 1    1   16   38 o   33.809   9.3300   19.311   19.595   4.5893   28.316   32.838   27.143   29.513   12.742   38.104   13.633 -8.591375 18.66007 
1 1 1    1   16   39 o   26.408   7.9566  -1.2101   16.272   18.927   23.674 -19.2446   22.404   31.750   12.434   21.067   9.9310 10.68342 15.91320 
1 1 1    1   16   40 o   43.060   10.281   47.767   21.652   45.518   29.911   50.243   31.384   42.195   14.363   43.925   14.713 -1.729778 20.56112 
1 1 1    1   16   41 o   45.556   8.6549   52.523   16.756   44.721   23.832   60.149   23.563   41.898   12.695   49.215   11.768 -7.316311 17.30981 
1 1 1    1   16   42 f   36.379   8.0094   29.602   15.897   1.6709   22.459   57.645   22.504   25.109   11.082   47.650   11.567 -22.54062 16.01881 
1 1 1    1   16   43 o   28.105   8.5670   6.8439   18.746  -8.3412   26.736   21.530   26.293   24.468   11.303   31.743   12.877 -7.275549 17.13401 
1 1 1    1   16   44 o   35.232   8.9970   34.107   16.787   31.812   23.788   36.385   23.693   34.308   12.689   36.157   12.758 -1.849300 17.99409 
1 1 1    1   16   45 o   31.802   8.6074   23.026   17.119   41.963   24.263   4.2543   24.157   38.112   12.936   25.492   11.358 12.61947 17.21481 
1 1 1    1   16   46 o   26.182   8.4312   0.1494   21.083 -23.1445   31.111   19.931   28.670   22.641   10.946   29.722   12.827 -7.081320 16.86235 
1 1 1    1   16   47 o   25.777   8.7083  -7.8630   25.974  -9.3187   38.153  -6.6055   35.461   25.909   12.422   25.644   12.207 0.2649097 17.41651 
1 1 1    1   16   48 o   26.911   8.7086   10.605   21.847   23.516   31.754  -1.0005   30.105   29.309   13.043   24.513   11.542 4.796059 17.41716 
1 1 1    1   17    0 o  510.996   3.7035  5389.55  110.358  5389.55  110.358  5389.55  110.358  510.996   5.2375  510.996   5.2375 0.000000 0.000000 
1 1 1    1   17    1 o  250.990   2.3591  1302.49   23.682  1311.21   30.078  1288.29   38.414  252.111   2.8926  249.869   3.7274 2.241943 4.718125 
1 1 1    1   17    2 o  297.327   2.7150  1824.46   32.946  1825.92   43.566  1822.50   50.354  297.480   3.5508  297.174   4.1083 0.3058472 5.430072 
1 1 1    1   17    3 o  214.117   3.7719  951.544   31.197  960.867   38.063  932.462   54.453  215.770   4.2770  212.464   6.2141 3.306763 7.543717 
1 1 1    1   17    4 o  335.199   3.8996  2320.16   53.911  2329.67   76.634  2310.84   75.855  335.878   5.5319  334.521   5.4979 1.357117 7.799270 
1 1 1    1   17    5 o  528.848   5.4412  5778.53  118.564  5888.37  172.229  5679.58  163.464  533.596   7.8258  524.100   7.5621 9.496216 10.88248 
1 1 1    1   17    6 o  372.100   5.2397  2824.41   73.868  2959.92  135.811  2767.48   88.028  378.167   8.7073  366.034   5.8309 12.13361 10.47937 
1 1 1    1   17    7 o  418.184   5.5531  3639.85   91.542  3695.67  114.272  3539.86  152.940  422.880   6.5517  413.487   8.9679 9.393188 11.10627 
1 1 1    1   17    8 o  147.921   3.3582  451.591   20.483  458.604   29.381  444.960   28.569  149.037   4.7798  146.805   4.7184 2.231522 6.716362 
1 1 1    1   17    9 o  292.792   3.7446  1768.06   45.168  1822.34   65.801  1719.70   62.112  297.028   5.3712  288.555   5.2189 8.472290 7.489111 
1 1 1    1   17   10 o  307.526   2.8471  1952.81   35.705  1956.37   47.117  1948.01   54.720  307.878   3.7105  307.174   4.3191 0.7039185 5.694114 
1 1 1    1   17   11 o  351.349   2.9556  2553.37   41.475  2568.17   52.553  2528.94   67.535  352.750   3.6121  349.949   4.6791 2.800751 5.911111 
1 1 1    1   17   12 o  182.025   2.8091  683.838   20.526  683.318   26.173  684.670   33.081  181.957   3.4875  182.094   4.4047 -0.1364136 5.618203 
1 1 1    1   17   13 o  330.502   2.8760  2259.29   37.956  2271.36   48.074  2239.32   61.849  331.726   3.5137  329.278   4.5541 2.448334 5.752031 
1 1 1    1   17   14 o  133.310   2.6115  366.704   14.209  365.608   18.771  368.174   21.742  133.088   3.4197  133.533   3.9478 -0.4454956 5.222969 
1 1 1    1   17   15 o   41.559   5.5634   34.081   9.1568   57.094   14.829   19.897   11.641   52.510   6.8470   30.608   8.7708 21.90227 11.12686 
1 1 1    1   17   16 o  207.339   2.7962  887.122   23.894  909.009   34.601  867.171   33.035  209.777   3.9992  204.900   3.9091 4.876907 5.592326 
1 1 1    1   17   17 o  105.539   2.8553  230.888   12.383  210.851   17.673  250.209   17.355  101.016   4.2419  110.061   3.8231 -9.045174 5.710534 
1 1 1    1   17   18 o   95.579   4.0545  189.100   15.947  172.673   22.329  206.202   22.783   91.330   5.9278   99.828   5.5333 -8.498405 8.109026 
1 1 1    1   17   19 o   61.306   4.3758   77.803   11.059   79.148   15.948   76.557   15.348   61.813   6.2555   60.799   6.1205 1.014404 8.751698 
1 1 1    1   17   20 o  232.227   2.5890  1113.95   24.794  1120.95   35.426  1107.24   34.712  232.938   3.6873  231.515   3.6353 1.423264 5.178014 
1 1 1    1   17   21 f  134.681   2.8429  375.023   15.783  360.693   22.333  389.321   22.308  132.104   4.0989  137.258   3.9405 -5.154099 5.685843 
1 1 1    1   17   22 o   92.169   3.5658  175.263   13.524  192.858   19.709  159.607   18.592   96.532   4.9502   87.805   5.1337 8.726982 7.131607 
1 1 1    1   17   23 o   43.691   6.6220   42.353   12.104   20.802   17.384   62.633   16.863   32.502   10.950   54.880   7.4502 -22.37790 13.24409 
1 1 1    1   17   24 o  103.710   3.8510  222.370   16.450  238.954   23.856  207.335   22.715  107.394   5.3858  100.026   5.5059 7.367798 7.702071 
1 1 1    1   17   25 o  153.736   3.4339  489.833   21.748  474.632   31.201  504.196   30.329  151.396   4.9968  156.076   4.7114 -4.679504 6.867727 
1 1 1    1   17   26 o   92.796   4.0201  178.195   15.368  188.030   22.394  169.439   21.128   95.209   5.7028   90.383   5.6678 4.825867 8.040211 
1 1 1    1   17   27 o   60.168   7.0559   77.070   16.668   77.853   26.675   76.568   21.350   59.820   11.224   60.515   8.5538 -0.6950645 14.11187 
1 1 1    1   17   28 o   77.657   5.0982  126.877   16.031  156.476   22.895   98.404   22.455   86.715   6.4014   68.600   7.9364 18.11431 10.19633 
1 1 1    1   17   29 o   34.604   8.3151   22.490   15.140   7.4267   22.245   35.490   20.665   28.881   11.795   40.328   11.723 -11.44791 16.63022 
1 1 1    1   17   30 o  163.043   3.5589  552.150   23.926  557.292   34.306  547.280   33.385  163.771   5.0789  162.315   4.9869 1.456039 7.117848 
1 1 1    1   17   31 o   96.877   4.3770  196.481   17.413  219.465   24.807  174.157   24.447  102.537   5.8657   91.217   6.4982 11.32032 8.754031 
1 1 1    1   17   32 f   88.039   4.7384  162.511   17.139  183.549   24.918  143.621   23.611   93.491   6.4622   82.588   6.9317 10.90307 9.476725 
1 1 1    1   17   33 o  123.598   5.2172  324.397   26.496  320.490   39.046  327.732   36.073  122.747   7.7126  124.449   7.0279 -1.701691 10.43436 
1 1 1    1   17   34 o   40.508   9.5721   35.982   18.391   32.499   23.400   41.610   29.745   38.276   12.701   42.739   14.324 -4.463303 19.14415 
1 1 1    1   17   35 f   27.882   8.2066  -1.1410   16.806   22.808   25.201 -20.3225   22.553   34.439   12.996   21.325   10.025 13.11357 16.41327 
1 1 1    1   17   36 o   80.863   7.3763  149.846   23.799  163.665   31.125  130.394   36.928   86.437   8.7305   75.289   11.892 11.14803 14.75269 
1 1 1    1   17   37 o   24.101   7.6201  -5.8934   15.729   1.4538   21.815 -13.8477   22.699   25.719   11.144   22.483   10.396 3.236534 15.24015 
1 1 1    1   17   38 o   50.269   8.2446   60.803   16.797   66.723   23.680   54.808   23.830   53.060   11.174   47.477   12.126 5.583370 16.48928 
1 1 1    1   17   39 o   31.642   8.1481   14.871   16.236 -12.0828   23.417   39.826   22.532   22.996   10.608   40.288   12.371 -17.29162 16.29612 
1 1 1    1   17   40 f   33.295   9.2088   19.221   19.606   38.827   27.822  -0.1205   27.633   39.258   13.828   27.333   12.166 11.92553 18.41763 
1 1 1    1   17   41 o   25.697   8.2315 -28.0570   19.275   25.634   32.263 -57.8574   24.036   34.741   14.199   16.652   8.3321 18.08943 16.46290 
1 1 1    1   17   42 o   35.510   9.4217   30.520   19.538   15.309   27.719   45.541   27.545   30.401   12.849   40.620   13.783 -10.21844 18.84340 
1 1 1    1   17   43 o   38.143   11.452   42.841   31.088   40.573   40.672   46.028   48.213   37.507   15.692   38.780   16.685 -1.273357 22.90424 
1 1 1    1   17   44 o   26.766   8.1634   6.5394   17.135  -8.5916   24.229   21.679   24.237   22.875   10.634   30.656   12.389 -7.781347 16.32679 
1 1 1    1   17   45 o   33.988   8.8977   32.239   17.341   18.744   24.859   45.030   24.202   29.161   12.238   38.815   12.919 -9.653343 17.79543 
1 1 1    1   17   46 f   24.460   8.1942  -9.3630   22.093 -13.4103   32.409  -5.8493   30.197   24.226   11.570   24.694   11.606 -0.4681587 16.38844 
1 1 1    1   17   47 o   30.626   8.7737   14.508   20.605   60.298   30.014 -26.3065   28.337   40.593   14.355   20.659   10.091 19.93425 17.54747 
1 1 1    1   17   48 o   20.420   7.1038 -31.2303   21.001 -40.5673   29.715 -21.9128   29.684   19.435   9.6497   21.405   10.428 -1.970695 14.20761 
1 1 1    1   18    0 o  258.964   2.3330  1384.02   35.227  1384.02   35.227  1384.02   35.227  258.964   3.2994  258.964   3.2994 0.000000 0.000000 
1 1 1    1   18    1 o  246.503   2.4543  1256.83   24.789  1281.67   33.389  1226.32   37.001  249.233   3.2482  243.773   3.6802 5.460220 4.908583 
1 1 1    1   18    2 o  219.945   2.7813  1001.25   24.910  1017.01   32.861  979.969   38.194  222.000   3.5889  217.891   4.2501 4.108765 5.562678 
1 1 1    1   18    3 o  361.371   4.0678  2697.67   60.627  2708.88   85.677  2686.43   85.803  362.124   5.7365  360.617   5.7689 1.506897 8.135518 
1 1 1    1   18    4 o  114.485   3.2339  270.664   15.257  285.253   21.668  256.320   21.486  117.548   4.4692  111.422   4.6754 6.126282 6.467862 
1 1 1    1   18    5 o  183.398   3.1811  694.383   24.062  699.021   34.133  689.802   33.927  184.007   4.4975  182.790   4.5001 1.217499 6.362283 
1 1 1    1   18    6 o  289.972   5.2335  1736.96   62.509  1786.81   91.233  1692.85   85.818  293.872   7.5271  286.072   7.2734 7.800385 10.46706 
1 1 1    1   18    7 o  267.203   3.5697  1474.65   39.340  1474.69   55.422  1474.60   55.850  267.209   5.0288  267.197   5.0678 0.1159668E-01 7.139464 
1 1 1    1   18    8 o  340.656   4.0382  2397.99   56.738  2393.24   80.127  2402.76   80.352  340.319   5.7086  340.994   5.7132 -0.6755676 8.076451 
1 1 1    1   18    9 o  315.809   3.9050  2060.36   50.854  2081.37   72.769  2040.30   71.097  317.378   5.5591  314.240   5.4856 3.138580 7.809964 
1 1 1    1   18   10 o  253.925   3.2214  1329.38   32.646  1322.95   41.211  1340.20   53.494  253.147   3.9470  254.702   5.0922 -1.554581 6.442813 
1 1 1    1   18   11 o   97.098   2.1264  193.848   8.4996  209.794   12.442  179.896   11.639  100.829   2.9919   93.367   3.0223 7.461197 4.252752 
1 1 1    1   18   12 o  172.506   2.7411  617.892   19.021  630.743   24.479  598.310   30.216  174.807   3.3952  170.205   4.3043 4.601364 5.482235 
1 1 1    1   18   13 o  146.893   2.4533  445.693   14.593  446.786   18.932  444.093   22.906  147.129   3.1199  146.656   3.7870 0.4733734 4.906604 
1 1 1    1   18   14 o   69.253   2.9361   93.401   7.8692   83.902   9.4087  115.515   14.356   63.744   3.5787   74.762   4.6556 -11.01764 5.872148 
1 1 1    1   18   15 o   85.614   3.4442  150.025   12.101  170.025   18.187  134.139   16.209   90.683   4.8625   80.546   4.8792 10.13721 6.888477 
1 1 1    1   18   16 o  115.021   2.7825  273.445   13.178  276.138   18.168  270.457   19.143  115.625   3.8097  114.417   4.0565 1.207741 5.564989 
1 1 1    1   18   17 o   67.317   3.6450   93.498   10.105  100.873   14.669   86.838   13.940   69.839   5.0927   64.794   5.2163 5.045181 7.290098 
1 1 1    1   18   18 o  168.267   2.4828  584.879   17.226  580.078   24.611  589.490   24.118  167.587   3.5606  168.948   3.4612 -1.361237 4.965632 
1 1 1    1   18   19 o  171.104   2.8465  605.363   19.737  606.801   25.649  603.275   30.906  171.387   3.6286  170.820   4.3867 0.5671234 5.692900 
1 1 1    1   18   20 o  370.119   3.0738  2831.01   46.901  2871.20   67.530  2793.56   65.189  372.645   4.3937  367.593   4.2998 5.052490 6.147601 
1 1 1    1   18   21 o  145.116   3.0372  435.207   18.172  445.394   26.125  425.658   25.293  146.758   4.3161  143.473   4.2743 3.284576 6.074411 
1 1 1    1   18   22 o  137.176   2.8550  388.897   16.148  393.687   23.179  384.379   22.508  137.993   4.0727  136.358   4.0021 1.635193 5.709929 
1 1 1    1   18   23 o   77.001   4.1381  122.992   13.127  121.952   18.975  123.947   18.181   76.677   5.9998   77.324   5.7008 -0.6465302 8.276287 
1 1 1    1   18   24 o  102.258   3.7726  216.347   15.896  209.665   21.910  223.775   23.099  100.599   5.2806  103.919   5.3893 -3.320038 7.545118 
1 1 1    1   18   25 o  159.458   2.9552  526.093   19.421  500.293   27.340  552.372   27.593  155.501   4.2629  163.415   4.0940 -7.914001 5.910390 
1 1 1    1   18   26 o  124.320   3.3795  320.267   17.316  315.394   24.861  324.859   24.132  123.389   4.8851  125.251   4.6713 -1.861893 6.759084 
1 1 1    1   18   27 o   43.919   7.9269   41.947   14.552   52.459   21.279   32.711   19.946   48.891   10.837   38.946   11.572 9.945251 15.85383 
1 1 1    1   18   28 o  102.678   5.0919  220.475   21.543  226.609   30.108  214.040   30.838  104.179   7.0072  101.178   7.3897 3.000076 10.18375 
1 1 1    1   18   29 o  126.079   3.5920  329.707   18.654  354.289   26.950  307.095   25.847  130.597   5.0033  121.561   5.1553 9.036194 7.184065 
1 1 1    1   18   30 o   31.244   8.1251   11.486   15.294   32.407   22.192  -7.4354   21.105   38.797   12.332   23.692   10.582 15.10507 16.25020 
1 1 1    1   18   31 o  112.475   4.4943  260.391   20.352  243.689   25.761  288.122   33.196  107.932   5.7869  117.018   6.8780 -9.086296 8.988618 
1 1 1    1   18   32 o   42.126   8.9123   30.601   18.010   72.078   30.319   7.9835   22.389   55.626   13.379   28.626   11.778 27.00035 17.82465 
1 1 1    1   18   33 o   34.555   8.9035   23.484   16.531   28.007   23.728   19.217   23.043   36.406   12.774   32.705   12.406 3.700920 17.80700 
1 1 1    1   18   34 o   31.275   8.4663   17.002   15.279   15.077   21.509   18.963   21.707   30.487   11.876   32.064   12.070 -1.577068 16.93261 
1 1 1    1   18   35 o   61.948   6.5729   85.597   16.123  105.092   23.344   67.815   22.295   69.549   8.1380   54.347   10.324 15.20282 13.14577 
1 1 1    1   18   36 o   58.093   9.1113   81.543   21.248   77.158   29.336   86.382   30.817   56.406   12.891   59.780   12.879 -3.373951 18.22251 
1 1 1    1   18   37 f   29.350   8.6352   9.9123   17.280   10.760   24.666   9.0950   24.216   29.694   12.304   29.006   12.119 0.6874409 17.27036 
1 1 1    1   18   38 o   60.221   7.0645   84.411   16.706   63.453   23.575  105.550   23.676   51.324   11.430   69.117   8.3055 -17.79291 14.12900 
1 1 1    1   18   39 o   26.704   7.9469   2.6843   15.899   20.111   22.640 -14.2732   22.333   31.589   12.218   21.820   10.166 9.768589 15.89382 
1 1 1    1   18   40 o   60.421   7.1883   87.728   16.784   57.095   23.550  119.349   23.927   47.619   11.997   73.224   7.9227 -25.60503 14.37663 
1 1 1    1   18   41 o   53.847   8.4565   74.283   18.299   77.991   26.030   70.659   25.730   55.403   11.755   52.292   12.160 3.110729 16.91296 
1 1 1    1   18   42 f   64.292   6.1802   95.733   16.204  114.711   23.618   78.855   22.274   70.818   8.0860   57.767   9.3486 13.05132 12.36040 
1 1 1    1   18   43 o   56.759   7.6905   82.220   17.448  110.379   25.486   57.376   23.938   67.994   9.0879   45.525   12.409 22.46868 15.38102 
1 1 1    1   18   44 o   27.154   8.2202   11.981   16.426   13.994   23.000   9.8849   23.466   27.680   11.702   26.628   11.548 1.051773 16.44044 
1 1 1    1   18   45 f   36.808   8.9451   40.431   16.863   52.074   24.237   29.508   23.476   41.398   12.850   32.219   12.447 9.178303 17.89017 
1 1 1    1   18   46 o   32.308   9.4096   30.024   21.245   11.137   29.780   49.599   30.318   27.216   12.327   37.399   14.220 -10.18308 18.81919 
1 1 1    1   18   47 o   25.421   8.3253   2.5776   21.042   20.633   30.407 -14.0153   29.149   28.543   12.728   22.299   10.734 6.243252 16.65061 
1 1 1    1   19    0 o  430.510   3.2369  3825.85   81.260  3825.85   81.260  3825.85   81.260  430.510   4.5776  430.510   4.5776 0.000000 0.000000 
1 1 1    1   19    1 o  362.898   2.9489  2718.64   42.705  2718.33   53.961  2719.17   69.860  362.919   3.6050  362.877   4.6677 0.4180908E-01 5.897738 
1 1 1    1   19    2 o  217.378   2.7832  979.378   24.739  1008.72   33.177  942.634   37.126  221.075   3.6386  213.681   4.2126 7.394455 5.566442 
1 1 1    1   19    3 o  131.914   4.4114  359.291   24.001   0.0000   0.0000  359.291   24.001  ?   ?   131.914   4.4114      ?      ? 
1 1 1    1   19    4 o  207.959   3.2144  893.004   27.570  897.257   39.059  888.780   38.922  208.453   4.5431  207.466   4.5487 0.9872894 6.428847 
1 1 1    1   19    5 o  242.720   3.4026  1216.58   34.060  1229.49   48.523  1204.03   47.821  243.990   4.8218  241.451   4.8021 2.538681 6.805131 
1 1 1    1   19    6 o  115.755   5.4924  275.646   26.132  307.884   38.678  248.568   35.446  121.947   7.6900  109.563   7.8441 12.38351 10.98475 
1 1 1    1   19    7 o  275.273   3.6331  1565.44   41.245  1556.69   57.900  1574.45   58.768  274.495   5.1143  276.052   5.1616 -1.557281 7.266206 
1 1 1    1   19    8 o  115.711   3.8303  276.345   18.268  264.607   25.317  289.094   26.384  113.151   5.4249  118.271   5.4087 -5.120483 7.660572 
1 1 1    1   19    9 o   65.297   6.1967   92.869   15.351  126.143   21.671   59.357   21.748   78.071   6.7301   52.524   10.407 25.54663 12.39348 
1 1 1    1   19   10 o  216.533   3.4941  968.620   31.202  986.090   44.534  951.776   43.728  218.450   4.9428  214.616   4.9401 3.834229 6.988280 
1 1 1    1   19   11 o  119.577   3.2805  307.746   13.293  317.785   15.136  273.893   27.795  124.087   2.9575  115.067   5.8566 9.020203 6.560963 
1 1 1    1   19   12 o  347.861   3.2363  2500.22   46.423  2474.80   64.853  2526.93   66.480  346.054   4.5438  349.668   4.6097 -3.614594 6.472659 
1 1 1    1   19   13 o  255.257   2.6664  1347.33   27.728  1355.96   36.533  1335.61   42.585  256.254   3.4566  254.261   4.0608 1.992859 5.332756 
1 1 1    1   19   14 o  151.061   2.3475  469.657   13.877  466.454   17.080  475.875   23.802  150.334   2.7546  151.788   3.8019 -1.453674 4.694963 
1 1 1    1   19   15 o   92.315   3.2923  175.775   12.414  173.452   16.400  178.891   18.996   91.617   4.3401   93.013   4.9518 -1.396255 6.584579 
1 1 1    1   19   16 o  166.536   2.5342  574.157   17.087  580.074   22.207  565.569   26.753  167.615   3.2123  165.457   3.9204 2.157684 5.068367 
1 1 1    1   19   17 o   43.957   5.1165   41.873   8.8095   32.303   12.903   50.230   12.057   38.674   8.3348   49.240   5.9369 -10.56645 10.23307 
1 1 1    1   19   18 o  217.205   2.4761  974.447   22.181  980.581   31.522  968.431   31.218  217.882   3.5078  216.529   3.4957 1.352844 4.952170 
1 1 1    1   19   19 f  102.632   3.8463  217.665   16.255  235.705   23.549  201.247   22.466  106.692   5.3516   98.572   5.5259 8.120003 7.692510 
1 1 1    1   19   20 o  161.616   2.5757  538.989   17.155  557.404   24.891  522.329   23.675  164.239   3.6745  158.993   3.6104 5.245728 5.151412 
1 1 1    1   19   21 o  174.629   3.3978  633.679   23.565  621.578   38.794  640.755   29.665  173.216   5.4302  176.042   4.0856 -2.825790 6.795541 
1 1 1    1   19   22 o  163.202   3.0533  551.108   20.545  542.627   29.290  559.324   28.826  161.958   4.3848  164.447   4.2501 -2.488541 6.106506 
1 1 1    1   19   23 o  156.254   2.8485  504.584   18.352  517.098   26.351  492.798   25.573  158.133   4.0403  154.375   4.0165 3.757751 5.697011 
1 1 1    1   19   24 o  111.892   4.0205  260.199   18.512  250.613   26.786  268.963   25.613  109.890   5.9101  113.895   5.4524 -4.005630 8.040987 
1 1 1    1   19   25 o   48.540   7.7132   51.480   15.118   60.788   21.776   42.820   21.004   52.884   10.354   44.196   11.435 8.687515 15.42649 
1 1 1    1   19   26 o  107.536   3.7234  240.242   16.490  233.121   23.743  246.879   22.921  105.973   5.4322  109.099   5.0938 -3.125351 7.446815 
1 1 1    1   19   27 f   84.382   4.5147  147.902   15.685  156.510   23.023  140.444   21.428   86.659   6.4413   82.106   6.3276 4.553276 9.029379 
1 1 1    1   19   28 o   61.151   8.0637   81.364   19.782   65.640   27.365   98.576   28.631   54.187   12.499   68.115   10.191 -13.92762 16.12736 
1 1 1    1   19   29 f   43.234   9.3475   30.531   18.540   72.072   33.304   11.876   22.318   56.171   14.329   30.297   12.007 25.87426 18.69491 
1 1 1    1   19   30 o   30.635   7.9901   8.5300   15.442 -14.9380   21.428   33.884   22.273   22.017   10.153   39.253   12.341 -17.23688 15.98019 
1 1 1    1   19   31 o   65.001   6.0446   90.580   16.087   77.804   22.597  103.708   22.906   60.186   9.1033   69.816   7.9547 -9.630486 12.08917 
1 1 1    1   19   32 o  159.296   4.2319  534.846   27.486  530.740   42.060  537.907   36.312  158.506   6.4336  160.086   5.4996 -1.580017 8.463842 
1 1 1    1   19   33 f   44.664   7.9277   46.002   15.211   64.244   21.600   28.055   21.424   53.392   10.180   35.935   12.156 17.45704 15.85550 
1 1 1    1   19   34 o   42.607   8.3325   42.870   15.356   52.114   21.885   33.905   21.553   47.035   11.400   38.179   12.155 8.855961 16.66497 
1 1 1    1   19   35 o   25.683   7.8207   1.8963   15.081  -2.3774   21.171   6.2996   21.489   24.336   10.749   27.030   11.363 -2.693666 15.64132 
1 1 1    1   19   36 o   19.276   6.5510 -27.5303   15.218 -29.1735   21.733 -25.9495   21.316   19.146   9.2298   19.406   9.2992 -0.2595673 13.10208 
1 1 1    1   19   37 o   32.186   8.7016   18.559   16.523   32.088   24.670   7.5549   22.250   36.946   13.020   27.426   11.548 9.519934 17.40328 
1 1 1    1   19   38 o   72.810   5.7494  117.294   17.258  117.711   24.778  116.900   24.052   72.866   8.2447   72.754   8.0155 0.1121368 11.49887 
1 1 1    1   19   39 o   56.643   8.9112   80.945   20.287   84.369   28.769   77.558   28.612   58.044   12.394   55.242   12.807 2.802551 17.82243 
1 1 1    1   19   40 o   22.037   7.0680 -16.2260   15.354 -43.7488   21.940   10.188   21.494   16.885   8.3677   27.189   11.393 -10.30424 14.13610 
1 1 1    1   19   41 o   53.508   8.1129   73.116   17.381   66.191   24.648   79.965   24.514   50.388   12.027   56.628   10.891 -6.239948 16.22573 
1 1 1    1   19   42 o   26.096   7.8523   8.9130   14.966   2.3806   20.876   15.821   21.468   23.968   10.626   28.225   11.564 -4.256332 15.70450 
1 1 1    1   19   43 o   26.805   8.1145   10.643   16.014   7.8014   22.579   13.519   22.715   25.955   11.291   27.656   11.657 -1.701136 16.22904 
1 1 1    1   19   44 o   34.870   9.6326   34.164   22.018   58.944   30.765   8.1471   31.524   41.962   14.555   27.777   12.621 14.18454 19.26523 
1 1 1    1   19   45 o   26.019   8.4128   0.5129   20.917 -19.5344   29.518   20.732   29.644   22.355   10.772   29.684   12.926 -7.328398 16.82563 
1 1 1    1   19   46 o   28.333   8.8084   17.685   20.350   32.730   29.195   3.4692   28.380   31.681   13.277   24.985   11.578 6.695745 17.61673 
1 1 1    1   20    0 o  707.425   4.9168 10341.68  202.839 10341.68  202.839 10341.68  202.839  707.425   6.9534  707.425   6.9534 0.000000 0.000000 
1 1 1    1   20    1 o  134.672   2.0282  377.108   10.860  385.407   13.730  363.237   17.749  136.678   2.4356  132.666   3.2438 4.011810 4.056344 
1 1 1    1   20    2 o  246.500   3.2117  1254.92   32.652  1244.68   46.006  1265.31   46.351  245.486   4.5438  247.513   4.5404 -2.026779 6.423469 
1 1 1    1   20    3 o  179.461   3.1032  665.111   22.965  663.952   32.140  666.319   32.825  179.304   4.3460  179.618   4.4308 -0.3141785 6.206421 
1 1 1    1   20    4 f  465.532   4.9260  4486.12   94.581  4495.09  134.111  4477.24  133.406  465.992   6.9778  465.072   6.9549 0.9201660 9.851935 
1 1 1    1   20    5 o  211.943   3.2973  927.131   28.809  901.203   39.993  955.098   41.535  208.867   4.6425  215.019   4.6835 -6.151535 6.594521 
1 1 1    1   20    6 o  186.565   4.1032  723.933   29.692  732.237   36.388  707.385   51.366  188.265   4.6862  184.866   6.7369 3.398941 8.206434 
1 1 1    1   20    7 o  190.190   3.3127  747.396   25.984  755.170   36.685  739.570   36.810  191.185   4.6523  189.195   4.7173 1.990036 6.625462 
1 1 1    1   20    8 o  235.986   3.4881  1150.91   33.945  1145.46   47.566  1156.56   48.459  235.421   4.8988  236.552   4.9668 -1.131088 6.976202 
1 1 1    1   20    9 o  259.503   3.6043  1392.37   38.577  1390.20   54.386  1394.58   54.728  259.301   5.0853  259.706   5.1093 -0.4049377 7.208664 
1 1 1    1   20   10 o  114.107   3.8791  269.293   18.247  281.359   26.056  257.682   25.561  116.619   5.4172  111.596   5.5536 5.023674 7.758122 
1 1 1    1   20   11 o  269.708   5.1366  1502.72   56.998  1594.48   84.315  1425.49   77.350  277.236   7.3738  262.179   7.1531 15.05707 10.27326 
1 1 1    1   20   12 o  123.276   2.3610  314.380   11.776  316.943   15.274  310.623   18.492  123.911   2.9886  122.640   3.6559 1.271294 4.722043 
1 1 1    1   20   13 o  129.969   2.7059  348.768   14.495  331.485   20.289  366.787   20.717  126.679   3.8832  133.260   3.7693 -6.581268 5.411757 
1 1 1    1   20   14 o  233.739   2.3636  1127.63   22.780  1106.02   31.772  1150.49   32.679  231.436   3.3285  236.042   3.3567 -4.605255 4.727205 
1 1 1    1   20   15 o   80.665   3.0444  138.561   9.2250  144.931   11.115  124.463   16.536   83.777   3.2169   77.554   5.1695 6.222420 6.088711 
1 1 1    1   20   16 o  195.311   2.7696  788.213   22.310  781.242   31.417  795.304   31.686  194.440   3.9176  196.182   3.9160 -1.742233 5.539184 
1 1 1    1   20   17 o   81.462   3.5143  137.518   11.782  133.704   17.089  140.974   16.266   80.373   5.1552   82.550   4.7774 -2.177528 7.028527 
1 1 1    1   20   18 o   52.902   4.6239   59.334   9.8590   70.528   13.571   46.824   14.346   58.343   5.6399   47.461   7.3289 10.88174 9.247790 
1 1 1    1   20   19 o   46.961   5.2251   47.659   9.6255   38.111   14.162   55.856   13.122   42.027   8.4629   51.896   6.1308 -9.868393 10.45026 
1 1 1    1   20   20 o   77.493   4.7254  122.581   13.995  119.169   16.769  130.416   25.406   75.844   5.3605   79.142   7.7834 -3.298615 9.450731 
1 1 1    1   20   21 o   99.068   3.2162  203.260   13.120  199.687   19.013  206.508   18.126   98.225   4.6931   99.911   4.3988 -1.685402 6.432326 
1 1 1    1   20   22 o  117.628   3.2554  285.231   15.747  272.258   21.298  300.871   23.386  114.700   4.5022  120.557   4.7032 -5.857346 6.510729 
1 1 1    1   20   23 o   81.668   4.0307  139.369   13.467  121.250   19.289  156.598   18.809   76.415   6.1203   86.921   5.2466 -10.50619 8.061322 
1 1 1    1   20   24 o  105.993   4.1001  233.479   17.875  229.505   26.139  236.969   24.499  105.117   6.0291  106.870   5.5581 -1.753105 8.200134 
1 1 1    1   20   25 o  144.399   4.3592  431.054   25.485  420.122   32.846  447.591   40.399  142.222   5.5994  146.576   6.6825 -4.354279 8.718354 
1 1 1    1   20   26 o   71.842   5.3526  106.225   15.656  133.626   23.734   85.117   20.830   79.958   7.1967   63.725   7.9253 16.23305 10.70527 
1 1 1    1   20   27 o  143.750   3.4184  426.852   20.186  405.946   27.121  452.814   30.223  139.851   4.7020  147.649   4.9630 -7.798370 6.836706 
1 1 1    1   20   28 o   78.962   4.8714  131.314   15.771  116.654   22.517  145.431   22.095   74.532   7.3249   83.392   6.4240 -8.860069 9.742805 
1 1 1    1   20   29 o   44.928   9.7026   45.418   19.024   46.095   23.309   44.065   32.922   45.084   12.227   44.772   15.069 0.3120041 19.40528 
1 1 1    1   20   30 o  107.212   3.8687  240.566   17.100  231.455   24.042  249.894   24.327  105.137   5.5444  109.288   5.3971 -4.150879 7.737471 
1 1 1    1   20   31 o  104.412   3.9888  228.923   17.149  211.620   23.965  247.080   24.550  100.318   5.7921  108.506   5.4857 -8.187431 7.977554 
1 1 1    1   20   32 o  122.294   4.2589  315.085   21.469  300.318   30.069  330.440   30.662  119.334   6.1093  125.254   5.9353 -5.919533 8.517731 
1 1 1    1   20   33 o   33.052   8.2051   22.387   14.312   32.212   20.334   12.740   20.148   37.336   11.798   28.768   11.406 8.567387 16.41029 
1 1 1    1   20   34 o   33.542   8.1728   20.177   15.681  -2.4787   22.266   42.471   22.088   24.909   11.012   42.175   12.080 -17.26540 16.34564 
1 1 1    1   20   35 o   35.230   8.6134   27.724   15.262   30.176   21.502   25.234   21.667   36.312   12.178   34.148   12.184 2.164063 17.22681 
1 1 1    1   20   36 o   55.377   7.7140   72.511   16.990   75.039   24.278   70.084   23.785   56.396   10.831   54.359   10.986 2.036587 15.42801 
1 1 1    1   20   37 o   37.480   9.8906   32.575   20.531   33.908   28.818   31.201   29.258   37.926   13.978   37.035   13.996 0.8900490 19.78111 
1 1 1    1   20   38 o   39.591   8.5559   38.723   15.793   50.913   22.415   26.705   22.255   45.176   11.874   34.007   12.322 11.16927 17.11173 
1 1 1    1   20   39 o   31.178   8.9308   17.768   18.227   8.2005   25.966   27.060   25.590   28.301   12.210   34.055   13.037 -5.754198 17.86161 
1 1 1    1   20   40 o   36.710   8.5271   34.604   15.313   25.297   21.688   43.854   21.622   32.508   12.098   40.912   12.020 -8.403980 17.05424 
1 1 1    1   20   41 o   25.839   7.7654   8.2128   14.665   15.292   20.749   1.1472   20.729   27.999   11.408   23.679   10.538 4.319773 15.53081 
1 1 1    1   20   42 o   29.837   8.3911   20.274   15.409   22.026   22.890   18.823   20.838   30.582   12.147   29.092   11.579 1.489780 16.78214 
1 1 1    1   20   43 f   24.748   7.7682   3.9945   16.027  -3.6169   22.757   11.484   22.574   22.900   10.524   26.596   11.429 -3.695446 15.53650 
1 1 1    1   20   44 o   27.670   8.7542   7.5639   21.280   27.276   30.259 -11.7250   29.933   31.608   13.396   23.732   11.274 7.875921 17.50841 
1 1 1    1   20   45 o   42.129   9.9542   62.222   20.812   76.138   29.851   49.060   29.031   47.123   14.192   37.134   13.962 9.988472 19.90839 
1 1 1    1   20   46 o   28.376   8.6484   12.727   20.845 -22.7210   29.903   46.234   29.073   21.390   10.430   35.362   13.798 -13.97235 17.29682 
1 1 1    1   21    0 o   91.021   1.8584  171.333   9.8479  171.333   9.8479  171.333   9.8479   91.021   2.6282   91.021   2.6282 0.000000 0.000000 
1 1 1    1   21    1 o  330.160   2.7804  2243.73   36.444  2224.14   45.619  2278.29   60.588  328.237   3.3697  332.083   4.4236 -3.846497 5.560867 
1 1 1    1   21    2 o   76.241   2.7854  117.821   8.6693  136.419   13.484  104.717   11.319   81.272   4.0227   71.210   3.8538 10.06232 5.570830 
1 1 1    1   21    3 o  296.261   3.6410  1814.07   44.475  1793.81   61.965  1835.60   63.873  294.562   5.1004  297.959   5.1975 -3.396912 7.282032 
1 1 1    1   21    4 o  194.300   3.1853  779.733   25.519  805.774   36.518  754.879   35.676  197.471   4.4837  191.129   4.5256 6.341736 6.370647 
1 1 1    1   21    5 o  119.794   4.5314  296.979   20.202  297.754   37.877  296.671   23.883  119.793   7.6662  119.795   4.8337 -0.2792358E-02 9.062853 
1 1 1    1   21    6 o  280.871   3.6453  1629.84   42.194  1591.47   58.277  1672.12   61.171  277.409   5.0934  284.332   5.2162 -6.923065 7.290520 
1 1 1    1   21    7 o  104.140   3.8557  224.125   16.551  214.365   22.989  234.629   23.848  101.787   5.4759  106.493   5.4296 -4.705383 7.711390 
1 1 1    1   21    8 o  137.939   3.5381  393.102   20.119  409.040   28.934  378.182   27.995  140.645   4.9880  135.234   5.0191 5.411469 7.076126 
1 1 1    1   21    9 o  305.984   3.8445  1935.86   48.495  1972.27   69.898  1902.07   67.339  308.747   5.4890  303.221   5.3845 5.525879 7.689080 
1 1 1    1   21   10 o  198.629   3.4536  815.738   28.293  814.502   39.930  816.985   40.096  198.478   4.8777  198.779   4.8906 -0.3009491 6.907283 
1 1 1    1   21   11 o  116.284   5.1917  281.080   24.846  291.440   34.457  269.858   35.861  118.548   7.0472  114.020   7.6257 4.528252 10.38339 
1 1 1    1   21   12 o   59.400   6.3414   73.112   15.471   64.333   21.145   83.227   22.696   55.565   9.2264   63.236   8.7020 -7.671146 12.68277 
1 1 1    1   21   13 o  170.653   3.1698  601.052   21.185  598.656   26.118  605.661   36.221  170.227   3.7201  171.080   5.1333 -0.8532715 6.339573 
1 1 1    1   21   14 o   95.324   2.2008  188.016   8.6331  175.105   12.292  200.583   12.128   92.083   3.2366   98.565   2.9832 -6.481842 4.401689 
1 1 1    1   21   15 o  293.836   3.4304  1785.08   40.767  1780.21   52.687  1792.35   64.353  293.429   4.3534  294.243   5.3027 -0.8137817 6.860846 
1 1 1    1   21   16 o  148.759   2.7721  457.386   17.006  446.271   23.967  468.657   24.133  146.936   3.9547  150.583   3.8858 -3.646179 5.544250 
1 1 1    1   21   17 o   54.453   3.4308   56.959   7.3131   48.431   8.8114   75.838   13.110   48.390   4.4149   60.516   5.2526 -12.12656 6.861630 
1 1 1    1   21   18 o  222.078   2.6527  1017.61   23.842  1010.59   30.824  1028.06   37.617  221.173   3.3790  222.983   4.0902 -1.810196 5.305403 
1 1 1    1   21   19 o  205.216   2.6493  864.654   21.911  844.032   27.985  897.323   35.222  202.122   3.3569  208.311   4.0996 -6.189377 5.298650 
1 1 1    1   21   20 o  152.467   4.8374  481.257   30.419   0.0000   0.0000  481.257   30.419  ?   ?   152.467   4.8374      ?      ? 
1 1 1    1   21   21 o   85.230   3.6369  150.932   12.696  173.235   18.111  129.379   17.804   91.465   4.8008   78.995   5.4645 12.46911 7.273846 
1 1 1    1   21   22 o  275.575   4.0994  1573.55   46.541  1529.34   64.003  1623.15   67.798  271.497   5.7157  279.652   5.8781 -8.154755 8.198818 
1 1 1    1   21   23 o  174.078   3.7823  628.621   27.151  629.684   38.766  627.597   38.039  174.213   5.3952  173.942   5.3023 0.2710571 7.564519 
1 1 1    1   21   24 o  191.948   3.1361  762.753   24.816  744.811   34.451  782.102   35.776  189.609   4.4053  194.286   4.4646 -4.676727 6.272114 
1 1 1    1   21   25 o  140.036   3.1376  407.150   18.093  392.878   26.039  420.472   25.158  137.635   4.5869  142.438   4.2823 -4.803360 6.275208 
1 1 1    1   21   26 o   96.738   4.3239  195.379   17.224  183.789   24.456  206.787   24.263   93.852   6.3180   99.625   5.9049 -5.772484 8.647814 
1 1 1    1   21   27 o   66.462   5.2620   92.877   14.400   93.289   21.000   92.511   19.783   66.565   7.6491   66.359   7.2281 0.2053909 10.52393 
1 1 1    1   21   28 f   81.340   4.7384  139.486   15.848  148.612   22.120  129.862   22.716   84.155   6.3728   78.524   7.0140 5.630684 9.476769 
1 1 1    1   21   29 o   94.680   5.3594  191.191   20.800  211.454   29.108  170.051   29.733  100.010   7.0568   89.350   8.0681 10.66018 10.71886 
1 1 1    1   21   30 o   67.857   5.3614   98.109   14.977   90.247   20.902  106.405   21.470   65.001   7.7965   70.713   7.3616 -5.711739 10.72283 
1 1 1    1   21   31 o   37.540   8.7335   30.416   16.498   15.921   23.970   43.464   22.742   31.785   12.492   43.296   12.208 -11.51066 17.46710 
1 1 1    1   21   32 o   44.340   7.8656   46.087   14.381   42.706   20.327   49.475   20.349   42.619   11.358   46.061   10.884 -3.442154 15.73119 
1 1 1    1   21   33 o   29.037   8.0827   13.689   14.228   12.119   20.256   15.218   19.989   28.495   11.392   29.580   11.469 -1.085028 16.16533 
1 1 1    1   21   34 o   57.710   7.0244   74.614   16.143   58.908   21.810   93.646   24.008   50.207   10.849   65.214   8.9258 -15.00714 14.04876 
1 1 1    1   21   35 o   28.770   7.8872   9.0789   14.902   29.305   21.288 -10.3580   20.868   35.534   12.116   22.007   10.101 13.52792 15.77433 
1 1 1    1   21   36 o   28.801   8.3952   11.322   16.125   10.726   23.172   11.882   22.453   28.749   11.920   28.853   11.825 -0.1039848 16.79030 
1 1 1    1   21   37 o   55.464   8.9062   78.039   20.925   50.077   29.520  106.275   29.664   43.573   14.257   67.356   10.678 -23.78337 17.81237 
1 1 1    1   21   38 o   42.432   9.2467   46.083   17.653   57.222   27.501   38.276   23.022   46.235   13.548   38.629   12.588 7.605213 18.49340 
1 1 1    1   21   39 o   33.235   8.4082   25.010   15.445   10.993   21.324   40.479   22.402   27.252   11.378   39.218   12.382 -11.96599 16.81647 
1 1 1    1   21   40 o   36.486   8.2164   34.681   14.789   20.533   21.252   47.964   20.592   30.183   11.792   42.789   11.445 -12.60538 16.43275 
1 1 1    1   21   41 o   25.120   7.6031   7.7751   14.031   5.7459   19.493   9.9567   20.212   24.335   10.539   25.905   10.962 -1.570370 15.20621 
1 1 1    1   21   42 f   45.103   8.7940   57.789   18.288   84.926   26.512   33.158   25.259   55.952   11.857   34.254   12.990 21.69828 17.58793 
1 1 1    1   21   43 o   29.561   7.9161   13.989   16.270   45.606   22.905 -18.2076   23.114   38.980   12.544   20.142   9.6601 18.83836 15.83222 
1 1 1    1   21   44 o   31.827   9.4829   30.545   21.627   21.112   31.954   38.520   29.379   29.610   13.135   34.045   13.681 -4.434938 18.96589 
1 1 1    1   21   45 o   24.591   8.0306  -1.7277   19.952   21.530   28.123 -25.2991   28.312   28.579   12.513   20.604   10.069 7.975271 16.06119 
1 1 1    1   22    0 o   59.054   2.6004   72.804   8.8777   72.804   8.8777   72.804   8.8777   59.054   3.6776   59.054   3.6776 0.000000 0.000000 
1 1 1    1   22    1 o  235.848   2.3151  1142.70   21.630  1128.17   26.971  1168.89   36.206  233.794   2.7971  237.901   3.6899 -4.106110 4.630260 
1 1 1    1   22    2 o  386.490   5.1990  3100.80   78.170  3105.20   95.848  3092.06  135.087  387.279   6.0006  385.701   8.4918 1.577789 10.39795 
1 1 1    1   22    3 o   81.513   3.6023  138.449   12.019  151.913   16.604  123.630   17.420   85.725   4.6961   77.301   5.4638 8.423454 7.204585 
1 1 1    1   22    4 o  156.633   3.1318  506.901   20.224  502.577   28.171  511.501   29.053  155.948   4.3798  157.319   4.4776 -1.371094 6.263506 
1 1 1    1   22    5 o   75.732   7.4479  122.453   22.108   90.956   30.834  155.777   31.716   64.924   11.955   86.541   8.8856 -21.61623 14.89583 
1 1 1    1   22    6 o  288.747   3.6726  1724.35   43.735  1715.22   61.426  1733.73   62.284  287.977   5.1716  289.518   5.2160 -1.542053 7.345215 
1 1 1    1   22    7 o  151.029   3.3798  471.027   21.038  457.123   29.090  486.274   30.463  148.698   4.7433  153.360   4.8160 -4.661987 6.759629 
1 1 1    1   22    8 o   52.543   6.6195   59.913   13.695   77.727   19.304   41.862   19.433   61.186   7.6495   43.900   10.805 17.28559 13.23899 
1 1 1    1   22    9 o  119.370   3.7655  294.645   18.524  278.339   25.834  311.901   26.575  115.968   5.4011  122.773   5.2481 -6.805000 7.530901 
1 1 1    1   22   10 o  118.979   3.8153  292.941   18.708  290.754   25.906  295.326   27.045  118.523   5.2994  119.435   5.4903 -0.9122849 7.630699 
1 1 1    1   22   11 o  258.838   5.0379  1390.87   53.782  1402.29   76.210  1379.53   75.910  259.901   7.1095  257.776   7.1399 2.124878 10.07585 
1 1 1    1   22   12 o  189.157   3.5268  740.229   27.512  757.054   39.124  723.771   38.695  191.286   4.9590  187.027   5.0163 4.259201 7.053656 
1 1 1    1   22   13 o  155.797   3.7313  502.573   23.974  509.596   33.858  495.513   33.951  156.894   5.2322  154.701   5.3211 2.193329 7.462605 
1 1 1    1   22   14 o  109.016   2.6601  246.244   11.587  248.234   14.701  242.980   18.828  109.628   3.2513  108.403   4.2112 1.224190 5.320268 
1 1 1    1   22   15 o  115.039   2.1713  273.299   10.302  273.577   14.637  273.026   14.501  115.096   3.0834  114.981   3.0578 0.1146774 4.342532 
1 1 1    1   22   16 o  206.368   2.4357  880.014   20.643  878.490   30.623  881.283   27.948  206.187   3.6010  206.550   3.2807 -0.3630524 4.871324 
1 1 1    1   22   17 o  111.812   2.9986  258.660   13.823  251.558   19.606  265.680   19.492  110.280   4.3104  113.344   4.1696 -3.064087 5.997113 
1 1 1    1   22   18 o  231.936   3.4050  1106.24   31.109  1089.16   38.503  1138.36   52.797  229.501   4.0676  234.372   5.4618 -4.870422 6.810042 
1 1 1    1   22   19 o  157.104   2.9739  510.770   19.261  494.375   27.296  527.028   27.182  154.583   4.2813  159.625   4.1287 -5.041412 5.947773 
1 1 1    1   22   20 o   57.805   3.9905   65.596   8.7400   60.483   10.299   78.758   16.524   54.050   4.6197   61.559   6.5080 -7.508884 7.980957 
1 1 1    1   22   21 o   48.721   8.3516   55.045   16.958   66.754   21.064   33.482   28.586   56.447   9.0478   40.995   14.040 15.45212 16.70315 
1 1 1    1   22   22 o   32.820   6.7565   21.058   10.535   36.441   15.562   8.0467   14.312   40.844   9.4291   24.796   9.6797 16.04777 13.51306 
1 1 1    1   22   23 o   97.876   3.9900  200.412   15.992  176.554   22.930  223.005   22.314   92.112   6.0357  103.640   5.2202 -11.52740 7.980015 
1 1 1    1   22   24 f   91.347   3.7094  173.259   13.961  184.576   20.047  162.600   19.455   94.253   5.1570   88.441   5.3334 5.811584 7.418842 
1 1 1    1   22   25 f   30.399   7.3970   15.317   12.171   29.610   17.604   2.2279   16.846   36.880   10.849   23.917   10.058 12.96277 14.79395 
1 1 1    1   22   26 o   81.980   4.3688  140.288   14.752  134.522   20.233  146.834   21.555   80.197   6.1169   83.763   6.2392 -3.565887 8.737509 
1 1 1    1   22   27 o   38.413   7.6754   32.773   13.224   20.629   18.951   44.300   18.463   32.334   11.410   44.492   10.269 -12.15842 15.35080 
1 1 1    1   22   28 o   58.273   6.4901   74.200   15.193   67.913   21.686   80.260   21.292   55.285   9.8730   61.262   8.4267 -5.977436 12.98021 
1 1 1    1   22   29 o   33.878   8.1428   24.018   13.738   29.935   19.739   18.459   19.132   36.645   11.629   31.112   11.401 5.532831 16.28559 
1 1 1    1   22   30 o   22.740   7.4493 -18.6150   15.526 -26.3753   19.052  -3.2723   26.788   18.059   8.6896   27.421   12.102 -9.361235 14.89862 
1 1 1    1   22   31 o   39.843   8.8593   37.054   16.305   42.927   23.623   31.711   22.532   42.422   12.591   37.264   12.467 5.158329 17.71855 
1 1 1    1   22   32 o   29.702   7.3199   7.6944   14.039 -22.0569   19.697   38.418   20.016   19.070   9.0833   40.334   11.481 -21.26486 14.63987 
1 1 1    1   22   33 o   63.609   5.9790   88.612   15.652   82.264   22.132   94.964   22.139   61.190   8.7697   66.029   8.1292 -4.839733 11.95793 
1 1 1    1   22   34 o   49.532   7.6580   58.126   15.231   65.134   21.739   51.369   21.346   52.794   10.354   46.270   11.286 6.524361 15.31602 
1 1 1    1   22   35 o   82.109   5.2674  147.486   17.715  167.555   25.187  127.838   24.922   87.948   6.9436   76.270   7.9225 11.67825 10.53472 
1 1 1    1   22   36 o   24.893   7.6254   2.1602   14.562   7.6147   20.618  -3.2681   20.568   26.478   11.131   23.307   10.426 3.171175 15.25072 
1 1 1    1   22   37 o   20.385   6.7634 -17.8173   14.667  -5.1892   20.907 -30.0555   20.581   22.832   10.336   17.938   8.7261 4.893908 13.52676 
1 1 1    1   22   38 o   49.353   10.269   70.694   22.294   74.917   27.514   62.622   38.040   53.348   12.689   45.359   16.148 7.988636 20.53750 
1 1 1    1   22   39 o   32.236   8.4907   25.407   15.123   23.967   21.387   26.847   21.386   31.648   11.965   32.823   12.050 -1.175026 16.98141 
1 1 1    1   22   40 o   40.287   8.1603   43.681   14.668   55.147   20.850   32.445   20.640   45.837   11.138   34.738   11.929 11.09962 16.32070 
1 1 1    1   22   41 o   36.157   8.3046   35.931   14.388   29.576   20.631   41.947   20.074   33.169   11.883   39.146   11.604 -5.976955 16.60926 
1 1 1    1   22   42 o   23.326   7.5582  -1.6493   16.510   3.0254   22.216  -7.4170   24.677   23.973   10.771   22.679   10.606 1.294378 15.11631 
1 1 1    1   22   43 o   31.279   8.4828   27.142   15.867   37.682   22.387   16.505   22.491   35.159   12.402   27.399   11.577 7.760256 16.96557 
1 1 1    1   22   44 o   21.440   7.3168 -16.9106   19.397 -18.4666   28.748 -15.6103   26.281   21.666   10.486   21.214   10.207 0.4517345 14.63369 
1 1 1    1   23    0 o  189.128   2.8280  739.326   31.165  739.326   31.165  739.326   31.165  189.128   3.9994  189.128   3.9994 0.000000 0.000000 
1 1 1    1   23    1 o  300.069   2.6193  1855.63   31.225  1844.18   39.150  1875.65   51.766  298.864   3.1761  301.274   4.1660 -2.409424 5.238570 
1 1 1    1   23    3 o  172.127   3.0695  612.045   21.783  599.868   30.306  625.060   31.331  170.359   4.3132  173.895   4.3684 -3.535400 6.138933 
1 1 1    1   23    4 o  164.941   3.1285  562.124   21.271  588.357   30.429  537.055   29.747  168.706   4.3732  161.174   4.4749 7.532059 6.256912 
1 1 1    1   23    5 o  338.341   5.7295  2380.09   79.937  2355.01  111.708  2406.40  114.438  336.534   8.0480  340.148   8.1572 -3.613495 11.45906 
1 1 1    1   23    6 o  138.980   3.3266  399.536   19.065  402.631   26.779  396.355   27.149  139.530   4.6534  138.430   4.7551 1.100464 6.653184 
1 1 1    1   23    7 o  291.894   3.7311  1763.18   44.912  1783.43   64.168  1743.73   62.882  293.532   5.3003  290.256   5.2526 3.275665 7.462113 
1 1 1    1   23    8 o  156.843   3.4452  508.629   22.281  497.365   31.074  520.548   31.964  155.058   4.8589  158.628   4.8856 -3.569931 6.890385 
1 1 1    1   23    9 o   95.504   4.2850  188.818   16.869  180.544   23.442  197.703   24.292   93.334   6.0897   97.674   6.0300 -4.339447 8.570061 
1 1 1    1   23   10 o   83.198   5.3068  143.116   17.647  140.832   22.273  146.968   28.924   82.389   6.5545   84.007   8.3478 -1.617966 10.61358 
1 1 1    1   23   11 o   73.413   5.3077  111.801   15.950   94.021   21.952  131.682   23.213   67.210   7.9191   79.615   7.0692 -12.40438 10.61536 
1 1 1    1   23   12 o  205.370   3.5499  872.993   30.058  869.797   41.916  876.376   43.126  204.992   4.9577  205.747   5.0820 -0.7544556 7.099710 
1 1 1    1   23   13 o  269.686   3.7977  1506.31   42.237  1516.73   60.302  1496.27   59.178  270.595   5.4031  268.777   5.3383 1.817566 7.595469 
1 1 1    1   23   14 o  252.366   5.5845  1326.20   58.096  1331.52   83.622  1321.24   80.771  252.816   8.0196  251.915   7.7739 0.9009094 11.16900 
1 1 1    1   23   15 o   28.500   6.8777   11.668   5.1167   19.957   23.247   11.246   5.2454   34.156   12.560   22.843   5.6086 11.31242 13.75535 
1 1 1    1   23   16 o   86.043   2.7621  155.461   9.4211  162.459   11.943  143.935   15.328   88.679   3.2655   83.407   4.4557 5.272125 5.524149 
1 1 1    1   23   17 o  176.205   2.2509  641.003   16.353  658.227   23.497  624.821   22.774  178.498   3.1916  173.912   3.1750 4.586792 4.501883 
1 1 1    1   23   18 o   57.581   4.2567   69.866   9.9520   60.480   14.752   77.705   13.482   53.938   6.6311   61.224   5.3391 -7.286133 8.513374 
1 1 1    1   23   19 o   54.325   3.6957   54.482   7.7341   43.572   9.1501   81.777   14.473   45.864   4.8371   62.786   5.5890 -16.92197 7.391498 
1 1 1    1   23   20 o  146.568   2.6813  444.660   15.769  445.650   20.110  443.080   25.409  146.832   3.3206  146.305   4.2109 0.5277557 5.362633 
1 1 1    1   23   21 o   35.492   5.0291   35.751   8.3782   54.583   10.038  -7.5043   15.212   51.310   4.7431   19.674   8.8697 31.63630 10.05821 
1 1 1    1   23   22 o   56.928   7.7550   87.809   10.620   92.506   11.229   48.047   32.673   66.828   4.0740   47.028   14.965 19.80060 15.51001 
1 1 1    1   23   23 o   38.219   7.5171   31.195   12.277   25.156   16.209   39.321   18.801   34.275   10.487   42.163   10.772 -7.888115 15.03415 
1 1 1    1   23   24 o   84.891   3.7795  150.374   13.173  133.582   18.582  167.337   18.677   80.073   5.6266   89.710   5.0477 -9.636787 7.559014 
1 1 1    1   23   25 o   44.415   6.7145   43.555   11.936   49.323   17.251   38.258   16.532   47.361   9.1626   41.469   9.8177 5.892239 13.42909 
1 1 1    1   23   26 o   67.294   4.6505   95.315   12.897   93.431   18.495   97.097   17.994   66.615   6.7316   67.972   6.4183 -1.357758 9.300995 
1 1 1    1   23   27 o   57.915   5.8935   72.168   13.992   65.646   20.233   78.146   19.370   55.251   8.8786   60.578   7.7526 -5.327316 11.78693 
1 1 1    1   23   28 o   96.330   3.9821  194.302   15.762  202.488   23.509  187.618   21.243   98.109   5.8097   94.551   5.4475 3.558357 7.964138 
1 1 1    1   23   29 o   23.718   7.1551  -1.7456   12.974   10.658   18.491 -13.7727   18.209   27.517   10.922   19.920   9.2465 7.596922 14.31023 
1 1 1    1   23   30 o   44.700   8.5674   46.169   18.768   79.461   26.364   11.965   26.722   58.370   11.360   31.030   12.828 27.34051 17.13477 
1 1 1    1   23   31 o   76.717   4.7464  126.035   14.959  112.255   20.927  140.435   21.392   72.296   7.0181   81.138   6.3922 -8.842430 9.492815 
1 1 1    1   23   32 o   58.095   6.1510   74.178   14.703   79.693   20.779   68.647   20.807   60.403   8.3406   55.788   9.0429 4.615158 12.30203 
1 1 1    1   23   33 o   67.937   5.4071  100.648   15.147   97.991   21.142  103.450   21.711   67.015   7.6489   68.858   7.6447 -1.843384 10.81422 
1 1 1    1   23   34 o   31.918   8.2730   21.200   14.535   28.533   20.501   13.789   20.610   34.983   11.891   28.853   11.506 6.129591 16.54594 
1 1 1    1   23   35 o   36.532   8.4877   28.389   17.131   2.1033   24.189   54.844   24.266   26.441   11.590   46.623   12.403 -20.18169 16.97538 
1 1 1    1   23   36 o   21.420   6.9206 -11.7714   14.300 -27.7978   20.626   3.0596   19.842   18.312   8.8677   24.528   10.628 -6.215340 13.84127 
1 1 1    1   23   37 o   28.913   8.0917   15.926   14.568   8.9981   20.785   22.616   20.424   26.467   11.153   31.360   11.726 -4.893343 16.18348 
1 1 1    1   23   38 o   25.804   7.9848  -4.6045   17.643   22.384   25.438 -29.6187   24.490   31.744   12.740   19.864   9.6297 11.88009 15.96967 
1 1 1    1   23   39 f   19.760   6.5919 -13.6878   14.016 -15.3595   19.982 -12.0688   19.665   19.527   9.2572   19.993   9.3871 -0.4657688 13.18388 
1 1 1    1   23   40 o   24.010   7.4349   4.1919   14.094   8.4485   20.226   0.1740   19.651   25.301   10.844   22.719   10.174 2.582603 14.86977 
1 1 1    1   23   41 o   23.247   7.4265  -0.3593   15.399  -9.1046   21.741   8.4455   21.815   21.186   9.9227   25.308   11.052 -4.121359 14.85300 
1 1 1    1   23   42 o   42.730   8.7834   54.787   16.636   45.880   23.414   63.866   23.640   38.611   12.700   46.849   12.137 -8.238136 17.56682 
1 1 1    1   23   43 o   23.981   8.0738 -13.7147   20.173   21.318   34.674 -31.6387   24.802   29.346   13.295   18.617   9.1639 10.72862 16.14758 
1 1 1    1   23   44 o   22.694   7.6244  -7.6267   19.432  -2.2302   27.277 -13.1873   27.689   23.485   11.036   21.904   10.523 1.581362 15.24881 
1 1 1    1   24    0 o  237.719   2.2178  1166.74   30.740  1166.74   30.740  1166.74   30.740  237.719   3.1365  237.719   3.1365 0.000000 0.000000 
1 1 1    1   24    1 o  116.595   1.9718  280.677   9.0756  280.775   11.304  280.500   15.225  116.641   2.3496  116.549   3.1672 0.9197235E-01 3.943592 
1 1 1    1   24    2 o  281.303   4.2221  1654.40   47.288  1581.27   76.829  1699.00   59.999  276.068   6.7475  286.538   5.0769 -10.46967 8.444183 
1 1 1    1   24    3 o  233.559   3.2838  1128.15   31.632  1137.96   44.923  1118.51   44.548  234.566   4.6434  232.553   4.6446 2.013153 6.567575 
1 1 1    1   24    4 o  259.824   3.4630  1395.20   37.073  1364.12   51.083  1429.78   53.889  256.784   4.8233  262.865   4.9705 -6.080780 6.926043 
1 1 1    1   24    5 o  172.705   4.8567  616.924   34.532  575.980   47.236  663.926   50.610  166.571   6.8756  178.839   6.8613 -12.26767 9.713435 
1 1 1    1   24    6 o   32.338   7.3174   21.435   11.246   26.477   15.126   15.205   16.815   35.130   9.9742   29.545   10.710 5.585590 14.63486 
1 1 1    1   24    7 o   84.148   4.2798  146.857   14.846  148.248   20.722  145.390   21.279   84.565   5.9412   83.730   6.1618 0.8356171 8.559568 
1 1 1    1   24    8 o  128.969   3.6064  344.780   19.159  359.647   26.860  329.384   27.335  131.818   4.9405  126.120   5.2550 5.698158 7.212723 
1 1 1    1   24    9 o  164.969   3.4647  563.126   23.570  555.744   32.975  570.837   33.704  163.866   4.8790  166.071   4.9206 -2.205170 6.929427 
1 1 1    1   24   10 o  111.544   5.1524  258.053   23.675  245.485   32.530  272.207   34.521  108.667   7.2581  114.421   7.3149 -5.754326 10.30474 
1 1 1    1   24   11 o  169.412   3.6287  594.555   25.342  614.582   35.784  574.404   35.895  172.288   5.0358  166.535   5.2259 5.752426 7.257363 
1 1 1    1   24   12 o  198.566   3.6212  816.621   29.653  832.398   41.955  800.873   41.916  200.491   5.0737  196.642   5.1682 3.848465 7.242459 
1 1 1    1   24   13 o  312.467   4.0317  2023.35   51.940  1994.48   72.310  2054.13   74.656  310.179   5.6522  314.755   5.7508 -4.575470 8.063408 
1 1 1    1   24   14 o  156.097   5.1337  496.835   29.825  483.990   35.061  530.465   56.731  152.801   5.5633  159.392   8.6295 -6.591080 10.26741 
1 1 1    1   24   15 o  116.957   4.4528  283.793   21.462  277.509   29.641  290.719   31.116  115.608   6.2164  118.307   6.3769 -2.698471 8.905507 
1 1 1    1   24   16 o   69.782   2.6373   99.241   7.4103   94.423   9.4032  107.135   12.037   67.595   3.3728   71.969   4.0553 -4.373100 5.274630 
1 1 1    1   24   17 o   39.945   3.0270   33.997   4.8407   26.689   7.2032   40.015   6.5367   35.894   4.8656   43.995   3.6023 -8.101116 6.053979 
1 1 1    1   24   18 o   61.509   3.0500   74.696   7.4257   66.408   9.0975   91.239   12.854   56.657   3.8932   66.362   4.6961 -9.705189 6.100010 
1 1 1    1   24   19 o  140.020   3.2299  406.277   18.653  409.693   26.402  402.874   26.356  140.610   4.5525  139.430   4.5831 1.179611 6.459855 
1 1 1    1   24   20 o  189.595   2.9486  744.583   23.057  747.266   32.737  741.941   32.479  189.932   4.1790  189.258   4.1609 0.6743317 5.897204 
1 1 1    1   24   21 o   57.036   3.9477   68.060   8.6135   68.710   10.424   66.661   15.294   57.564   4.3906   56.508   6.5620 1.055817 7.895347 
1 1 1    1   24   22 o   86.910   3.7119  155.360   12.647  151.687   15.541  162.559   21.760   85.513   4.4065   88.307   5.9745 -2.794487 7.423758 
1 1 1    1   24   23 o   88.199   3.2420  160.942   10.686  159.949   12.654  163.410   19.949   87.871   3.4916   88.528   5.4636 -0.6572876 6.484016 
1 1 1    1   24   24 o   86.534   3.8142  153.929   13.464  125.828   17.939  190.176   20.374   77.588   5.6059   95.480   5.1737 -17.89249 7.628402 
1 1 1    1   24   25 o   68.339   4.5279   97.894   12.738   92.020   17.384  104.705   18.719   66.140   6.3726   70.538   6.4341 -4.398033 9.055861 
1 1 1    1   24   26 o   46.701   6.3472   48.444   11.775   47.960   16.928   48.899   16.391   46.405   9.1698   46.998   8.7785 -0.5939598 12.69438 
1 1 1    1   24   27 o   57.633   5.5835   71.316   13.205   66.930   19.254   75.212   18.144   55.828   8.3620   59.437   7.4014 -3.609268 11.16708 
1 1 1    1   24   28 o  124.060   3.5741  323.058   18.280  311.664   25.800  334.545   25.905  121.828   5.1346  126.291   4.9733 -4.463005 7.148263 
1 1 1    1   24   29 o   59.789   5.4139   77.069   13.163   94.825   19.193   61.299   18.088   66.504   6.9972   53.073   8.2633 13.43148 10.82787 
1 1 1    1   24   30 o   28.759   8.2231   10.627   15.309   18.364   22.169   3.5727   21.167   31.493   12.115   26.025   11.122 5.467529 16.44620 
1 1 1    1   24   31 o   46.217   8.3904   53.001   15.935   58.955   19.747   41.886   26.980   50.744   9.7900   41.691   13.629 9.053047 16.78087 
1 1 1    1   24   32 o   30.900   7.6129   16.126   13.713   36.994   19.544  -4.1101   19.246   39.226   11.400   22.573   10.092 16.65261 15.22571 
1 1 1    1   24   33 o   91.688   4.2789  180.013   16.163  191.551   23.062  168.876   22.658   94.655   5.9074   88.721   6.1919 5.933693 8.557862 
1 1 1    1   24   34 o   61.294   5.9105   83.900   14.935   83.886   20.823   83.916   21.433   61.362   8.2278   61.227   8.4875 0.1346283 11.82098 
1 1 1    1   24   35 o   20.378   6.7219 -12.8339   13.854 -14.8219   20.472 -11.1544   18.817   20.483   9.6046   20.274   9.4068 0.2095528 13.44380 
1 1 1    1   24   36 o   26.122   7.7701  -1.0011   16.009   25.389   22.995 -25.8203   22.300   32.831   12.408   19.414   9.3565 13.41658 15.54026 
1 1 1    1   24   37 o   90.145   5.2398  182.786   19.434  181.060   28.368  184.313   26.678   89.458   7.6884   90.831   7.1211 -1.373047 10.47955 
1 1 1    1   24   38 o   17.448   6.0107 -27.1577   13.850 -22.2442   20.358 -31.3917   18.898   18.546   8.9384   16.350   8.0385 2.195623 12.02135 
1 1 1    1   24   39 o   23.431   7.1593   0.6396   13.540 -14.9232   19.039   16.566   19.260   19.034   9.0271   27.828   11.115 -8.793850 14.31853 
1 1 1    1   24   40 o   34.229   8.2545   32.731   14.266   24.994   20.125   40.546   20.227   30.686   11.605   37.772   11.741 -7.086535 16.50892 
1 1 1    1   24   41 o   28.533   8.1462   18.387   15.361   6.8298   21.441   30.573   22.017   24.541   10.829   32.526   12.173 -7.985285 16.29246 
1 1 1    1   24   42 o   25.694   7.7835   12.069   15.119   2.0908   21.439   21.942   21.326   22.854   10.393   28.534   11.589 -5.680004 15.56701 
1 1 1    1   24   43 o   39.694   9.8008   53.047   23.896  103.744   35.014   8.8489   32.693   52.857   15.230   26.530   12.340 26.32625 19.60155 
1 1 1    1   25    0 o   66.756   1.9587   92.428   7.5970   92.428   7.5970   92.428   7.5970   66.756   2.7700   66.756   2.7700 0.000000 0.000000 
1 1 1    1   25    1 o  167.617   2.4594  582.025   16.699  571.938   26.088  589.026   21.735  166.354   3.8023  168.881   3.1204 -2.526825 4.918710 
1 1 1    1   25    2 o  157.714   3.4951  504.054   21.790  552.048   37.191  478.967   26.888  163.238   5.5239  152.189   4.2836 11.04903 6.990199 
1 1 1    1   25    3 o  115.180   3.1453  274.586   14.930  280.532   20.861  268.341   21.378  116.467   4.3428  113.893   4.5510 2.574684 6.290594 
1 1 1    1   25    4 o  155.883   3.1208  502.530   20.058  520.408   28.545  485.093   28.190  158.626   4.3631  153.139   4.4632 5.486954 6.241532 
1 1 1    1   25    5 o   39.577   7.3920   39.711   13.778   52.705   15.510  -8.9135   30.004   50.339   7.4704   28.814   12.758 21.52482 14.78409 
1 1 1    1   25    6 o  173.500   3.3012  619.942   23.565  579.813   32.000  667.485   34.832  167.399   4.6349  179.600   4.7022 -12.20178 6.602496 
1 1 1    1   25    7 o  214.717   3.3987  954.233   30.096  968.971   42.647  939.612   42.478  216.373   4.7788  213.061   4.8339 3.312073 6.797305 
1 1 1    1   25    8 o   69.020   5.3185  100.594   14.890  117.967   20.684   81.906   21.452   75.365   6.6543   62.675   8.2987 12.69008 10.63708 
1 1 1    1   25    9 o  132.976   3.6962  366.249   20.271  362.453   28.515  370.128   28.822  132.279   5.2266  133.672   5.2279 -1.393051 7.392389 
1 1 1    1   25   10 o   96.555   5.5569  194.752   22.062  208.780   30.893  180.150   31.518  100.159   7.4783   92.950   8.2214 7.208809 11.11376 
1 1 1    1   25   11 o   52.958   7.3471   60.758   15.693   32.663   21.525   92.632   22.927   39.283   12.096   66.633   8.3425 -27.35025 14.69415 
1 1 1    1   25   12 o  190.281   3.6560  748.455   28.654  717.419   39.308  783.649   41.859  186.089   5.1215  194.472   5.2187 -8.383026 7.311937 
1 1 1    1   25   13 o   79.258   8.6022  141.044   23.886  121.906   44.824  148.635   28.228   74.122   15.173   84.393   8.1098 -10.27163 17.20436 
1 1 1    1   25   14 o   68.770   6.5031  100.322   18.201  112.451   24.932   86.480   26.633   73.383   8.2375   64.157   10.065 9.225960 13.00620 
1 1 1    1   25   15 o  140.958   4.1320  413.427   23.956  428.882   33.078  396.381   34.740  143.776   5.5781  138.140   6.0974 5.636108 8.264013 
1 1 1    1   25   16 o   71.779   6.8245  110.202   19.813  130.108   27.445   88.534   28.634   78.829   8.4412   64.728   10.726 14.10143 13.64896 
1 1 1    1   25   17 o  138.125   3.7252  405.463   19.270  419.694   23.103  372.935   34.930  142.400   3.9336  133.850   6.3273 8.550461 7.450374 
1 1 1    1   25   18 o  172.443   2.2753  614.795   16.182  607.826   22.748  621.934   23.024  171.454   3.2168  173.432   3.2187 -1.978119 4.550621 
1 1 1    1   25   19 o  112.671   2.8140  266.978   12.691  281.530   16.365  245.025   20.100  116.649   3.4016  108.693   4.4837 7.956123 5.628006 
1 1 1    1   25   20 o   66.314   3.3016   89.642   8.5218   86.503   10.366   96.187   14.968   64.620   3.8893   68.007   5.3363 -3.386345 6.603258 
1 1 1    1   25   21 o   64.898   2.7211   87.021   7.2706   94.289   10.609   80.586   9.9833   67.447   3.8139   62.348   3.8823 5.099106 5.442181 
1 1 1    1   25   22 o  126.972   3.7423  336.500   19.590  328.013   27.853  344.807   27.557  125.360   5.3871  128.583   5.1961 -3.222771 7.484617 
1 1 1    1   25   23 o   60.875   8.5563   82.941   21.012   57.726   28.791  111.675   30.734   49.933   13.608   71.817   10.376 -21.88382 17.11259 
1 1 1    1   25   24 f   75.918   3.3587  114.567   9.6739  106.495   11.427  134.983   18.173   71.576   3.8710   80.261   5.4898 -8.685120 6.717354 
1 1 1    1   25   25 o   32.001   6.0474   19.223   6.8731   16.539   7.6671   30.205   15.509   27.417   6.8108   36.585   9.9948 -9.168058 12.09478 
1 1 1    1   25   26 o   51.744   4.3123   49.965   8.1359   43.564   9.2855   71.123   16.881   45.628   4.9341   57.860   7.0738 -12.23251 8.624634 
1 1 1    1   25   27 o  123.667   3.4990  316.935   17.691  290.244   23.224  353.840   27.308  117.618   4.7873  129.715   5.1042 -12.09686 6.997933 
1 1 1    1   25   28 o  111.253   3.5695  260.041   16.324  254.322   22.098  266.912   24.219  109.987   4.8713  112.518   5.2187 -2.531181 7.138931 
1 1 1    1   25   29 o   42.944   7.1574   42.790   12.561   51.309   17.987   34.682   17.548   47.374   9.5357   38.514   10.676 8.859650 14.31485 
1 1 1    1   25   30 o   79.433   4.6733  134.845   15.229  132.893   20.455  137.274   22.813   78.929   6.2834   79.937   6.9195 -1.007957 9.346656 
1 1 1    1   25   31 o   34.574   8.8550   23.026   17.749   3.0087   24.926   43.617   25.281   27.288   11.868   41.860   13.146 -14.57128 17.71002 
1 1 1    1   25   32 o   43.229   7.4142   44.632   13.469   60.198   19.306   29.867   18.801   50.983   9.5314   35.474   11.359 15.50946 14.82831 
1 1 1    1   25   33 o   36.085   7.4644   29.501   13.553   7.8066   19.157   51.241   19.177   25.893   10.796   46.276   10.311 -20.38299 14.92885 
1 1 1    1   25   34 o   22.179   7.1385  -6.7347   14.374  -3.0606   20.511 -10.2808   20.150   23.134   10.375   21.225   9.8078 1.908695 14.27710 
1 1 1    1   25   35 o   64.372   5.6737   93.773   15.020  102.260   21.394   85.523   21.092   67.480   7.6869   61.264   8.3472 6.215649 11.34745 
1 1 1    1   25   36 o   74.909   5.2364  125.385   16.116  111.938   21.902  141.266   23.801   70.444   7.5382   79.374   7.2703 -8.929817 10.47287 
1 1 1    1   25   37 o   58.674   6.2014   81.380   14.999   77.828   20.978   85.095   21.453   57.269   8.8812   60.079   8.6576 -2.810165 12.40277 
1 1 1    1   25   38 o   35.641   8.2418   34.341   13.992   31.192   19.665   37.569   19.912   34.119   11.646   37.162   11.666 -3.043194 16.48366 
1 1 1    1   25   39 o   25.794   8.0869   7.1167   17.152   10.602   24.147   3.5684   24.366   26.625   11.628   24.962   11.242 1.663256 16.17380 
1 1 1    1   25   40 o   42.271   8.0069   51.941   15.177   67.915   20.722   33.460   22.290   50.830   10.238   33.712   12.313 17.11879 16.01389 
1 1 1    1   25   41 o   28.577   7.8865   17.665   15.216  -4.1669   21.519   39.497   21.519   21.549   10.019   35.605   12.182 -14.05610 15.77291 
1 1 1    1   25   42 o   42.499   8.5155   55.993   15.614   54.669   22.165   57.298   21.999   41.805   12.138   43.194   11.946 -1.388744 17.03098 
1 1 1    1   26    0 o   74.063   2.0357  113.709   8.7640  113.709   8.7640  113.709   8.7640   74.063   2.8789   74.063   2.8789 0.000000 0.000000 
1 1 1    1   26    1 o  190.676   3.1440  743.401   18.338  765.380   45.485  739.135   20.038  192.135   5.7398  189.217   2.5676 2.917786 6.287961 
1 1 1    1   26    2 o  153.127   3.4590  488.263   21.237  473.058   34.032  497.961   27.177  151.089   5.4611  155.164   4.2467 -4.074509 6.917975 
1 1 1    1   26    3 o  163.462   3.0551  552.369   20.585  543.601   28.535  561.883   29.724  162.116   4.2676  164.807   4.3729 -2.691238 6.110241 
1 1 1    1   26    4 o  178.208   4.5291  657.128   33.290   0.0000   0.0000  657.128   33.290  ?   ?   178.208   4.5291      ?      ? 
1 1 1    1   26    5 o  171.678   4.2013  615.371   27.152  621.359   32.446  601.380   49.596  173.288   4.5397  170.069   7.0706 3.218323 8.402563 
1 1 1    1   26    6 o  144.839   3.4051  432.631   20.301  406.576   27.691  462.910   29.852  140.144   4.7906  149.533   4.8402 -9.388321 6.810152 
1 1 1    1   26    7 o  126.199   3.5679  329.658   18.557  325.238   25.667  334.499   26.859  125.322   4.9657  127.076   5.1247 -1.754517 7.135878 
1 1 1    1   26    8 o  165.580   3.4614  567.770   23.636  578.369   33.495  557.256   33.359  167.124   4.8593  164.036   4.9307 3.088730 6.922804 
1 1 1    1   26    9 o   88.344   4.6223  162.087   16.828  159.897   23.263  164.492   24.373   87.729   6.4292   88.958   6.6429 -1.229477 9.244556 
1 1 1    1   26   10 o  255.638   4.3999  1368.49   45.131  1306.56   71.862  1408.82   57.995  250.599   6.9528  260.677   5.3941 -10.07832 8.799842 
1 1 1    1   26   11 o   68.849   6.0496   98.124   17.074   84.620   23.006  114.678   25.473   63.604   8.7700   74.094   8.3354 -10.49024 12.09928 
1 1 1    1   26   12 o  132.357   4.0772  362.074   22.207  332.172   30.372  396.423   32.552  126.501   5.8212  138.212   5.7104 -11.71071 8.154442 
1 1 1    1   26   13 o  123.553   7.0745  320.827   35.927  285.714   49.740  359.125   51.947  116.406   10.360  130.701   9.6365 -14.29417 14.14904 
1 1 1    1   26   14 o  184.945   3.8311  709.594   29.208  696.544   40.526  723.701   42.134  183.188   5.3638  186.701   5.4717 -3.512375 7.662198 
1 1 1    1   26   15 o   46.110   9.0432   47.209   17.884   52.324   24.446   41.320   26.230   48.576   12.214   43.644   13.339 4.932091 18.08640 
1 1 1    1   26   16 o  136.160   4.4447  386.954   24.902  416.473   35.170  357.279   35.263  141.433   6.0292  130.888   6.5321 10.54439 8.889310 
1 1 1    1   26   17 o   67.335   7.2056   96.252   20.001   95.135   27.770   97.456   28.831   66.955   10.056   67.715   10.323 -0.7605896 14.41127 
1 1 1    1   26   18 f   53.252   7.9170   80.944   8.4685   83.736   8.7266   35.810   35.082   63.617   3.3259   42.888   15.481 20.72843 15.83404 
1 1 1    1   26   19 o   97.741   2.2592  197.859   9.1002  191.838   12.995  203.654   12.748   96.272   3.2727   99.209   3.1155 -2.937752 4.518483 
1 1 1    1   26   20 o   74.869   2.4916  116.457   7.6756  110.185   11.030  122.345   10.688   72.894   3.6689   76.844   3.3721 -3.949997 4.983148 
1 1 1    1   26   21 o  115.068   2.7515  274.929   12.631  274.976   15.958  274.850   20.666  115.180   3.3592  114.955   4.3588 0.2250595 5.503047 
1 1 1    1   26   22 o  124.571   3.1546  323.107   16.203  333.651   23.203  313.071   22.637  126.558   4.4452  122.584   4.4773 3.974152 6.309196 
1 1 1    1   26   23 o  101.284   2.4358  212.873   10.168  216.302   14.711  209.736   14.069  102.054   3.4951  100.513   3.3938 1.540588 4.871665 
1 1 1    1   26   24 o   31.463   4.8075   21.789   6.0446   20.881   8.8716   22.576   8.2580   30.773   7.1296   32.154   6.4513 -1.381283 9.615093 
1 1 1    1   26   25 f  123.508   3.3288  319.256   16.957  320.190   24.063  318.335   23.899  123.684   4.7171  123.332   4.6982 0.3515015 6.657637 
1 1 1    1   26   26 o   57.655   4.3750   71.042   8.9423   71.436   10.323   69.857   17.901   58.426   4.2837   56.885   7.6298 1.541279 8.750027 
1 1 1    1   26   27 o   26.878   6.3414   12.448   6.7887   10.258   7.5138   22.181   15.839   22.096   7.1909   31.659   10.447 -9.563757 12.68281 
1 1 1    1   26   28 o   32.029   7.4663   22.659   11.545   18.439   16.284   26.924   16.371   29.787   10.570   34.272   10.548 -4.484659 14.93259 
1 1 1    1   26   29 o   52.694   5.5750   58.871   9.8930   56.855   11.228   65.869   20.919   51.853   5.2500   53.535   9.8365 -1.682472 11.14990 
1 1 1    1   26   30 o   49.408   6.5056   55.180   12.948   47.966   17.689   63.508   19.005   45.341   9.7488   53.476   8.6170 -8.134239 13.01122 
1 1 1    1   26   31 o   31.766   7.6701   22.675   12.313   16.322   17.704   28.628   17.137   28.789   10.886   34.744   10.809 -5.955017 15.34019 
1 1 1    1   26   32 o   30.869   8.7586   16.533   17.210   9.1326   24.021   24.337   24.669   28.274   11.956   33.465   12.802 -5.191055 17.51727 
1 1 1    1   26   33 o   27.387   7.2210   8.8560   12.934 -12.9589   18.274   30.755   18.310   19.487   9.1175   35.287   11.200 -15.79907 14.44206 
1 1 1    1   26   34 o   27.284   7.9253   12.153   14.309   11.290   20.233   13.016   20.240   26.983   11.159   27.585   11.257 -0.6018486 15.85056 
1 1 1    1   26   35 o   21.244   6.8390  -5.0405   13.180  -6.3690   18.771  -3.7487   18.510   20.990   9.6138   21.499   9.7295 -0.5091877 13.67805 
1 1 1    1   26   36 o   32.263   8.5699   26.490   15.603   21.182   22.073   31.791   22.059   30.179   11.947   34.347   12.290 -4.168060 17.13981 
1 1 1    1   26   37 o   23.859   7.4706   2.4947   14.644   7.1642   20.571  -2.3030   20.852   25.060   10.840   22.657   10.283 2.403057 14.94114 
1 1 1    1   26   38 o   32.462   8.1498   28.517   13.958   20.985   19.445   36.524   20.048   29.039   11.297   35.884   11.749 -6.844889 16.29970 
1 1 1    1   26   39 o   22.726   7.1882   2.2154   13.847   5.5452   19.829  -0.9538   19.345   23.677   10.433   21.776   9.8912 1.901148 14.37635 
1 1 1    1   26   40 o   22.227   7.1741   0.3549   14.617  -0.0699   20.718   0.7760   20.626   22.144   10.127   22.310   10.164 -0.1653576 14.34823 
1 1 1    1   26   41 o   19.313   6.5402 -14.1014   14.868 -17.8408   20.832 -10.2191   21.226   18.589   8.9798   20.037   9.5111 -1.448294 13.08038 
1 1 1    1   27    0 o  210.388   2.3808  914.437   29.200  914.437   29.200  914.437   29.200  210.388   3.3670  210.388   3.3670 0.000000 0.000000 
1 1 1    1   27    1 o   56.620   3.5543   73.902   6.4540   54.588   13.759   79.350   7.3079   51.254   6.5086   61.985   2.8585 -10.73079 7.108686 
1 1 1    1   27    2 o  160.425   3.5067  527.919   22.352  552.195   37.336  514.359   27.905  163.182   5.5474  157.668   4.2912 5.514343 7.013381 
1 1 1    1   27    3 o   60.138   6.6681   77.048   13.646   76.934   27.848   77.084   15.655   59.352   11.792   60.924   6.2300 -1.571396 13.33615 
1 1 1    1   27    4 o  142.813   5.2208  424.472   30.714  418.441   42.276  431.214   44.697  141.768   7.2302  143.858   7.5333 -2.089172 10.44156 
1 1 1    1   27    5 o  114.372   6.1155  271.619   28.848  271.619   28.848   0.0000   0.0000  114.372   6.1155  ?   ?       ?      ? 
1 1 1    1   27    6 o  108.763   4.5775  245.167   20.479  237.116   27.790  254.735   30.296  106.836   6.3067  110.690   6.6361 -3.854599 9.154931 
1 1 1    1   27    7 o   79.456   4.5745  130.744   14.953  118.392   20.527  144.706   21.825   75.461   6.5954   83.452   6.3408 -7.991165 9.149079 
1 1 1    1   27    8 o  110.012   3.9447  251.336   17.837  278.279   25.442  225.293   25.013  115.845   5.3249  104.179   5.8213 11.66634 7.889356 
1 1 1    1   27    9 o   94.778   5.2351  194.694   19.515  219.374   25.195  157.686   30.853  102.769   5.9441   86.787   8.6193 15.98199 10.47022 
1 1 1    1   27   10 o  137.272   3.9562  391.228   22.389  375.982   31.495  406.804   31.835  134.555   5.6751  139.989   5.5137 -5.433899 7.912492 
1 1 1    1   27   11 o   63.839   6.7697   86.186   17.204   69.377   23.291  106.373   25.524   56.475   10.382   71.204   8.6910 -14.72941 13.53930 
1 1 1    1   27   12 o  160.287   3.9055  533.755   25.818  541.061   36.558  526.485   36.466  161.388   5.4921  159.186   5.5541 2.201828 7.810976 
1 1 1    1   27   13 o   36.103   10.966 -10.5309   31.517   26.090   44.578 -47.1296   44.565   42.854   16.974   29.351   13.888 13.50331 21.93184 
1 1 1    1   27   14 o  175.971   3.9048  644.006   28.337  646.350   40.418  641.740   39.741  176.276   5.5592  175.666   5.4851 0.6097412 7.809668 
1 1 1    1   27   15 o   78.081   5.9552  127.855   19.141  119.780   26.129  137.207   28.119   75.435   8.3983   80.727   8.4454 -5.292168 11.91033 
1 1 1    1   27   16 o   39.482   9.4322   32.281   18.277   35.067   25.326   29.253   26.404   40.570   13.202   38.393   13.475 2.177464 18.86433 
1 1 1    1   27   17 o  115.437   4.7554  279.664   22.595  285.650   31.191  273.054   32.777  116.807   6.4743  114.068   6.9669 2.739311 9.510760 
1 1 1    1   27   18 o   41.908   10.142   36.017   22.278   53.179   30.467   16.297   32.659   48.191   14.298   35.626   14.386 12.56530 20.28302 
1 1 1    1   27   19 f   48.140   7.0516   41.205   8.0043   39.288   8.3276   64.462   29.009   43.436   4.6484   52.845   13.315 -9.409439 14.10319 
1 1 1    1   27   20 o  125.897   2.2323  328.502   11.591  330.365   16.495  326.685   16.291  126.248   3.1679  125.547   3.1460 0.7005920 4.464686 
1 1 1    1   27   21 o   71.816   2.5718  107.479   7.5945  100.957   10.938  113.551   10.553   69.680   3.8058   73.951   3.4600 -4.271408 5.143509 
1 1 1    1   27   22 o   48.368   3.7859   48.781   7.0477   48.274   8.5345   49.867   12.496   48.119   4.3003   48.616   6.2321 -0.4976082 7.571743 
1 1 1    1   27   23 o   81.464   3.1767  141.678   10.098  149.037   12.603  128.479   16.878   84.666   3.6090   78.262   5.2289 6.404236 6.353456 
1 1 1    1   27   24 o   91.007   2.4732  172.550   9.2709  162.142   13.096  183.006   13.126   88.229   3.5989   93.785   3.3934 -5.556480 4.946410 
1 1 1    1   27   25 o   39.689   3.8073   33.562   6.1709   37.283   8.5145   29.445   8.9562   42.106   4.9028   37.271   5.8261 4.834850 7.614556 
1 1 1    1   27   26 o   67.715   2.8955   96.114   8.0659   92.394   11.689   99.496   11.144   66.420   4.2669   69.010   3.9154 -2.589264 5.791058 
1 1 1    1   27   27 o   40.645   5.6179   40.136   8.0172   44.234   9.3811   29.035   15.440   45.833   4.9626   35.458   10.081 10.37440 11.23587 
1 1 1    1   27   28 o   22.809   6.0910   5.9905   6.5231   3.2516   7.2594   17.475   14.865   16.913   6.7992   28.705   10.108 -11.79251 12.18193 
1 1 1    1   27   29 o   44.886   7.3318   48.140   13.431   58.265   18.810   37.608   19.185   50.263   9.4194   39.510   11.238 10.75317 14.66359 
1 1 1    1   27   30 o   44.615   6.0587   49.586   9.3403   54.299   10.877   36.348   18.229   50.523   5.2196   38.707   10.935 11.81652 12.11730 
1 1 1    1   27   31 o   37.795   6.3819   33.908   8.7492   34.988   9.9214   30.131   18.555   40.318   5.9663   35.273   11.283 5.045425 12.76376 
1 1 1    1   27   32 o   45.754   6.0673   49.908   10.035   52.168   11.944   44.485   18.502   49.092   5.8988   42.416   10.604 6.676521 12.13468 
1 1 1    1   27   33 o   46.636   9.0097   59.162   16.289   60.508   18.356   54.177   35.332   50.484   9.1526   42.788   15.522 7.696087 18.01942 
1 1 1    1   27   34 o   33.862   7.7037   27.992   12.951   15.398   17.870   41.927   18.797   27.439   10.786   40.284   11.003 -12.84462 15.40731 
1 1 1    1   27   35 o   37.701   7.6015   37.037   13.352   53.294   18.892   20.811   18.874   45.824   10.252   29.577   11.226 16.24628 15.20306 
1 1 1    1   27   36 o   37.173   8.5335   38.076   15.597   50.296   22.058   25.859   22.056   42.630   12.024   31.716   12.112 10.91364 17.06705 
1 1 1    1   27   37 o   21.339   6.8445  -2.0402   13.106   2.2660   18.583  -6.3017   18.486   22.440   9.9828   20.238   9.3667 2.202438 13.68910 
1 1 1    1   27   38 o   19.854   6.5513  -8.5521   13.282 -14.4963   18.693  -2.4927   18.874   18.537   8.8348   21.172   9.6760 -2.635433 13.10265 
1 1 1    1   27   39 o   30.420   7.9776   26.347   13.464   31.741   19.125   21.048   18.957   32.713   11.469   28.127   11.092 4.586109 15.95514 
1 1 1    1   27   40 o   31.565   9.0833   28.591   20.240   3.9412   28.226   54.680   29.038   24.839   11.524   38.291   14.044 -13.45201 18.16656 
1 1 1    1   28    0 o   64.418   1.8940   86.081   7.0885   86.081   7.0885   86.081   7.0885   64.418   2.6785   64.418   2.6785 0.000000 0.000000 
1 1 1    1   28    1 o  187.223   5.6452  727.646   43.591  727.646   43.591   0.0000   0.0000  187.223   5.6452  ?   ?       ?      ? 
1 1 1    1   28    2 o   60.300   3.4089   72.801   7.6231   81.192   14.737   69.735   8.9075   62.533   5.7139   58.067   3.7193 4.465679 6.817739 
1 1 1    1   28    3 o  203.240   3.1825  855.152   26.667  843.377   37.111  867.724   38.345  201.802   4.4587  204.678   4.5422 -2.875809 6.364906 
1 1 1    1   28    4 o  108.810   3.3898  245.385   15.185  245.442   20.862  245.321   22.146  108.840   4.6473  108.780   4.9361 0.5952454E-01 6.779546 
1 1 1    1   28    5 o  232.370   4.3467  1116.60   38.186  1107.20   45.573  1138.75   69.961  231.122   4.7808  233.617   7.2608 -2.495621 8.693421 
1 1 1    1   28    6 o  119.570   3.5995  296.359   17.731  291.959   24.417  301.267   25.790  118.646   4.9897  120.495   5.1894 -1.848587 7.199065 
1 1 1    1   28    7 o  109.404   3.8070  247.214   17.130  230.818   23.192  266.894   25.409  105.441   5.3330  113.367   5.4343 -7.926399 7.613942 
1 1 1    1   28    8 o   43.759   7.5221   41.257   13.876   25.445   18.866   59.890   20.480   35.046   11.394   52.473   9.8240 -17.42796 15.04425 
1 1 1    1   28    9 o  119.268   5.0679  297.905   24.869  311.408   34.538  283.365   35.839  122.148   6.8555  116.389   7.4658 5.758858 10.13590 
1 1 1    1   28   10 o   76.473   8.2897  126.045   22.328  128.498   43.411  125.162   26.035   75.741   14.423   77.205   8.1762 -1.463997 16.57935 
1 1 1    1   28   11 o  114.368   7.7069  277.690   36.260  252.533   49.602  306.563   53.139  108.774   11.056  119.961   10.740 -11.18712 15.41388 
1 1 1    1   28   12 o   33.360   13.414   12.992   28.261   12.992   28.261   0.0000   0.0000   33.360   13.414  ?   ?       ?      ? 
1 1 1    1   28   13 o  138.863   7.3903  404.346   42.327  404.346   42.327   0.0000   0.0000  138.863   7.3903  ?   ?       ?      ? 
1 1 1    1   28   14 o   72.384   6.6249  111.975   19.524  133.367   27.817   91.204   27.411   79.430   8.4911   65.338   10.172 14.09143 13.24985 
1 1 1    1   28   15 o  142.419   6.1400  424.560   36.066   0.0000   0.0000  424.560   36.066  ?   ?   142.419   6.1400      ?      ? 
1 1 1    1   28   16 f   71.146   6.6672  108.397   19.549  102.948   27.491  113.969   27.803   69.284   9.6206   73.009   9.2331 -3.724976 13.33440 
1 1 1    1   28   17 o   70.562   6.7623  107.953   19.494  120.599   27.058   94.303   28.111   75.137   8.7312   65.988   10.329 9.149475 13.52459 
1 1 1    1   28   18 o   36.335   9.6270   23.366   20.224   9.0868   29.463   36.089   27.811   32.041   13.376   40.629   13.849 -8.587311 19.25393 
1 1 1    1   28   19 o   81.863   6.5529  148.062   21.524  179.712   29.831  113.688   31.088   91.720   7.8857   72.006   10.468 19.71341 13.10577 
1 1 1    1   28   20 o   31.250   8.9994   9.3662   18.809  -3.3548   26.061   23.197   27.174   27.082   11.945   35.417   13.463 -8.335491 17.99883 
1 1 1    1   28   21 o   58.647   2.4839   71.316   5.9876   73.309   8.8928   69.662   8.0983   59.380   3.6311   57.914   3.3903 1.465637 4.967788 
1 1 1    1   28   22 o   55.728   2.6796   65.129   6.1211   59.247   8.8731   70.470   8.4551   53.273   4.0384   58.184   3.5233 -4.911499 5.359288 
1 1 1    1   28   23 o   67.605   3.1678   95.760   8.3774   95.697   10.331   95.880   14.315   67.745   3.6975   67.464   5.1446 0.2818832 6.335519 
1 1 1    1   28   24 o   83.285   3.5737  146.238   12.267  141.099   17.446  151.264   17.252   81.796   5.1712   84.775   4.9339 -2.979393 7.147373 
1 1 1    1   28   25 o   38.196   3.5629   30.874   5.5861   28.363   8.0571   33.199   7.7517   36.645   5.3308   39.747   4.7286 -3.101772 7.125816 
1 1 1    1   28   26 o   73.456   3.0560  113.878   9.1305  117.782   12.084  108.683   13.939   75.047   3.9040   71.865   4.7026 3.182007 6.111981 
1 1 1    1   28   27 o   45.545   3.4027   43.720   6.2902   54.734   9.2002   34.052   8.6194   51.015   4.3726   40.074   5.2149 10.94063 6.805468 
1 1 1    1   28   28 o   71.539   2.8222  107.231   8.3221  111.619   12.015  103.183   11.538   72.944   3.9935   70.135   3.9888 2.809303 5.644361 
1 1 1    1   28   29 o   32.756   4.5943   23.797   6.0725   20.959   8.7574   26.426   8.4277   30.417   7.1085   35.095   5.8223 -4.678034 9.188564 
1 1 1    1   28   30 o   28.474   7.5126   15.778   11.977   23.697   18.017   9.5080   16.033   31.930   11.135   25.017   10.088 6.913019 15.02526 
1 1 1    1   28   31 o   18.830   5.4686   3.1475   7.2623   9.1032   8.0741 -22.0810   16.618   21.085   7.4468   16.576   8.0104 4.509676 10.93712 
1 1 1    1   28   32 o   37.563   5.9774   39.799   8.9580   48.570   10.461   15.684   17.345   47.473   5.3428   27.653   10.694 19.82013 11.95472 
1 1 1    1   28   33 o   33.037   6.0929   31.165   9.9746   41.070   11.397  -1.2390   20.615   43.048   6.4193   23.025   10.358 20.02333 12.18578 
1 1 1    1   28   34 o   23.092   6.3341   10.581   8.1326   12.971   9.1288   1.3851   17.904   23.841   7.9343   22.343   9.8756 1.498747 12.66811 
1 1 1    1   28   35 o   24.540   5.6956   13.484   8.9150   24.360   10.053 -26.5547   19.289   31.908   7.7222   17.172   8.3742 14.73641 11.39124 
1 1 1    1   28   36 o   37.869   7.4490   37.252   13.449   16.603   18.199   62.100   19.964   27.028   10.801   48.709   10.261 -21.68123 14.89798 
1 1 1    1   28   37 o   47.343   7.4749   60.093   14.183   58.170   19.202   62.401   21.040   46.861   10.223   47.824   10.908 -0.9629288 14.94983 
1 1 1    1   28   38 o   24.501   8.0364   0.9096   19.422  -4.9393   26.986   7.1948   27.974   23.256   10.944   25.746   11.772 -2.489624 16.07276 
1 1 1    1   28   39 o   33.034   10.121   41.486   25.716   49.009   35.384   33.064   37.438   34.847   14.611   31.222   14.009 3.624445 20.24198 
1 1 1    1   29    0 o   53.871   1.9450   60.374   6.0754   60.374   6.0754   60.374   6.0754   53.871   2.7507   53.871   2.7507 0.000000 0.000000 
1 1 1    1   29    1 o   46.631   3.5142   45.914   6.0845   43.312   11.267   46.986   7.2294   45.614   5.9888   47.648   3.6787 -2.034042 7.028381 
1 1 1    1   29    2 o   29.797   5.0274   20.885   5.8348   12.744   11.205   23.914   6.8346   25.648   8.7904   33.946   4.8816 -8.297831 10.05490 
1 1 1    1   29    3 o   25.842   5.3342   12.129   5.5477   20.209   10.805   9.2372   6.4648   30.528   8.3437   21.155   6.6482 9.372992 10.66840 
1 1 1    1   29    4 o   66.897   4.1475   93.710   11.375  101.535   15.734   85.142   16.463   69.882   5.4591   63.912   6.2454 5.969780 8.294971 
1 1 1    1   29    5 o   65.941   7.1116   90.505   14.739   88.607   16.348   98.752   34.079   65.211   6.0781   66.671   12.859 -1.459282 14.22324 
1 1 1    1   29    6 o   40.478   6.8191   36.323   11.226   39.715   15.216   32.272   16.631   42.637   8.9383   38.319   10.301 4.317455 13.63822 
1 1 1    1   29    7 o   70.562   4.7711  103.588   13.851   97.552   18.803  110.748   20.482   68.335   6.6714   72.789   6.8224 -4.453934 9.542211 
1 1 1    1   29    8 o  112.640   3.8485  263.473   17.856  255.167   24.500  272.881   26.077  110.764   5.3630  114.515   5.5211 -3.751183 7.696981 
1 1 1    1   29    9 o   60.235   7.2226   78.290   17.557   78.960   24.362   77.566   25.325   61.005   9.6823   59.466   10.720 1.539070 14.44525 
1 1 1    1   29   10 o   74.230   5.5065  115.846   16.833  114.747   23.127  117.085   24.546   73.893   7.5885   74.568   7.9812 -0.6749573 11.01290 
1 1 1    1   29   11 o  102.185   4.5714  218.543   19.261  212.466   26.889  224.947   27.605  100.725   6.4724  103.644   6.4576 -2.919800 9.142892 
1 1 1    1   29   12 o   57.512   9.6967   84.933   22.122   45.338   42.903   99.273   25.819   46.805   17.085   68.219   9.1764 -21.41377 19.39339 
1 1 1    1   29   13 o   76.842   6.1046  128.353   18.674  165.384   26.374   91.126   26.444   88.560   7.2207   65.123   9.8451 23.43633 12.20916 
1 1 1    1   29   14 o   29.670   8.3765   7.9441   16.487   22.881   22.817  -8.3771   23.850   34.417   12.475   24.923   11.182 9.493988 16.75307 
1 1 1    1   29   15 o   32.122   8.8489   16.141   16.958   19.690   23.345   12.176   24.674   33.206   12.513   31.039   12.515 2.166214 17.69783 
1 1 1    1   29   16 o   47.337   9.0078   52.132   18.589   68.737   26.165   35.208   26.415   54.708   11.932   39.966   13.498 14.74181 18.01556 
1 1 1    1   29   17 o   62.993   8.8491   88.695   21.874   73.723   28.076  111.819   34.892   56.355   12.414   69.632   12.614 -13.27713 17.69813 
1 1 1    1   29   18 o   35.762   9.6268   23.443   19.687   20.005   27.325   27.153   28.388   34.379   13.387   37.144   13.838 -2.765881 19.25356 
1 1 1    1   29   19 o   69.222   10.146   97.432   25.965  167.817   50.311   71.878   30.314   83.490   15.169   54.954   13.477 28.53634 20.29146 
1 1 1    1   29   20 o   59.267   13.262   95.608   36.382  101.512   51.592   89.767   51.314   61.046   18.715   57.488   18.796 3.558708 26.52464 
1 1 1    1   29   21 o   36.595   16.422   1.0643   51.464   1.0643   51.464   0.0000   0.0000   36.595   16.422  ?   ?       ?      ? 
1 1 1    1   29   22 o   47.978   3.6999   48.018   7.3215   48.018   7.3215   0.0000   0.0000   47.978   3.6999  ?   ?       ?      ? 
1 1 1    1   29   23 o   42.743   3.1091   39.757   5.2501   28.168   7.6834   49.908   7.1907   36.555   5.0961   48.930   3.5631 -12.37489 6.218194 
1 1 1    1   29   24 o   31.622   6.0857   22.884   8.1323   20.800   12.496   24.415   10.711   30.375   9.1900   32.870   7.9804 -2.494913 12.17140 
1 1 1    1   29   25 o   79.202   2.6657  131.171   8.7031  125.174   12.165  137.458   12.456   77.335   3.8139   81.068   3.7254 -3.732994 5.331436 
1 1 1    1   29   26 o   53.654   3.0175   60.733   6.6495   55.618   9.5364   65.572   9.2767   51.391   4.4991   55.918   4.0223 -4.526241 6.035033 
1 1 1    1   29   27 o   22.396   5.0212   10.884   5.3451   13.753   7.2443   7.4562   7.9188   24.760   6.8582   20.032   7.3359 4.728189 10.04244 
1 1 1    1   29   28 o   54.601   3.3137   63.462   7.4186   57.268   10.675   69.247   10.317   51.916   4.9855   57.285   4.3666 -5.368813 6.627412 
1 1 1    1   29   29 o   30.997   4.5637   22.007   5.7492   14.589   8.3163   28.797   7.9567   25.325   7.4586   36.668   5.2611 -11.34261 9.127439 
1 1 1    1   29   30 o   32.950   4.6354   24.705   6.1308   19.707   8.9553   29.114   8.4109   29.175   7.4239   36.724   5.5530 -7.548922 9.270870 
1 1 1    1   29   31 o   20.998   5.7969   7.5301   7.4259   11.900   8.3091  -9.8087   16.551   23.099   7.5641   18.897   8.7864 4.201639 11.59381 
1 1 1    1   29   32 o   38.058   4.6317   32.817   6.9848   41.082   10.076   25.171   9.6913   43.353   5.6351   32.764   7.3523 10.58850 9.263371 
1 1 1    1   29   33 o   22.099   6.1214   9.2242   7.7005   11.624   8.6901   0.4500   16.615   22.795   7.7416   21.403   9.4844 1.391752 12.24280 
1 1 1    1   29   34 o   18.716   6.6779 -20.9440   7.5800 -23.3298   7.8530   11.593   29.000   9.0784   4.5722   28.354   12.549 -19.27519 13.35585 
1 1 1    1   29   35 o   31.682   7.1695   26.422   9.6717   27.056   10.767   23.773   22.009   33.246   7.9581   30.119   11.928 3.126587 14.33891 
1 1 1    1   29   36 o   22.527   7.6188 -15.0047   20.017 -12.2184   28.655 -17.6598   27.973   23.042   10.970   22.011   10.575 1.031284 15.23761 
1 1 1    1   29   37 o   36.320   9.6009   46.217   20.285   60.272   28.136   31.003   29.274   41.340   13.930   31.300   13.216 10.04041 19.20176 
1 1 1    1   29   38 o   24.731   8.1419   2.1434   20.303  -6.6310   28.413   11.299   29.023   23.097   10.975   26.364   12.029 -3.266773 16.28386 
1 1 1    1   30    0 o  108.946   2.3823  245.913   15.106  245.913   15.106  245.913   15.106  108.946   3.3691  108.946   3.3691 0.000000 0.000000 
1 1 1    1   30    1 o   50.518   3.2995   53.565   6.1775   51.681   11.543   54.322   7.3130   49.811   5.6184   51.226   3.4613 -1.415489 6.599051 
1 1 1    1   30    2 o  101.791   3.1347  212.230   12.296  222.875   21.918  207.342   14.853  103.520   5.1334  100.062   3.5991 3.457718 6.269378 
1 1 1    1   30    3 o   51.240   3.7777   50.285   7.2378   65.247   14.194   45.028   8.4139   55.900   6.1565   46.580   4.3796 9.319717 7.555357 
1 1 1    1   30    4 o   69.704   3.8907  100.040   11.075   82.269   14.874  122.153   16.592   62.806   5.7420   76.601   5.2517 -13.79454 7.781442 
1 1 1    1   30    5 o   60.421   6.4854   60.733   13.206   50.450   14.496  110.909   32.021   49.007   7.1717   71.835   10.808 -22.82755 12.97080 
1 1 1    1   30    6 o   43.693   6.4163   41.874   11.157   40.343   15.158   43.683   16.482   42.855   8.8683   44.532   9.2752 -1.677074 12.83265 
1 1 1    1   30    7 o   65.206   4.9298   89.366   13.222   89.001   18.033   89.792   19.444   65.107   6.7155   65.305   7.2191 -0.1983109 9.859656 
1 1 1    1   30    8 o   29.178   7.5972   15.114   12.158   18.933   16.204   10.196   18.390   30.714   10.569   27.641   10.917 3.073418 15.19449 
1 1 1    1   30    9 o  150.745   4.5379  477.042   28.206  477.903   39.452  476.142   40.342  150.917   6.3382  150.574   6.4959 0.3435974 9.075773 
1 1 1    1   30   10 f   49.704   7.7029   55.457   15.338   53.603   21.082   57.542   22.355   48.849   10.755   50.560   11.030 -1.711143 15.40587 
1 1 1    1   30   11 o  142.221   3.8418  423.468   22.509  445.656   31.767  401.096   31.898  146.023   5.2746  138.419   5.5873 7.604828 7.683683 
1 1 1    1   30   12 o   75.241   10.613  134.058   31.752  145.089   44.439  122.552   45.385   78.997   14.159   71.485   15.812 7.511360 21.22546 
1 1 1    1   30   13 o   73.279   5.8367  115.156   17.607  121.047   24.644  109.015   25.163   75.298   7.9353   71.259   8.5616 4.039261 11.67344 
1 1 1    1   30   14 o   97.028   4.8975  199.380   19.583  193.693   27.024  205.669   28.416   95.600   6.8538   98.455   6.9977 -2.854912 9.794999 
1 1 1    1   30   15 o   63.181   6.7801   86.934   17.636   91.719   24.769   82.013   25.115   65.067   9.2295   61.295   9.9346 3.772308 13.56023 
1 1 1    1   30   16 o   46.538   8.6850   50.500   16.908   51.230   23.405   49.703   24.451   46.951   12.032   46.125   12.528 0.8260536 17.37008 
1 1 1    1   30   17 o   35.338   9.4836   18.702   20.076   0.4469   26.774   42.152   30.345   28.136   12.267   42.540   14.466 -14.40417 18.96712 
1 1 1    1   30   18 o   49.594   8.9934   59.301   18.613   50.437   26.221   68.304   26.425   45.623   13.189   53.565   12.230 -7.942078 17.98687 
1 1 1    1   30   19 o   92.238   5.5232  183.942   20.931  163.262   29.023  206.355   30.215   86.666   8.1195   97.809   7.4898 -11.14320 11.04648 
1 1 1    1   30   20 o   40.540   11.789   20.616   33.284   61.136   50.109 -11.3757   44.525   48.701   18.337   32.380   14.822 16.32092 23.57808 
1 1 1    1   30   21 o  103.775   5.2629  232.591   22.524  228.903   31.819  236.295   31.889  102.917   7.4961  104.633   7.3894 -1.716179 10.52588 
1 1 1    1   30   22 o   49.211   9.4855   59.952   19.779   60.576   27.818   59.314   28.128   49.513   13.327   48.908   13.501 0.6051064 18.97103 
1 1 1    1   30   23 o   51.527   9.3804   66.713   20.060   64.984   28.231   68.476   28.509   50.809   13.312   52.245   13.220 -1.436722 18.76081 
1 1 1    1   30   24 o   60.770   2.5098   77.474   6.2609   72.719   9.1211   81.710   8.6096   58.953   3.7512   62.586   3.3354 -3.632923 5.019594 
1 1 1    1   30   25 o   50.214   4.0754   57.692   7.1701   46.344   13.750   61.929   8.4030   46.059   7.2383   54.370   3.7472 -8.310345 8.150747 
1 1 1    1   30   26 o   17.932   4.3787   5.7726   4.3241   0.4566   6.4478   10.118   5.8292   14.457   6.1573   21.407   6.2274 -6.949749 8.757483 
1 1 1    1   30   27 f   45.675   3.3506   44.911   6.2153   37.821   9.0532   51.232   8.5480   42.077   5.2166   49.272   4.2063 -7.194401 6.701177 
1 1 1    1   30   28 o   28.745   4.8949   18.356   5.9155   11.311   7.9257   27.216   8.8883   22.671   7.3857   34.820   6.4258 -12.14954 9.789768 
1 1 1    1   30   29 o   16.801   4.7510   3.3904   5.0848   0.7439   7.2933   5.8933   7.0928   15.323   6.5380   18.279   6.8952 -2.955688 9.502093 
1 1 1    1   30   30 o   15.058   4.5836   0.2242   5.1674   1.6572   7.4495  -1.1047   7.1739   15.877   6.6832   14.239   6.2747 1.638123 9.167212 
1 1 1    1   30   31 o   44.257   3.8220   42.697   6.9656   41.382   10.022   43.926   9.6883   43.518   5.5836   44.995   5.2205 -1.477280 7.643941 
1 1 1    1   30   32 o   21.724   6.1012   8.5574   7.6682   10.885   8.6202  -0.2697   16.786   22.222   7.7048   21.227   9.4622 0.9958992 12.20241 
1 1 1    1   30   33 o   41.605   10.220   56.773   21.455   57.445   30.445   56.110   30.241   41.821   14.481   41.388   14.427 0.4331055 20.44071 
1 1 1    1   30   34 o   19.070   6.7020 -48.0146   20.486 -52.2377   29.417 -44.0381   28.545   18.862   9.4036   19.277   9.5518 -0.4153194 13.40391 
1 1 1    1   30   35 o   22.280   7.5538 -15.5567   19.971 -18.4416   28.725 -12.8578   27.784   22.043   10.623   22.517   10.743 -0.4732628 15.10768 
1 1 1    1   30   36 o   26.128   8.3458   4.4306   20.297 -20.7547   28.522   30.272   28.891   21.298   10.340   30.958   13.103 -9.659897 16.69162 
1 1 1    1   31    1 o   59.552   3.4559   73.528   8.4884   0.0000   0.0000   73.528   8.4884  ?   ?    59.552   3.4559      ?      ? 
1 1 1    1   31    2 o   28.527   4.8794   17.830   5.2525   17.061   10.004   18.122   6.1716   28.041   8.1584   29.013   5.3548 -0.9719448 9.758748 
1 1 1    1   31    3 o  111.159   3.4883  256.335   15.739  265.013   24.722  250.422   20.409  112.632   5.3218  109.686   4.5113 2.946350 6.976611 
1 1 1    1   31    4 o   96.491   3.3941  194.477   13.478  206.286   18.891  182.236   19.234   99.522   4.6023   93.460   4.9897 6.061714 6.788137 
1 1 1    1   31    5 o   89.737   5.5310  178.699   16.836  185.405   19.243  156.805   34.769   94.263   4.9495   85.211   9.8931 9.052444 11.06210 
1 1 1    1   31    6 o   80.404   3.9709  134.903   13.142  127.208   17.912  143.875   19.341   77.940   5.5722   82.869   5.6589 -4.928795 7.941814 
1 1 1    1   31    7 o   78.721   4.2488  130.441   13.765  135.626   19.114  124.854   19.840   80.407   5.7635   77.035   6.2443 3.372696 8.497634 
1 1 1    1   31    8 o   82.895   4.3401  144.319   14.823  138.543   20.396  150.784   21.580   81.152   6.0936   84.637   6.1819 -3.484871 8.680278 
1 1 1    1   31    9 o   31.123   8.0018   17.042   14.149   28.454   19.210   3.5120   20.917   35.903   11.480   26.343   11.150 9.559568 16.00356 
1 1 1    1   31   10 o  119.167   4.0304  299.099   19.763  316.246   27.630  281.135   28.280  122.765   5.4567  115.569   5.9329 7.196167 8.060758 
1 1 1    1   31   11 o   53.362   7.2346   62.657   15.538   50.998   20.951   76.904   23.161   47.214   10.969   59.509   9.4365 -12.29491 14.46916 
1 1 1    1   31   12 o   48.097   11.844   52.923   29.411   69.990   42.202   36.808   41.009   53.317   17.013   42.877   16.482 10.43981 23.68719 
1 1 1    1   31   13 o   29.139   8.1196   9.4025   15.342   23.846   21.408  -5.8499   21.999   34.049   12.115   24.228   10.814 9.820736 16.23918 
1 1 1    1   31   14 o   45.662   8.7000   49.247   16.792   53.444   23.799   45.087   23.695   47.626   12.094   43.699   12.510 3.927177 17.40003 
1 1 1    1   31   15 o   23.344   7.4187 -13.8287   15.899 -34.0427   22.359   6.8450   22.612   18.865   9.1581   27.822   11.674 -8.957138 14.83739 
1 1 1    1   31   16 o   35.239   8.2230   22.137   16.661   50.292   23.322  -7.2096   23.810   45.868   12.139   24.611   11.096 21.25666 16.44594 
1 1 1    1   31   17 o   50.426   9.8160   63.020   21.059   63.163   30.109   62.884   29.464   50.430   13.986   50.423   13.777 0.7244110E-02 19.63206 
1 1 1    1   31   18 o   28.275   8.4797   5.8006   17.262   0.4988   24.154   11.335   24.678   26.611   11.625   29.939   12.348 -3.327753 16.95930 
1 1 1    1   31   19 o   51.676   8.8161   64.888   18.663   56.022   27.072   72.917   25.762   47.786   13.266   55.565   11.615 -7.778545 17.63222 
1 1 1    1   31   20 o   50.145   12.878   68.442   34.867   55.866   51.625   78.990   47.280   46.934   18.367   53.357   18.058 -6.423252 25.75697 
1 1 1    1   31   21 o   32.548   8.8176   16.249   18.126   38.031   25.872  -4.7467   25.401   39.478   13.358   25.618   11.513 13.85995 17.63513 
1 1 1    1   31   22 o   59.154   8.2449   83.839   19.647  103.312   28.120   65.268   27.461   67.280   10.134   51.029   13.009 16.25132 16.48990 
1 1 1    1   31   23 o   31.595   9.0465   16.068   18.838   26.704   26.046   4.4012   27.279   34.785   13.191   28.406   12.384 6.378546 18.09299 
1 1 1    1   31   24 o   43.144   9.7131   48.526   19.464   49.419   27.216   47.591   27.847   43.564   13.633   42.724   13.839 0.8403206 19.42622 
1 1 1    1   31   25 o   42.969   6.2259   68.198   8.1863   74.797   8.5375  -7.0820   28.838   59.767   3.4634   26.171   11.961 33.59602 12.45187 
1 1 1    1   31   26 o   45.496   2.9280   44.036   5.4404   41.247   8.1215   46.305   7.3274   44.091   4.4660   46.901   3.7880 -2.810093 5.856094 
1 1 1    1   31   27 o   52.921   3.8267   58.475   7.8578   54.994   9.4953   66.039   13.997   50.844   4.5280   54.999   6.1703 -4.155670 7.653443 
1 1 1    1   31   28 f   28.017   4.6510   18.219   5.3102   14.922   7.8168   21.044   7.2362   25.427   7.1531   30.607   5.9465 -5.180134 9.301983 
1 1 1    1   31   29 o   39.007   4.5869   34.278   7.0805   43.132   10.301   26.350   9.7483   44.424   5.6223   33.590   7.2491 10.83454 9.173831 
1 1 1    1   31   30 o   32.867   9.3576   26.891   19.753   34.579   27.513   18.712   28.377   35.243   13.511   30.492   12.950 4.750996 18.71524 
1 1 1    1   31   31 o   25.607   8.1889  -0.6050   19.026   14.535   26.901 -15.7570   26.912   28.697   12.404   22.517   10.694 6.180214 16.37788 
1 1 1    1   31   32 o   31.847   9.3355   27.644   20.078   25.405   27.789   30.091   29.042   31.147   12.995   32.548   13.406 -1.401726 18.67103 
1 1 1    1   31   33 o   33.176   9.9291   33.028   23.195   39.627   35.824   28.265   30.435   34.597   14.614   31.755   13.445 2.842323 19.85826 
1 1 1    1   31   34 o   32.208   10.572   31.639   34.096   48.378   47.602   14.002   48.863   34.522   15.615   29.894   14.258 4.628027 21.14489 
1 1 1    1   31   35 o   20.089   6.9374 -25.8538   18.937 -36.0012   26.655 -15.5130   26.908   18.795   9.2982   21.382   10.298 -2.586821 13.87472 
1 1 1    1   32    1 o   75.792   3.3380  119.236   10.435  119.236   10.435   0.0000   0.0000   75.792   3.3380  ?   ?       ?      ? 
1 1 1    1   32    2 o   57.410   2.5821   68.618   6.0972   74.505   8.6290   62.748   8.6165   59.892   3.4932   54.928   3.8034 4.964951 5.164134 
1 1 1    1   32    3 f   25.495   5.8481   13.523   7.1478   10.056   10.277   16.772   9.9479   23.285   8.3824   27.705   8.1570 -4.419609 11.69619 
1 1 1    1   32    4 o  167.378   5.6995  588.900   39.346  588.900   39.346   0.0000   0.0000  167.378   5.6995  ?   ?       ?      ? 
1 1 1    1   32    5 o   80.915   5.6239  139.224   15.398  138.575   17.389  141.580   33.143   81.326   5.1842   80.504   9.9818 0.8217239 11.24777 
1 1 1    1   32    6 o   90.586   3.6891  170.572   13.722  151.189   18.543  194.035   20.401   84.922   5.2940   96.250   5.1390 -11.32893 7.378108 
1 1 1    1   32    7 o   60.920   4.9180   78.836   12.332   80.901   17.056   76.574   17.851   61.821   6.6894   60.020   7.2111 1.801022 9.836092 
1 1 1    1   32    8 o   96.866   5.7839  197.420   23.108   0.0000   0.0000  197.420   23.108  ?   ?    96.866   5.7839      ?      ? 
1 1 1    1   32    9 o   87.289   5.2631  163.432   18.855  174.424   26.068  151.373   27.306   90.562   6.9791   84.017   7.8799 6.545494 10.52619 
1 1 1    1   32   10 o   31.990   8.0127   19.796   13.472   11.830   18.103   29.684   20.169   27.691   10.865   36.289   11.780 -8.597530 16.02541 
1 1 1    1   32   11 o   60.635   6.9227   84.359   16.376  102.531   22.572   64.164   23.796   68.853   7.9485   52.418   11.336 16.43540 13.84537 
1 1 1    1   32   12 o   63.975   11.275  105.063   29.735   95.258   42.078  114.844   42.026   60.506   16.435   67.443   15.441 -6.937477 22.55097 
1 1 1    1   32   13 o   37.401   7.8486   29.709   15.250   54.921   21.322   3.3040   21.821   48.481   10.925   26.321   11.272 22.15968 15.69722 
1 1 1    1   32   14 o   28.729   8.1805   8.6117   15.468  -3.4973   21.003   22.964   22.866   23.956   10.637   33.503   12.431 -9.547834 16.36101 
1 1 1    1   32   15 o   62.006   7.2618   88.283   17.832  104.416   25.039   71.679   25.402   68.906   8.8105   55.106   11.546 13.80032 14.52370 
1 1 1    1   32   16 o   78.830   6.1013  136.332   19.337  100.503   26.546  176.831   28.224   67.238   9.5725   90.422   7.5678 -23.18444 12.20267 
1 1 1    1   32   17 o   62.952   7.4152   90.305   18.845   96.481   27.305   84.686   26.042   65.531   10.102   60.374   10.857 5.156536 14.83049 
1 1 1    1   32   18 o   59.848   7.9533   86.221   18.835   56.284   26.669  116.015   26.605   47.465   13.163   72.231   8.9305 -24.76572 15.90660 
1 1 1    1   32   19 o   37.958   9.4372   33.560   18.832   45.022   26.631   22.095   26.634   42.351   13.515   33.564   13.176 8.786560 18.87434 
1 1 1    1   32   20 o   83.743   6.2787  157.084   21.600  148.504   31.312  164.872   29.834   81.207   9.3488   86.280   8.3837 -5.072876 12.55738 
1 1 1    1   32   21 o   29.871   8.8524   11.056   18.491   4.3181   25.705   18.281   26.620   27.719   12.053   32.022   12.968 -4.303032 17.70481 
1 1 1    1   32   22 o   63.780   8.1095   98.633   20.581  119.313   29.279   78.432   28.937   71.985   9.8616   55.576   12.876 16.40863 16.21890 
1 1 1    1   32   23 o   50.720   9.3035   67.018   20.095   85.509   28.914   49.740   27.949   58.183   12.427   43.257   13.849 14.92613 18.60706 
1 1 1    1   32   24 o   46.811   10.849   63.757   24.519   73.572   34.171   53.340   35.202   50.577   15.173   43.044   15.512 7.532875 21.69875 
1 1 1    1   32   25 o   55.753   9.0609   82.049   20.399   78.830   28.458   85.451   29.256   54.539   12.860   56.967   12.768 -2.427929 18.12185 
1 1 1    1   32   26 o   49.753   9.0569   67.134   20.146   37.783   27.900   99.106   29.119   37.329   13.755   62.176   11.786 -24.84714 18.11385 
1 1 1    1   32   27 o   39.232   11.486   33.499   33.421   96.946   50.670 -15.3575   44.464   49.937   18.510   28.528   13.605 21.40864 22.97204 
1 1 1    1   32   28 o   40.012   9.5184   46.612   19.406   60.581   27.025   31.742   27.883   45.690   13.442   34.333   13.480 11.35713 19.03686 
1 1 1    1   32   29 o   28.506   8.5016   10.959   18.219   30.552   25.903  -8.2233   25.631   33.597   13.048   23.414   10.902 10.18342 17.00314 
1 1 1    1   32   30 o   37.496   9.6159   43.181   19.614   54.960   28.027   31.874   27.459   41.639   13.904   33.353   13.287 8.286434 19.23181 
1 1 1    1   32   31 o   32.254   9.7513   26.194   23.896   6.6216   33.453   46.586   34.146   27.709   12.744   36.799   14.763 -9.090343 19.50254 
1 1 1    1   32   32 o   37.731   9.3040   41.793   20.478   10.587   27.970   77.848   30.065   26.904   12.087   48.557   14.148 -21.65370 18.60799 
1 1 1    1   32   33 o   22.179   7.4550 -11.4917   18.870   0.9640   26.110 -25.1102   27.302   23.976   11.109   20.382   9.9448 3.593832 14.91010 
1 1 1    1   32   34 o   23.351   7.7763  -7.1025   19.788 -26.0090   27.868   12.122   28.102   20.319   9.9426   26.382   11.960 -6.063391 15.55267 
1 1 1    1   33    2 o   16.946   3.8961   5.6603   3.2099   3.5427   4.4764   7.9018   4.6054   14.746   5.4946   19.147   5.5253 -4.401293 7.792250 
1 1 1    1   33    3 o   47.927   3.6757   47.782   6.5513   49.567   12.373   47.086   7.7227   48.342   6.2057   47.511   3.9410 0.8308716 7.351327 
1 1 1    1   33    4 o  113.208   3.1597  261.607   13.140  283.218   25.592  253.871   15.312  115.936   5.3520  110.480   3.3603 5.455879 6.319453 
1 1 1    1   33    5 o   53.609   5.0781   60.460   11.228   0.0000   0.0000   60.460   11.228  ?   ?    53.609   5.0781      ?      ? 
1 1 1    1   33    6 o   68.994   4.1939  100.414   11.894   89.967   16.238  112.512   17.473   65.103   6.0473   72.884   5.8125 -7.780807 8.387741 
1 1 1    1   33    7 o   53.158   5.5766   63.886   11.443   78.673   15.674   47.007   16.746   60.813   6.2491   45.504   9.2380 15.30935 11.15312 
1 1 1    1   33    8 o   47.327   6.3386   50.310   11.898   46.687   16.216   54.535   17.512   45.444   8.9700   49.209   8.9582 -3.765503 12.67715 
1 1 1    1   33    9 o   30.826   7.2465   16.723   12.278   35.971   17.829  -0.6393   16.933   39.253   10.713   22.399   9.7609 16.85380 14.49302 
1 1 1    1   33   10 o   69.573   5.1425  104.283   14.748  104.903   20.554  103.625   21.173   69.841   7.1354   69.304   7.4072 0.5371704 10.28496 
1 1 1    1   33   11 o   37.557   8.2800   31.567   14.540   21.157   19.477   44.669   21.852   31.882   11.531   43.231   11.886 -11.34926 16.56003 
1 1 1    1   33   12 o   42.165   10.233   39.260   18.787   36.248   21.211   50.228   40.475   39.152   12.000   45.177   16.579 -6.024387 20.46576 
1 1 1    1   33   13 o   76.262   5.6150  126.334   17.634  125.428   24.250  127.349   25.690   76.075   7.7286   76.449   8.1474 -0.3743515 11.22993 
1 1 1    1   33   14 o   53.913   7.7398   67.729   16.593   61.726   22.570   74.789   24.478   51.228   11.010   56.598   10.881 -5.370014 15.47965 
1 1 1    1   33   15 o   29.512   8.4506   13.089   16.001   10.193   22.207   16.215   23.075   28.334   11.702   30.691   12.195 -2.357056 16.90114 
1 1 1    1   33   16 o   31.888   9.2040   14.014   19.777   0.2058   27.737   28.292   28.206   27.781   12.285   35.995   13.709 -8.213949 18.40797 
1 1 1    1   33   17 o   24.918   7.9755  -7.1162   17.578 -11.5943   24.017  -1.9501   25.796   23.417   10.780   26.418   11.757 -3.001120 15.95103 
1 1 1    1   33   18 o   79.722   6.0898  141.525   19.977  129.059   27.688  155.063   28.853   75.901   8.8444   83.542   8.3738 -7.640503 12.17963 
1 1 1    1   33   19 o   64.386   12.398  121.520   34.241  102.569   48.438  140.449   48.412   58.174   18.184   70.597   16.859 -12.42305 24.79667 
1 1 1    1   33   20 o   32.117   9.0795   19.869   18.199   20.190   25.644   19.544   25.832   32.199   12.836   32.035   12.845 0.1638603 18.15905 
1 1 1    1   33   21 o   52.484   9.0204   70.723   19.396   60.601   26.537   82.330   28.419   48.095   13.047   56.873   12.460 -8.777275 18.04077 
1 1 1    1   33   22 o   29.219   8.7465   11.156   18.562   20.500   25.909   1.3013   26.608   31.729   12.813   26.709   11.909 5.020260 17.49306 
1 1 1    1   33   23 o   66.175   7.6532  107.500   20.179   91.550   28.441  123.670   28.636   59.846   11.941   72.505   9.5759 -12.65846 15.30632 
1 1 1    1   33   24 o   42.949   10.474   52.255   23.630   31.141   32.300   76.567   34.660   35.368   14.298   50.529   15.309 -15.16157 20.94785 
1 1 1    1   33   25 o   44.115   9.8209   57.133   19.938   54.295   27.585   60.237   28.852   43.085   13.755   45.145   14.021 -2.059746 19.64189 
1 1 1    1   33   26 o   31.649   8.5391   10.514   19.205 -29.1172   26.533   54.127   27.834   20.638   10.009   42.660   13.838 -22.02255 17.07830 
1 1 1    1   33   27 f   45.311   9.5643   60.282   19.279   54.819   26.778   66.161   27.779   43.069   13.530   47.554   13.522 -4.485195 19.12855 
1 1 1    1   33   28 o   33.049   9.3357   29.840   19.359   23.198   27.045   36.819   27.724   30.892   12.849   35.206   13.547 -4.313591 18.67132 
1 1 1    1   33   29 o   38.293   9.7203   47.116   19.500   50.199   28.531   44.413   26.713   39.157   13.980   37.430   13.509 1.726917 19.44058 
1 1 1    1   33   30 o   30.131   8.9860   22.337   19.491   32.852   27.464   11.666   27.665   32.970   13.235   27.292   12.158 5.677376 17.97197 
1 1 1    1   33   31 o   28.255   9.1032   9.4976   24.151 -14.6469   33.339   36.162   35.035   23.768   11.451   32.742   14.154 -8.973814 18.20638 
1 1 1    1   33   32 o   27.637   8.5469   14.409   19.785   34.929   27.351  -8.1148   28.656   32.253   13.115   23.022   10.963 9.231014 17.09375 
1 1 1    1   34    2 o   23.673   3.3558   11.996   3.2112   16.509   4.7046   8.0596   4.3938   28.098   4.0596   19.247   5.3447 8.851061 6.711649 
1 1 1    1   34    3 o   77.471   3.2112  128.194   9.5169  119.659   16.657  132.330   11.596   75.258   5.3665   79.685   3.5283 -4.426872 6.422451 
1 1 1    1   34    4 o   22.891   5.3726   9.4405   5.1816   14.800   10.869   7.8643   5.8946   26.293   8.6532   19.488   6.3705 6.805105 10.74527 
1 1 1    1   34    6 o   93.385   3.0990  185.323   11.332  174.381   19.002  191.362   14.117   90.963   5.0648   95.808   3.5726 -4.844505 6.198009 
1 1 1    1   34    7 o  117.214   3.4383  289.055   16.618  289.645   23.260  288.439   23.751  117.363   4.8053  117.064   4.9191 0.2987671 6.876649 
1 1 1    1   34    8 o   61.023   4.9340   79.896   12.411   77.597   17.190   82.399   17.937   60.123   6.9321   61.924   7.0231 -1.800339 9.868085 
1 1 1    1   34    9 f   47.332   7.1278   51.436   13.420   55.425   20.241   48.308   17.927   48.861   10.365   45.803   9.7868 3.058140 14.25552 
1 1 1    1   34   10 o   97.416   4.2210  201.993   16.938  215.792   24.209  188.762   23.707  100.746   5.8263   94.085   6.1092 6.661118 8.442034 
1 1 1    1   34   11 o   23.434   7.1113   0.0102   12.664  -8.7952   17.472   9.7562   18.381   20.293   9.2874   26.576   10.771 -6.282883 14.22251 
1 1 1    1   34   12 o   51.574   9.6870   64.337   18.322   61.922   20.624   73.381   39.913   51.509   10.069   51.639   16.552 -0.1300011 19.37396 
1 1 1    1   34   13 o   44.826   8.3662   49.741   16.113   61.821   22.217   36.335   23.404   50.967   10.899   38.686   12.696 12.28151 16.73241 
1 1 1    1   34   14 o   43.798   8.6840   47.409   16.285   47.479   22.052   47.326   24.152   44.013   11.874   43.583   12.675 0.4302254 17.36802 
1 1 1    1   34   15 o   60.055   7.2077   84.000   17.385   87.200   23.911   80.413   25.320   62.080   9.3387   58.029   10.981 4.050545 14.41539 
1 1 1    1   34   16 o   26.966   8.5089  -1.0310   19.082  -1.9219   25.323   0.1392   29.024   25.962   11.594   27.970   12.457 -2.008322 17.01779 
1 1 1    1   34   17 o   35.436   9.0611   29.236   17.122   22.957   23.573   36.250   24.913   32.734   12.517   38.137   13.105 -5.402687 18.12222 
1 1 1    1   34   18 o   30.376   8.6987   14.532   17.400   3.3112   24.129   26.689   25.116   26.557   11.610   34.196   12.957 -7.638548 17.39750 
1 1 1    1   34   19 o   36.754   10.823   20.147   30.157 -21.6708   42.905   60.975   42.395   28.587   13.556   44.921   16.876 -16.33396 21.64592 
1 1 1    1   34   20 o   26.319   8.1038   2.2083   17.201   15.950   23.742 -12.9739   24.956   29.666   12.159   22.972   10.717 6.693455 16.20766 
1 1 1    1   34   21 o   26.267   8.1202   4.2232   16.888   11.106   23.537  -3.0784   24.243   27.964   11.831   24.569   11.126 3.395098 16.24049 
1 1 1    1   34   22 o   39.431   8.9970   42.106   17.335   54.758   24.256   28.899   24.782   44.974   12.582   33.889   12.863 11.08527 17.99404 
1 1 1    1   34   23 o   38.952   9.0272   40.587   18.538   17.088   25.837   65.518   26.613   29.680   12.467   48.225   13.059 -18.54456 18.05434 
1 1 1    1   34   24 o   34.910   9.3481   33.472   18.485   32.465   26.077   34.488   26.206   34.548   13.176   35.272   13.265 -0.7241478 18.69614 
1 1 1    1   34   25 o   30.914   8.8151   21.005   17.837   33.688   25.558   8.9626   24.904   34.828   13.099   27.001   11.800 7.827021 17.63020 
1 1 1    1   34   26 o   27.240   9.2229 -14.5244   29.260 -23.1390   39.406  -3.9377   43.684   25.580   12.356   28.899   13.696 -3.319078 18.44586 
1 1 1    1   34   27 o   33.830   8.9560   28.771   19.045   57.591   27.496   2.1928   26.405   42.495   13.750   25.165   11.479 17.33082 17.91205 
1 1 1    1   34   28 o   33.141   9.1348   30.106   19.367   50.661   27.512   9.9142   27.268   39.384   13.758   26.899   12.020 12.48466 18.26966 
1 1 1    1   34   29 o   26.508   8.3996   9.0685   19.381  -3.5403   27.637   21.271   27.188   23.904   11.193   29.113   12.527 -5.209261 16.79913 
1 1 1    1   34   30 o   23.553   7.9627 -10.2950   21.187 -19.9508   27.464   3.8981   33.297   21.043   10.200   26.063   12.230 -5.019379 15.92535 
1 1 1    1   34   31 o   26.971   8.5053   15.229   19.335   20.983   26.904   9.0832   27.805   28.240   12.305   25.701   11.745 2.538481 17.01068 
1 1 1    1   35    2 o   13.533   4.7232   3.4607   3.2419   3.4607   3.2419   0.0000   0.0000   13.533   4.7232  ?   ?       ?      ? 
1 1 1    1   35    3 o  102.586   2.4811  219.594   10.497  222.260   14.879  216.952   14.812  103.210   3.4954  101.961   3.5221 1.248978 4.962148 
1 1 1    1   35    4 o   60.091   3.6401   83.104   8.1449   98.081   10.232   57.194   13.457   68.524   3.6202   51.658   6.3162 16.86549 7.280181 
1 1 1    1   35    5 o   12.156   5.3998  -1.7202   5.4175   0.0000   0.0000  -1.7202   5.4175  ?   ?    12.156   5.3998      ?      ? 
1 1 1    1   35    6 o   80.098   3.5400  135.167   10.288  136.837   20.063  134.570   11.983   79.954   6.0840   80.243   3.6208 -0.2889404 7.079940 
1 1 1    1   35    7 o   74.617   3.6169  121.258   10.203  109.067   18.014  127.016   12.381   71.352   6.1213   77.883   3.8543 -6.531456 7.233701 
1 1 1    1   35    8 o   89.592   3.9669  171.337   14.619  180.564   20.357  161.510   21.008   92.216   5.3522   86.968   5.8566 5.247734 7.933865 
1 1 1    1   35    9 o   34.602   6.8213   26.839   11.888   4.4986   17.267   46.971   16.391   24.046   10.151   45.158   9.1145 -21.11165 13.64252 
1 1 1    1   35   10 o   23.417   6.9801   4.3115   11.514   5.3737   15.750   3.0921   16.875   23.519   9.7958   23.315   9.9465 0.2032356 13.96026 
1 1 1    1   35   11 o   30.455   7.7841   19.852   12.548   17.381   17.181   22.676   18.368   29.092   10.780   31.818   11.233 -2.726040 15.56817 
1 1 1    1   35   12 o   32.860   8.8443   23.426   17.455   33.372   19.443 -17.8975   39.631   37.015   11.513   28.706   13.429 8.309580 17.68853 
1 1 1    1   35   13 o   28.688   8.0688   14.447   14.275   14.268   19.513   14.653   20.937   28.381   11.234   28.995   11.585 -0.6139584 16.13761 
1 1 1    1   35   14 o   36.975   8.5301   33.716   15.238   40.425   20.901   26.105   22.263   40.254   11.816   33.696   12.306 6.557957 17.06012 
1 1 1    1   35   15 o   19.400   6.5685 -23.2108   15.006 -18.6180   20.361 -28.6712   22.201   19.697   9.3397   19.104   9.2386 0.5930958 13.13705 
1 1 1    1   35   16 o   55.877   9.1036   83.505   21.330  102.481   28.816   60.505   31.723   65.425   10.679   46.329   14.747 19.09652 18.20714 
1 1 1    1   35   17 o   72.294   6.2066  120.378   18.429  124.470   25.296  115.749   26.902   74.009   8.2872   70.578   9.2417 3.430626 12.41321 
1 1 1    1   35   18 o   46.670   9.0617   59.215   18.290   68.413   24.871   48.382   26.993   51.474   11.945   41.866   13.630 9.608593 18.12334 
1 1 1    1   35   19 f   35.367   10.837   26.504   29.350   33.035   38.881   17.853   44.750   36.517   15.314   34.217   15.337 2.299751 21.67351 
1 1 1    1   35   20 f   32.520   8.7210   23.460   17.584   41.948   24.419   3.5494   25.341   38.853   12.978   26.186   11.653 12.66751 17.44209 
1 1 1    1   35   21 o   59.322   7.9303   91.658   18.752  102.490   25.576   79.067   27.575   65.099   9.5257   53.545   12.682 11.55351 15.86068 
1 1 1    1   35   22 o   28.741   8.3563   13.373   16.902  -3.1468   23.834   30.086   23.973   23.842   10.887   33.640   12.680 -9.798862 16.71259 
1 1 1    1   35   23 o   44.526   10.411   64.080   23.228   48.113   35.132   76.479   30.960   38.815   15.162   50.236   14.272 -11.42130 20.82230 
1 1 1    1   35   24 o   21.617   7.2720 -15.9259   17.740 -16.4989   24.923 -15.3375   25.257   21.452   10.218   21.783   10.350 -0.3310452 14.54396 
1 1 1    1   35   25 f   27.554   8.4481   12.238   18.172   24.060   25.782   0.5659   25.618   30.536   12.610   24.572   11.246 5.964577 16.89626 
1 1 1    1   35   26 o   28.035   9.4198  -1.5748   29.577  -0.7705   40.804  -2.4651   42.932   27.948   13.243   28.123   13.400 -0.1755276 18.83959 
1 1 1    1   35   27 o   24.573   7.9561   2.5615   18.227   7.0960   25.513  -2.1657   26.049   25.441   11.476   23.705   11.022 1.735508 15.91220 
1 1 1    1   35   28 o   19.664   6.7599 -24.7883   17.437 -39.3948   24.307  -9.3015   25.029   17.538   8.7113   21.791   10.339 -4.252733 13.51972 
1 1 1    1   35   29 o   26.546   8.2270   9.6073   18.582 -14.2757   26.282   33.477   26.275   21.299   10.238   31.793   12.881 -10.49391 16.45401 
1 1 1    1   36    3 o  139.506   2.5642  407.086   14.751  414.565   21.104  399.941   20.627  140.754   3.6352  138.259   3.6173 2.495056 5.128311 
1 1 1    1   36    4 o   37.240   5.4341   31.557   8.0672   34.547   11.292   28.439   11.529   39.257   7.2406   35.222   8.1049 4.035503 10.86812 
1 1 1    1   36    5 o   68.714   3.6050  106.151   8.9941   86.962   16.481  114.290   10.733   63.507   6.2920   73.920   3.5205 -10.41269 7.209987 
1 1 1    1   36    6 o   46.899   4.1383   39.140   7.0826   66.730   14.934   31.134   8.0449   55.520   6.5219   38.278   5.0957 17.24173 8.276581 
1 1 1    1   36    7 o   77.589   3.9879  133.375   11.315  118.279   20.973  139.572   13.438   73.679   6.9016   81.499   3.9978 -7.819801 7.975883 
1 1 1    1   36    8 o   63.701   4.7106   87.992   12.366   83.797   17.120   92.568   17.882   62.106   6.6837   65.297   6.6399 -3.190830 9.421232 
1 1 1    1   36    9 o   34.594   7.4247   27.970   11.750   37.116   17.340   20.205   15.977   39.154   10.515   30.035   10.485 9.118357 14.84940 
1 1 1    1   36   10 o   19.083   6.1623  -7.2078   10.858  -3.8004   15.041 -10.9168   15.692   19.811   8.8847   18.356   8.5416 1.454744 12.32465 
1 1 1    1   36   11 o   61.409   5.4675   83.782   13.827   81.619   18.952   86.243   20.217   60.653   7.5761   62.165   7.8853 -1.512043 10.93506 
1 1 1    1   36   12 o   42.935   9.1377   28.911   16.050   12.071   17.915   97.387   36.126   26.634   10.690   59.237   14.822 -32.60290 18.27531 
1 1 1    1   36   13 o   24.287   7.4236   3.1421   13.694  -2.0888   18.772   9.0917   20.020   22.316   9.9728   26.258   10.999 -3.941607 14.84717 
1 1 1    1   36   14 o   39.299   8.0499   37.879   14.753   20.602   19.996   58.520   21.856   30.433   11.554   48.164   11.212 -17.73106 16.09984 
1 1 1    1   36   15 o   45.832   8.1945   53.920   15.572   46.448   21.538   62.102   22.540   42.192   11.875   49.471   11.295 -7.278854 16.38902 
1 1 1    1   36   16 o   34.424   8.7690   28.877   17.351   9.6843   25.830   44.658   23.421   28.167   12.165   40.681   12.633 -12.51355 17.53794 
1 1 1    1   36   17 o   32.998   8.1061   22.973   15.537  -0.0151   21.487   48.165   22.493   23.808   10.652   42.189   12.221 -18.38069 16.21225 
1 1 1    1   36   18 o   50.298   8.1634   66.736   17.691   40.114   24.289   96.820   25.820   37.705   12.941   62.891   9.9542 -25.18521 16.32672 
1 1 1    1   36   19 o   47.408   10.536   56.912   20.952   39.029   24.211  110.233   41.806   37.205   12.912   57.611   16.654 -20.40559 21.07277 
1 1 1    1   36   20 o   41.831   9.1726   50.065   17.695   41.283   24.698   59.325   25.363   37.963   13.049   45.698   12.895 -7.734924 18.34521 
1 1 1    1   36   21 o   24.529   7.8429  -0.5187   17.264 -10.5730   24.967   8.6920   23.897   22.621   10.607   26.437   11.556 -3.815681 15.68582 
1 1 1    1   36   22 o   44.131   9.5781   60.058   19.107   58.944   26.931   61.187   27.112   43.691   13.543   44.571   13.548 -0.8800621 19.15622 
1 1 1    1   36   23 o   24.563   8.2905 -15.1096   23.661  -1.0371   33.346 -29.3789   33.579   26.426   12.348   22.700   11.065 3.725889 16.58092 
1 1 1    1   36   24 o   38.592   9.7484   49.099   19.747   53.579   27.441   44.287   28.439   40.474   13.757   36.711   13.816 3.763294 19.49682 
1 1 1    1   36   25 o   21.908   7.3159 -13.2141   17.781 -31.4300   25.111   5.1054   25.182   18.940   9.3026   24.875   11.294 -5.935282 14.63173 
1 1 1    1   36   26 o   24.226   7.9008   1.7028   18.328  -5.7304   24.901   10.491   27.076   22.349   10.516   26.103   11.795 -3.754328 15.80155 
1 1 1    1   36   27 o   38.157   9.0066   48.326   18.552   72.567   26.300   24.318   26.174   47.209   13.065   29.106   12.401 18.10361 18.01312 
1 1 1    1   37    3 o   40.431   3.6306   34.298   6.0541   34.298   6.0541   0.0000   0.0000   40.431   3.6306  ?   ?       ?      ? 
1 1 1    1   37    4 o  104.062   3.5680  227.161   15.314   0.0000   0.0000  227.161   15.314  ?   ?   104.062   3.5680      ?      ? 
1 1 1    1   37    5 o   43.315   3.1143   39.767   5.5581   41.253   7.7983   38.233   7.9239   44.170   4.2806   42.461   4.5247 1.709225 6.228666 
1 1 1    1   37    6 o   50.880   4.9665   60.773   9.2688   47.952   15.497   67.915   11.566   45.351   8.5995   56.408   4.9712 -11.05714 9.932998 
1 1 1    1   37    7 o   43.153   5.2085   41.628   7.4654   42.578   15.788   41.354   8.4724   42.214   9.3172   44.093   4.6588 -1.879181 10.41706 
1 1 1    1   37    8 o   57.359   4.3848   69.989   8.9057   75.143   18.179   68.362   10.215   57.936   7.6078   56.783   4.3619 1.153481 8.769565 
1 1 1    1   37    9 o   35.001   7.5766   28.797   12.666   15.695   17.068   44.854   18.895   27.692   10.636   42.309   10.793 -14.61615 15.15312 
1 1 1    1   37   10 o   29.909   7.3912   20.799   11.474   26.102   15.795   14.874   16.696   32.635   10.407   27.183   10.498 5.451578 14.78241 
1 1 1    1   37   11 f   39.769   7.5908   39.742   12.863   32.769   17.847   47.278   18.554   35.977   11.004   43.561   10.459 -7.584225 15.18156 
1 1 1    1   37   12 o   39.989   9.3370   40.882   16.423   36.745   19.157   52.356   31.904   37.721   11.371   42.258   14.813 -4.536915 18.67410 
1 1 1    1   37   13 o   31.485   8.0769   23.676   13.718   31.004   19.915   17.059   18.925   34.580   11.720   28.390   11.117 6.189896 16.15378 
1 1 1    1   37   14 o   53.902   7.2531   74.332   15.630   39.738   21.729  111.424   22.500   38.128   12.212   69.676   7.8293 -31.54798 14.50619 
1 1 1    1   37   15 o   29.106   8.0964   18.789   14.486   24.545   19.998   12.434   21.013   31.268   11.621   26.944   11.276 4.323574 16.19272 
1 1 1    1   37   16 o   36.325   8.8137   36.626   17.086   20.203   25.970   49.162   22.689   30.512   12.633   42.138   12.294 -11.62593 17.62734 
1 1 1    1   37   17 o   39.761   8.7849   44.373   15.994   45.511   21.701   43.020   23.665   40.613   12.071   38.910   12.767 1.702698 17.56972 
1 1 1    1   37   18 o   24.277   8.1140 -10.7983   19.884  -8.6111   35.334 -11.8120   24.055   26.526   12.495   22.028   10.355 4.497969 16.22803 
1 1 1    1   37   19 o   35.076   7.5263   22.285   17.254   70.358   23.896 -30.0789   24.940   50.677   11.673   19.476   9.5031 31.20143 15.05251 
1 1 1    1   37   20 o   27.008   8.0075   5.6062   16.941 -20.9730   23.474   34.494   24.472   19.918   9.5993   34.097   12.819 -14.17970 16.01497 
1 1 1    1   37   21 o   26.019   8.0958   2.7909   17.987 -19.4428   24.933   26.918   25.973   20.727   9.9652   31.311   12.762 -10.58354 16.19151 
1 1 1    1   37   22 o   26.343   8.2944   9.9046   18.193   10.611   25.588   9.1826   25.871   26.478   11.750   26.209   11.710 0.2686863 16.58877 
1 1 1    1   37   23 o   52.949   8.4985   82.766   19.055  111.683   27.731   56.897   26.228   64.572   10.412   41.325   13.434 23.24763 16.99703 
1 1 1    1   37   24 o   19.559   6.7341 -23.1736   17.440 -21.7081   24.902 -24.5843   24.432   19.844   9.6406   19.274   9.4049 0.5700474 13.46825 
1 1 1    1   37   25 o   26.824   9.1632  -7.6607   30.608 -39.0398   41.718   28.924   45.045   23.005   11.425   30.642   14.330 -7.637085 18.32636 
1 1 1    1   38    4 o   80.209   2.4368  135.168   8.0604  136.090   11.499  134.277   11.302   80.470   3.4648   79.948   3.4274 0.5219955 4.873559 
1 1 1    1   38    5 o   74.217   3.3097  114.649   9.3480  110.099   11.148  125.429   17.159   72.257   3.7406   76.178   5.4613 -3.921242 6.619462 
1 1 1    1   38    6 o   22.240   4.7846   10.391   4.8888   15.739   7.5697   6.5635   6.4034   26.140   6.9146   18.341   6.6149 7.798586 9.569146 
1 1 1    1   38    7 o   36.877   5.5400   32.718   7.1792   28.733   14.674   33.973   8.2317   34.008   9.8767   39.746   5.0215 -5.737392 11.07994 
1 1 1    1   38    8 o   23.744   6.1773   10.321   6.6408   15.798   15.136   9.0158   7.3900   26.879   10.086   20.609   7.1346 6.269464 12.35456 
1 1 1    1   38    9 o   29.710   4.7038   26.094   8.1290 -28.3365   17.743   40.555   9.1453   16.107   7.8927   43.312   5.1195 -27.20455 9.407614 
1 1 1    1   38   10 o   46.741   6.9266   54.578   12.918   57.689   17.946   51.232   18.610   48.569   9.2971   44.913   10.270 3.656071 13.85315 
1 1 1    1   38   11 o   58.604   6.0202   80.650   13.865   61.238   18.904  103.249   20.397   49.837   9.5442   67.371   7.3404 -17.53344 12.04046 
1 1 1    1   38   12 o   34.166   8.7420   10.315   15.080  -6.5535   16.970   73.646   32.882   19.714   9.0705   48.619   14.947 -28.90482 17.48397 
1 1 1    1   38   13 o   48.175   7.1044   59.128   13.966   77.322   19.684   40.684   19.819   57.518   8.2975   38.831   11.534 18.68723 14.20877 
1 1 1    1   38   14 f   27.526   7.6952   12.426   14.056  -3.6567   19.482   29.889   20.301   21.661   9.8726   33.391   11.806 -11.73008 15.39033 
1 1 1    1   38   15 o   32.741   8.5241   28.334   15.352   20.632   21.029   37.121   22.462   29.411   11.656   36.072   12.441 -6.661579 17.04823 
1 1 1    1   38   16 o   23.988   7.5381   1.6191   15.186  -8.8090   20.638   13.933   22.426   20.806   9.7198   27.170   11.525 -6.363506 15.07613 
1 1 1    1   38   17 o   27.605   8.2129   15.963   15.922   17.838   21.927   13.870   23.159   28.091   11.617   27.118   11.613 0.9728909 16.42589 
1 1 1    1   38   18 o   32.917   10.274   30.917   27.338   26.692   38.450   35.237   38.877   32.060   14.304   33.775   14.752 -1.715607 20.54807 
1 1 1    1   38   19 o   27.320   8.3506   14.651   17.239   13.242   24.140   16.118   24.627   26.883   11.685   27.757   11.933 -0.8743801 16.70124 
1 1 1    1   38   20 o   23.861   7.5989  -2.0415   16.838   20.281   23.817 -24.3492   23.809   28.464   11.964   19.258   9.3722 9.206369 15.19780 
1 1 1    1   38   21 o   27.349   8.3766   16.930   17.520   22.064   24.698   11.729   24.856   28.708   12.131   25.990   11.555 2.717733 16.75315 
1 1 1    1   38   22 o   27.432   8.6766   16.374   19.848   16.030   25.393   16.914   31.821   26.921   11.836   27.944   12.690 -1.023067 17.35317 
1 1 1    1   38   23 o   38.437   9.4480   51.728   18.501   44.469   25.863   59.334   26.476   35.615   13.220   41.259   13.502 -5.643349 18.89600 
1 1 1    1   39    7 o   48.337   7.6653   61.640   14.403   64.689   17.492   55.219   25.383   52.811   8.0307   43.864   13.059 8.947258 15.33054 
1 1 1    1   39    8 o   26.967   6.8843   16.547   10.274   8.5685   15.272   23.142   13.885   23.516   9.7076   30.418   9.7641 -6.902201 13.76867 
1 1 1    1   39    9 o   80.467   4.0000  132.316   11.844  165.174   23.587  121.237   13.696   85.727   6.6711   75.208   4.4155 10.51865 8.000016 
1 1 1    1   39   10 o   29.048   7.3270   20.915   11.066   19.604   15.219   22.385   16.119   28.323   10.200   29.774   10.521 -1.450380 14.65399 
1 1 1    1   39   11 o   30.129   7.5322   23.438   11.794   26.401   15.897   19.811   17.589   31.731   10.466   28.528   10.835 3.202997 15.06433 
1 1 1    1   39   12 o   34.513   8.7143   15.545   14.417   0.1553   16.130   76.685   32.151   20.726   9.2546   48.299   14.769 -27.57366 17.42864 
1 1 1    1   39   13 o   40.973   7.8526   45.959   13.589   40.836   18.367   52.154   20.197   38.456   11.016   43.490   11.194 -5.034416 15.70525 
1 1 1    1   39   14 o   21.812   6.8887  -2.0182   13.011 -13.5555   17.645   11.728   19.260   18.182   8.6423   25.442   10.730 -7.260695 13.77742 
1 1 1    1   39   15 o   44.342   9.0817   57.974   16.944   53.583   20.815   66.598   29.172   43.641   11.429   45.043   14.117 -1.402084 18.16332 
1 1 1    1   39   16 o   27.114   8.0325   16.056   15.055   13.208   20.376   19.480   22.340   25.935   10.992   28.293   11.715 -2.358011 16.06493 
1 1 1    1   39   17 o   43.741   7.6412   56.128   16.470   88.489   22.919   21.575   23.683   58.716   9.4642   28.766   11.999 29.95016 15.28234 
1 1 1    1   39   18 o   33.104   10.112   34.361   27.230   67.494   38.430   0.9511   38.590   39.513   15.726   26.696   12.715 12.81678 20.22306 
1 1 1    1   39   19 o   22.471   7.2319  -7.1513   15.793 -31.4391   21.726   20.065   22.998   17.181   8.4800   27.761   11.717 -10.57918 14.46373 
1 1 1    1   39   20 o   22.630   7.4502  -2.1867   17.026   4.6983   23.988  -9.1766   24.170   23.920   10.923   21.339   10.135 2.580675 14.90049 
1 1 1    2    0    0 o   93.349   2.2923  180.388   12.448  180.388   12.448  180.388   12.448   93.349   3.2419   93.349   3.2419 0.000000 0.000000 
1 1 1    2    0    1 o   15.316   2.6096   5.6033   2.0213   5.6033   2.0213   5.6033   2.0213   15.316   3.6905   15.316   3.6905 0.000000 0.000000 
1 1 1    2    0    2 o  407.598   4.3393  3431.95  103.111  3431.95  103.111  3431.95  103.111  407.598   6.1366  407.598   6.1366 0.000000 0.000000 
1 1 1    2    0    3 o  254.330   3.1896  1335.83   47.283  1335.83   47.283  1335.83   47.283  254.330   4.5107  254.330   4.5107 0.000000 0.000000 
1 1 1    2    0    4 o  177.996   1.9503  653.954   20.238  653.954   20.238  653.954   20.238  177.996   2.7582  177.996   2.7582 0.000000 0.000000 
1 1 1    2    0    5 o  198.363   2.3642  812.342   27.336  812.342   27.336  812.342   27.336  198.363   3.3434  198.363   3.3434 0.000000 0.000000 
1 1 1    2    0    6 o  371.850   2.9003  2853.20   62.889  2853.20   62.889  2853.20   62.889  371.850   4.1017  371.850   4.1017 0.000000 0.000000 
1 1 1    2    0    7 o  746.787   5.1561 11510.84  224.548 11510.84  224.548 11510.84  224.548  746.787   7.2919  746.787   7.2919 0.000000 0.000000 
1 1 1    2    0    8 o  291.486   3.5487  1754.34   60.294  1754.34   60.294  1754.34   60.294  291.486   5.0186  291.486   5.0186 0.000000 0.000000 
1 1 1    2    0    9 o  320.928   2.6579  2125.47   49.738  2125.47   49.738  2125.47   49.738  320.928   3.7588  320.928   3.7588 0.000000 0.000000 
1 1 1    2    0   10 o  310.928   2.6149  1995.27   47.408  1995.27   47.408  1995.27   47.408  310.928   3.6980  310.928   3.6980 0.000000 0.000000 
1 1 1    2    0   11 o  287.437   2.5162  1705.23   42.171  1705.23   42.171  1705.23   42.171  287.437   3.5584  287.437   3.5584 0.000000 0.000000 
1 1 1    2    0   12 o   34.376   7.7659   30.865   13.723   30.865   13.723   30.865   13.723   34.376   10.983   34.376   10.983 0.000000 0.000000 
1 1 1    2    0   13 o  480.062   3.5623  4757.22   99.725  4757.22   99.725  4757.22   99.725  480.062   5.0379  480.062   5.0379 0.000000 0.000000 
1 1 1    2    0   14 o  682.620   4.7876  9621.14  190.583  9621.14  190.583  9621.14  190.583  682.620   6.7707  682.620   6.7707 0.000000 0.000000 
1 1 1    2    0   15 o  756.912   5.2544 11827.48  231.929 11827.48  231.929 11827.48  231.929  756.912   7.4308  756.912   7.4308 0.000000 0.000000 
1 1 1    2    0   16 o  388.390   3.1216  3112.79   70.697  3112.79   70.697  3112.79   70.697  388.390   4.4146  388.390   4.4146 0.000000 0.000000 
1 1 1    2    0   17 o  486.894   3.6629  4892.34  103.998  4892.34  103.998  4892.34  103.998  486.894   5.1801  486.894   5.1801 0.000000 0.000000 
1 1 1    2    0   18 o   23.802   9.6520   14.800   21.284   14.800   21.284   14.800   21.284   23.802   13.650   23.802   13.650 0.000000 0.000000 
1 1 1    2    0   19 o  241.445   2.6306  1203.30   37.027  1203.30   37.027  1203.30   37.027  241.445   3.7202  241.445   3.7202 0.000000 0.000000 
1 1 1    2    0   20 o  120.812   3.0118  302.203   21.164  302.203   21.164  302.203   21.164  120.812   4.2594  120.812   4.2594 0.000000 0.000000 
1 1 1    2    0   21 o  337.968   2.9416  2357.45   57.968  2357.45   57.968  2357.45   57.968  337.968   4.1600  337.968   4.1600 0.000000 0.000000 
1 1 1    2    0   22 o   77.535   6.9933  130.170   30.222  130.170   30.222  130.170   30.222   77.535   9.8900   77.535   9.8900 0.000000 0.000000 
1 1 1    2    0   23 o   97.441   3.5970  197.545   20.317  197.545   20.317  197.545   20.317   97.441   5.0870   97.441   5.0870 0.000000 0.000000 
1 1 1    2    0   24 o  103.438   3.9449  222.786   23.643  222.786   23.643  222.786   23.643  103.438   5.5789  103.438   5.5789 0.000000 0.000000 
1 1 1    2    0   25 f  232.256   2.8152  1114.09   38.113  1114.09   38.113  1114.09   38.113  232.256   3.9813  232.256   3.9813 0.000000 0.000000 
1 1 1    2    0   26 o  239.491   2.8043  1184.65   39.149  1184.65   39.149  1184.65   39.149  239.491   3.9658  239.491   3.9658 0.000000 0.000000 
1 1 1    2    0   27 o  197.186   3.7599  804.828   43.174  804.828   43.174  804.828   43.174  197.186   5.3173  197.186   5.3173 0.000000 0.000000 
1 1 1    2    0   28 o  148.862   3.1361  458.699   27.176  458.699   27.176  458.699   27.176  148.862   4.4352  148.862   4.4352 0.000000 0.000000 
1 1 1    2    0   29 o  108.022   3.8230  242.896   23.950  242.896   23.950  242.896   23.950  108.022   5.4065  108.022   5.4065 0.000000 0.000000 
1 1 1    2    0   30 o   49.771   8.4833   59.543   21.353   59.543   21.353   59.543   21.353   49.771   11.997   49.771   11.997 0.000000 0.000000 
1 1 1    2    0   31 o  159.898   3.9422  530.410   36.666  530.410   36.666  530.410   36.666  159.898   5.5752  159.898   5.5752 0.000000 0.000000 
1 1 1    2    0   32 o   82.821   5.0775  145.189   24.104  145.189   24.104  145.189   24.104   82.821   7.1806   82.821   7.1806 0.000000 0.000000 
1 1 1    2    0   33 o   40.497   10.495   45.677   22.887   45.677   22.887   45.677   22.887   40.497   14.842   40.497   14.842 0.000000 0.000000 
1 1 1    2    0   34 o   15.141   7.4632 -22.2180   23.822 -22.2180   23.822 -22.2180   23.822   15.141   10.555   15.141   10.555 0.000000 0.000000 
1 1 1    2    0   35 f   76.340   5.8461  125.218   25.258  125.218   25.258  125.218   25.258   76.340   8.2677   76.340   8.2677 0.000000 0.000000 
1 1 1    2    0   36 o   16.534   8.1498 -25.9251   28.403 -25.9251   28.403 -25.9251   28.403   16.534   11.525   16.534   11.525 0.000000 0.000000 
1 1 1    2    0   37 o   22.366   10.337  -2.4224   33.205  -2.4224   33.205  -2.4224   33.205   22.366   14.619   22.366   14.619 0.000000 0.000000 
1 1 1    2    0   38 o   24.068   10.801   6.3469   32.931   6.3469   32.931   6.3469   32.931   24.068   15.274   24.068   15.274 0.000000 0.000000 
1 1 1    2    0   39 o   48.472   12.176   66.919   31.355   66.919   31.355   66.919   31.355   48.472   17.219   48.472   17.219 0.000000 0.000000 
1 1 1    2    0   40 o   25.574   10.687   17.638   27.405   17.638   27.405   17.638   27.405   25.574   15.114   25.574   15.114 0.000000 0.000000 
1 1 1    2    0   41 o   25.871   10.365   20.619   24.147   20.619   24.147   20.619   24.147   25.871   14.658   25.871   14.658 0.000000 0.000000 
1 1 1    2    0   42 o   30.342   10.882   30.765   24.038   30.765   24.038   30.765   24.038   30.342   15.389   30.342   15.389 0.000000 0.000000 
1 1 1    2    0   43 o   30.182   11.398   30.753   27.355   30.753   27.355   30.753   27.355   30.182   16.119   30.182   16.119 0.000000 0.000000 
1 1 1    2    0   44 o   39.985   10.998   48.864   24.447   48.864   24.447   48.864   24.447   39.985   15.553   39.985   15.553 0.000000 0.000000 
1 1 1    2    0   45 o   34.518   11.296   40.321   25.110   40.321   25.110   40.321   25.110   34.518   15.975   34.518   15.975 0.000000 0.000000 
1 1 1    2    0   46 o   15.833   7.7066 -12.9790   23.444 -12.9790   23.444 -12.9790   23.444   15.833   10.899   15.833   10.899 0.000000 0.000000 
1 1 1    2    0   47 o   14.301   7.0911 -19.3710   22.432 -19.3710   22.432 -19.3710   22.432   14.301   10.028   14.301   10.028 0.000000 0.000000 
1 1 1    2    0   48 o   18.321   8.4394   3.1482   21.862   3.1482   21.862   3.1482   21.862   18.321   11.935   18.321   11.935 0.000000 0.000000 
1 1 1    2    0   49 o   22.310   9.8553   14.021   26.263   14.021   26.263   14.021   26.263   22.310   13.938   22.310   13.938 0.000000 0.000000 
1 1 1    2    0   50 o   16.497   8.1017 -13.7384   27.384 -13.7384   27.384 -13.7384   27.384   16.497   11.458   16.497   11.458 0.000000 0.000000 
1 1 1    2    1    0 o   43.259   1.5836   38.907   3.9713   38.907   3.9713   38.907   3.9713   43.259   2.2395   43.259   2.2395 0.000000 0.000000 
1 1 1    2    1    1 o  222.214   2.0861  1018.76   19.118  1026.01   27.207  1011.68   26.870  222.995   2.9582  221.433   2.9421 1.561905 4.172162 
1 1 1    2    1    2 o  181.619   1.9114  680.389   14.317  672.912   20.090  688.105   20.408  180.605   2.6970  182.632   2.7093 -2.027161 3.822842 
1 1 1    2    1    3 o  180.961   2.7283  675.663   20.361  666.991   28.546  684.643   29.049  179.780   3.8498  182.143   3.8668 -2.362839 5.456526 
1 1 1    2    1    4 f  400.111   3.2950  3298.20   53.597  3265.49   69.951  3344.71   83.408  397.748   4.2640  402.473   5.0246 -4.724762 6.590061 
1 1 1    2    1    5 o  322.891   2.6245  2151.06   34.948  2168.66   49.892  2134.10   48.968  324.187   3.7314  321.596   3.6918 2.591583 5.249066 
1 1 1    2    1    6 o   33.624   2.8946   23.324   4.0132   22.650   5.6541   24.009   5.6973   33.133   4.1374   34.114   4.0492 -0.9800720 5.789194 
1 1 1    2    1    7 o  436.956   3.7811  3939.84   68.141  3929.77   95.940  3950.09   96.797  436.394   5.3303  437.519   5.3641 -1.124969 7.562164 
1 1 1    2    1    8 o  381.760   3.4354  3006.69   54.076  2973.25   75.376  3042.15   77.623  379.576   4.8147  383.944   4.9018 -4.368317 6.870898 
1 1 1    2    1    9 o  334.354   2.7265  2306.86   37.599  2307.61   53.190  2306.12   53.157  334.408   3.8565  334.300   3.8553 0.1080322 5.453025 
1 1 1    2    1   10 o  140.743   2.0348  408.480   11.809  420.722   16.909  396.826   16.499  142.800   2.8710  138.686   2.8844 4.114822 4.069662 
1 1 1    2    1   11 o  225.536   2.2659  1049.60   21.077  1045.53   29.708  1053.72   29.908  225.097   3.1999  225.976   3.2089 -0.8787994 4.531745 
1 1 1    2    1   12 o   61.122   3.7710   75.698   9.3920   86.698   14.745   68.188   12.183   64.784   5.5183   57.460   5.1409 7.323956 7.541906 
1 1 1    2    1   13 o  209.225   2.2662  903.162   19.556  897.198   27.524  909.240   27.789  208.528   3.2003  209.922   3.2096 -1.394424 4.532458 
1 1 1    2    1   14 o  127.992   2.3485  337.843   12.395  346.396   17.734  329.674   17.331  129.576   3.3184  126.409   3.3241 3.166412 4.696965 
1 1 1    2    1   15 o  104.876   2.7116  227.313   11.690  249.834   16.589  205.096   16.476  110.047   3.6549   99.704   4.0066 10.34238 5.423218 
1 1 1    2    1   16 o  222.307   2.5162  1019.10   23.060  1007.23   32.043  1031.85   33.211  220.966   3.5159  223.649   3.6004 -2.682816 5.032362 
1 1 1    2    1   17 o  417.462   3.2895  3595.96   56.636  3612.05   80.527  3580.22   79.670  418.385   4.6666  416.539   4.6374 1.846069 6.578931 
1 1 1    2    1   18 o  199.436   3.5460  819.554   29.143  789.388   40.227  852.875   42.279  195.580   4.9869  203.292   5.0424 -7.711151 7.091930 
1 1 1    2    1   19 o  225.831   2.6229  1051.79   24.425  1033.25   34.118  1071.29   34.982  223.790   3.6964  227.872   3.7221 -4.082031 5.245708 
1 1 1    2    1   20 o  133.326   2.9460  366.857   16.196  375.489   22.890  358.201   22.921  134.898   4.1140  131.754   4.2180 3.144012 5.892057 
1 1 1    2    1   21 o  106.155   3.9058  232.686   17.098  232.829   24.396  232.547   23.970  106.186   5.5705  106.124   5.4764 0.6208801E-01 7.811597 
1 1 1    2    1   22 o  239.508   3.1089  1183.93   30.709  1200.15   43.738  1168.17   43.126  241.126   4.3979  237.891   4.3954 3.234421 6.217819 
1 1 1    2    1   23 o  253.626   2.7321  1327.28   28.575  1349.32   40.899  1306.27   39.940  255.681   3.8783  251.571   3.8493 4.110291 5.464281 
1 1 1    2    1   24 o   87.642   4.1495  158.761   14.998  161.163   21.231  156.368   21.191   88.305   5.8293   86.979   5.9071 1.326080 8.299056 
1 1 1    2    1   25 o  344.590   3.0491  2451.96   43.328  2470.62   61.880  2434.01   60.688  345.873   4.3378  343.307   4.2861 2.566132 6.098100 
1 1 1    2    1   26 o  187.468   3.0889  723.342   23.691  705.640   31.392  746.761   36.107  184.833   4.1179  190.104   4.6051 -5.271515 6.177710 
1 1 1    2    1   27 o  265.063   3.2577  1452.21   35.607  1449.72   49.850  1454.80   50.878  264.837   4.5638  265.289   4.6499 -0.4522095 6.515349 
1 1 1    2    1   28 o  167.423   3.4128  579.605   23.562  576.072   33.587  583.029   33.063  166.916   4.8787  167.930   4.7736 -1.014389 6.825642 
1 1 1    2    1   29 o  131.816   3.4035  358.972   18.490  340.281   25.688  379.064   26.634  128.257   4.8560  135.376   4.7701 -7.119171 6.806991 
1 1 1    2    1   30 o   40.064   9.4055   32.180   18.338   25.230   26.443   38.619   25.453   37.401   13.448   42.726   13.153 -5.324165 18.81098 
1 1 1    2    1   31 o  134.998   4.1421  376.764   23.027  360.080   31.503  395.903   33.741  131.805   5.7950  138.191   5.9199 -6.385696 8.284161 
1 1 1    2    1   32 o  162.982   3.2417  549.679   21.786  535.168   30.731  564.343   30.891  160.814   4.6332  165.151   4.5351 -4.337158 6.483378 
1 1 1    2    1   33 o   85.209   5.1946  151.845   18.139  170.394   25.544  132.978   25.762   90.536   6.8407   79.882   7.8192 10.65315 10.38919 
1 1 1    2    1   34 o   89.091   5.9934  165.501   21.975  160.510   29.928  171.338   32.369   87.665   8.2773   90.518   8.6701 -2.853012 11.98688 
1 1 1    2    1   35 o   70.995   7.6987  101.129   21.703  127.886   37.362   87.502   26.664   77.573   11.677   64.417   10.036 13.15675 15.39748 
1 1 1    2    1   36 o   54.066   8.9134   65.658   19.721   81.010   27.765   50.028   28.017   60.686   11.514   47.446   13.609 13.24008 17.82670 
1 1 1    2    1   37 f  125.649   4.1710  328.857   21.608  339.069   31.026  319.237   30.111  127.542   5.8980  123.756   5.8993 3.786461 8.341958 
1 1 1    2    1   38 o   86.135   6.6924  158.330   23.738  167.431   34.787  150.399   32.473   88.420   9.5389   83.851   9.3896 4.569427 13.38489 
1 1 1    2    1   39 o   62.340   9.0660   88.219   23.002   59.763   31.427  121.049   33.757   50.374   14.403   74.305   11.015 -23.93112 18.13198 
1 1 1    2    1   40 o   79.607   5.7977  136.906   18.868  119.625   27.124  153.105   26.262   74.458   8.8325   84.756   7.5127 -10.29797 11.59542 
1 1 1    2    1   41 o   48.945   9.4084   57.896   22.073   20.582   32.016   91.701   30.474   35.439   14.268   62.452   12.268 -27.01389 18.81688 
1 1 1    2    1   42 o   28.292   8.7164  -2.7913   18.624 -13.6752   23.274   16.585   31.054   22.867   10.558   33.716   13.872 -10.84894 17.43275 
1 1 1    2    1   43 o   25.054   8.0951 -12.8190   19.015  -1.7364   26.170 -25.2118   27.674   26.990   11.934   23.118   10.940 3.872061 16.19012 
1 1 1    2    1   44 o   47.297   7.7147   51.079   18.039   7.1770   25.001   98.759   26.054   28.442   12.119   66.151   9.5493 -37.70905 15.42945 
1 1 1    2    1   45 o   36.011   9.6792   26.360   20.742   46.373   30.563   9.2706   28.242   42.142   14.514   29.880   12.810 12.26148 19.35842 
1 1 1    2    1   46 o   29.971   8.8488   7.9277   18.679  -8.0215   24.179   31.537   29.418   23.779   10.899   36.162   13.944 -12.38321 17.69756 
1 1 1    2    1   47 o   29.630   8.2695   14.391   16.170  -3.5570   22.963   32.045   22.774   23.900   10.825   35.361   12.505 -11.46112 16.53907 
1 1 1    2    1   48 o   46.323   8.1473   57.506   16.368   35.242   22.809   81.145   23.503   35.865   12.528   56.782   10.420 -20.91706 16.29456 
1 1 1    2    1   49 o   47.465   8.1707   61.272   17.804   30.724   24.999   92.711   25.361   33.711   12.890   61.218   10.045 -27.50682 16.34131 
1 1 1    2    1   50 o   27.137   8.5096   8.5328   19.572   22.043   27.005  -6.4164   28.407   30.089   12.698   24.185   11.332 5.904112 17.01910 
1 1 1    2    1   51 o   26.442   8.9585  -7.7908   28.232 -22.5077   42.571   3.7630   37.720   25.383   12.392   27.501   12.940 -2.118458 17.91700 
1 1 1    2    2    0 o  332.094   2.6444  2276.03   51.210  2276.03   51.210  2276.03   51.210  332.094   3.7398  332.094   3.7398 0.000000 0.000000 
1 1 1    2    2    1 o  332.240   2.6430  2277.68   36.214  2261.92   50.792  2293.98   51.646  331.072   3.7197  333.408   3.7558 -2.335876 5.286037 
1 1 1    2    2    2 o  220.787   2.9511  1006.09   26.874  1003.49   37.911  1008.71   38.100  220.501   4.1686  221.073   4.1785 -0.5717163 5.902285 
1 1 1    2    2    3 o   75.402   1.6800  117.280   5.2245  117.785   7.3778  116.772   7.3995   75.565   2.3672   75.239   2.3845 0.3257599 3.359982 
1 1 1    2    2    4 o   52.647   1.9183   57.209   4.1631   55.570   5.9200   58.812   5.8557   51.900   2.7656   53.394   2.6590 -1.493256 3.836524 
1 1 1    2    2    5 o  186.634   2.3149  718.586   17.819  716.950   25.092  720.249   25.308  186.420   3.2634  186.848   3.2841 -0.4279022 4.629778 
1 1 1    2    2    6 o  548.886   3.9290  6215.68   88.917  6281.32  127.710  6153.92  123.872  551.694   5.6126  546.078   5.4999 5.615601 7.858101 
1 1 1    2    2    7 o  440.577   3.8045  4003.50   69.092  3947.35   95.801  4064.37   99.740  437.363   5.3108  443.790   5.4491 -6.427765 7.609025 
1 1 1    2    2    8 o  304.280   2.7728  1910.02   34.436  1908.42   45.524  1912.18   52.649  304.141   3.6291  304.419   4.1933 -0.2776184 5.545647 
1 1 1    2    2    9 o  119.538   2.1736  292.334   10.587  310.176   16.494  279.833   13.806  122.611   3.2615  116.466   2.8741 6.145058 4.347184 
1 1 1    2    2   10 o  186.184   2.1159  715.190   16.248  720.843   23.081  709.636   22.876  186.914   2.9940  185.455   2.9907 1.458496 4.231852 
1 1 1    2    2   11 o   74.368   2.8155  114.144   8.6293  114.535   12.458  113.783   11.965   74.489   4.0548   74.247   3.9072 0.2423630 5.630943 
1 1 1    2    2   12 o   91.312   2.5773  172.663   9.6152  167.518   14.514  176.688   12.836   90.091   3.9061   92.534   3.3633 -2.442810 5.154526 
1 1 1    2    2   13 o  290.485   2.7750  1743.56   32.968  1758.18   43.973  1724.80   49.820  291.891   3.6526  289.078   4.1785 2.813202 5.549910 
1 1 1    2    2   14 o  139.643   2.2940  402.262   13.210  412.912   18.775  391.820   18.590  141.473   3.2176  137.812   3.2707 3.661591 4.588046 
1 1 1    2    2   15 o  234.347   2.4465  1132.57   23.643  1151.88   33.800  1114.08   33.085  236.302   3.4680  232.392   3.4518 3.909790 4.893050 
1 1 1    2    2   16 o  499.762   3.7217  5154.46   76.711  5144.08  108.072  5165.01  108.904  499.255   5.2484  500.268   5.2781 -1.012390 7.443337 
1 1 1    2    2   17 o  217.312   2.9070  973.798   26.048  1004.02   37.320  945.093   36.372  220.598   4.1018  214.027   4.1203 6.571655 5.813946 
1 1 1    2    2   18 o  180.805   2.5467  674.312   18.989  660.814   26.699  688.129   27.012  178.974   3.6169  182.636   3.5860 -3.662094 5.093306 
1 1 1    2    2   19 o  233.575   3.0235  1124.49   29.105  1095.15   40.221  1156.76   42.170  230.380   4.2329  236.769   4.3183 -6.388977 6.046962 
1 1 1    2    2   20 o   30.993   6.8260   13.788   11.987 -10.0610   17.086   36.906   16.822   20.577   9.3268   41.408   9.9692 -20.83130 13.65193 
1 1 1    2    2   21 o  154.046   3.2242  489.924   20.478  484.593   29.251  495.047   28.677  153.222   4.6286  154.870   4.4896 -1.648178 6.448311 
1 1 1    2    2   22 o  423.223   3.8802  3699.02   67.725  3724.25   96.493  3674.53   95.079  424.643   5.5095  421.804   5.4652 2.839020 7.760320 
1 1 1    2    2   23 o  757.980   5.3076 11880.19  165.792 12064.23  240.147 11712.59  229.168  763.545   7.6257  752.415   7.3847 11.12958 10.61526 
1 1 1    2    2   24 o  123.602   3.3935  315.577   17.295  313.393   24.703  317.677   24.222  123.180   4.8623  124.024   4.7352 -0.8439331 6.787043 
1 1 1    2    2   25 o   92.640   4.1832  177.635   15.969  183.508   22.374  171.537   22.798   94.209   5.7582   91.071   6.0696 3.137947 8.366402 
1 1 1    2    2   26 o  138.488   3.1784  396.127   18.151  387.300   25.378  405.370   25.970  136.909   4.4943  140.067   4.4955 -3.157303 6.356765 
1 1 1    2    2   27 o   89.015   4.8882  164.083   17.853  142.283   24.732  187.802   25.798   82.826   7.2398   95.205   6.5699 -12.37882 9.776379 
1 1 1    2    2   28 f  113.363   4.0394  265.542   18.866  275.266   27.474  256.865   25.952  115.319   5.7763  111.407   5.6481 3.911903 8.078760 
1 1 1    2    2   29 o   22.187   7.0677 -15.9652   14.369 -32.4218   20.033   1.4734   20.622   18.121   8.7664   26.253   11.089 -8.131683 14.13540 
1 1 1    2    2   30 o   33.391   9.7804   3.8743   21.466  -4.7671   26.852   19.173   35.729   28.102   12.268   38.681   15.236 -10.57893 19.56070 
1 1 1    2    2   31 o   50.111   9.1253   55.391   19.084   62.657   26.270   47.270   27.771   53.496   12.179   46.726   13.592 6.769775 18.25062 
1 1 1    2    2   32 o   57.062   7.7608   69.826   17.848   81.343   25.538   58.832   24.953   62.306   9.9378   51.817   11.923 10.48853 15.52169 
1 1 1    2    2   33 o   87.691   5.2917  162.562   18.840  185.378   25.838  136.665   27.529   94.451   6.6327   80.930   8.2472 13.52106 10.58348 
1 1 1    2    2   34 o  138.388   3.6967  397.058   21.092  409.489   29.838  384.642   29.820  140.565   5.1467  136.212   5.3079 4.352859 7.393404 
1 1 1    2    2   35 o   74.692   6.4431  117.147   19.843  120.268   28.474  114.201   27.668   75.656   9.1253   73.727   9.0987 1.928810 12.88629 
1 1 1    2    2   36 o   45.943   9.3470   45.902   19.051   33.047   26.245   60.221   27.698   40.015   13.454   51.871   12.979 -11.85601 18.69404 
1 1 1    2    2   37 o   56.738   8.0278   70.801   18.401   60.141   26.292   81.033   25.760   51.775   12.463   61.701   10.123 -9.925976 16.05559 
1 1 1    2    2   38 o   34.748   9.9395   14.529   22.147   21.140   32.250   8.6290   30.466   36.877   14.491   32.618   13.608 4.258900 19.87901 
1 1 1    2    2   39 o   48.701   9.6053   55.970   21.495   78.898   29.269   29.129   31.669   58.552   12.500   38.850   14.587 19.70165 19.21069 
1 1 1    2    2   40 o   33.826   9.0364   20.581   17.434   26.946   24.553   14.111   24.757   36.155   12.963   31.496   12.594 4.659111 18.07288 
1 1 1    2    2   41 o   31.230   8.5117   14.419   16.581  -2.0075   23.966   29.502   22.965   26.033   11.470   36.426   12.579 -10.39320 17.02350 
1 1 1    2    2   42 o   29.735   8.5962   11.827   16.731   12.374   23.554   11.269   23.769   29.872   12.162   29.598   12.152 0.2740173 17.19240 
1 1 1    2    2   43 f   30.847   8.5417   12.520   17.001   30.219   24.036  -5.1996   24.050   36.580   12.856   25.113   11.251 11.46744 17.08343 
1 1 1    2    2   44 o   39.576   9.8083   37.114   19.374   44.561   31.239   32.460   24.697   42.061   14.663   37.091   13.031 4.969448 19.61652 
1 1 1    2    2   45 o   58.390   9.3016   90.767   22.870  117.790   30.639   56.769   34.366   71.137   10.443   45.643   15.396 25.49414 18.60326 
1 1 1    2    2   46 o   33.492   9.9759   17.547   24.350   35.053   34.139  -0.5801   34.740   37.638   14.871   29.347   13.301 8.290586 19.95172 
1 1 1    2    2   47 o   42.450   9.0100   48.458   17.141   54.169   24.237   42.744   24.245   45.053   12.568   39.847   12.914 5.206535 18.02004 
1 1 1    2    2   48 o   35.829   8.0381   29.663   16.456  -2.0523   23.297   61.243   23.247   23.901   10.856   47.756   11.857 -23.85506 16.07613 
1 1 1    2    2   49 o   24.064   7.6907  -3.8677   16.916   11.752   23.828 -19.7379   24.018   27.389   11.755   20.738   9.9201 6.650290 15.38146 
1 1 1    2    2   50 o   24.624   8.0529  -6.4956   19.904   13.796   28.285 -26.3981   28.013   28.167   12.433   21.081   10.238 7.085470 16.10588 
1 1 1    2    2   51 o   28.469   9.4320   8.9449   27.870   4.1433   40.256   13.365   38.624   27.925   13.209   29.013   13.467 -1.087732 18.86403 
1 1 1    2    3    0 o   45.565   1.8472   43.243   4.8725   43.243   4.8725   43.243   4.8725   45.565   2.6123   45.565   2.6123 0.000000 0.000000 
1 1 1    2    3    1 o  182.482   1.9129  686.840   14.396  678.786   20.192  695.167   20.530  181.394   2.6989  183.570   2.7116 -2.175415 3.825835 
1 1 1    2    3    2 o  173.334   2.1757  619.794   15.553  612.555   21.828  627.259   22.165  172.306   3.0715  174.362   3.0822 -2.055496 4.351311 
1 1 1    2    3    3 o  456.123   4.3188  4310.09   80.198  4373.84  105.711  4223.65  123.098  460.179   5.5696  452.067   6.6021 8.111969 8.637626 
1 1 1    2    3    4 o  359.678   3.0358  2674.35   44.752  2712.75   60.253  2627.10   66.836  362.578   4.0291  356.778   4.5420 5.799438 6.071548 
1 1 1    2    3    5 o  408.044   3.0945  3434.96   52.075  3414.78   73.060  3455.79   74.243  406.828   4.3542  409.261   4.3984 -2.433258 6.189041 
1 1 1    2    3    6 o  380.121   2.9459  2980.87   46.185  2987.11   65.466  2974.68   65.167  380.517   4.1713  379.725   4.1610 0.7920837 5.891819 
1 1 1    2    3    7 o  383.765   3.4337  3039.15   54.349  3042.37   76.929  3035.94   76.792  383.968   4.8577  383.562   4.8542 0.4057617 6.867333 
1 1 1    2    3    8 o  189.140   2.0804  737.104   16.219  763.242   23.455  713.152   22.452  192.349   2.9565  185.931   2.9278 6.418289 4.160872 
1 1 1    2    3    9 o  188.751   2.4292  735.136   18.911  739.794   26.837  730.542   26.652  189.345   3.4365  188.158   3.4343 1.187653 4.858366 
1 1 1    2    3   10 o  244.710   2.3172  1235.69   23.387  1237.61   33.136  1233.79   33.014  244.899   3.2806  244.521   3.2735 0.3778992 4.634422 
1 1 1    2    3   11 o  213.230   2.5651  937.911   22.553  919.286   31.462  957.599   32.347  211.053   3.6144  215.405   3.6409 -4.351959 5.130286 
1 1 1    2    3   12 o  235.265   2.3252  1142.00   22.561  1134.15   31.683  1150.07   32.134  234.446   3.2766  236.084   3.3002 -1.638351 4.650500 
1 1 1    2    3   13 o  178.479   2.5819  656.845   18.999  678.267   27.294  636.709   26.463  181.300   3.6501  175.658   3.6526 5.642075 5.163825 
1 1 1    2    3   14 f  411.206   3.1940  3489.44   54.169  3500.70   76.942  3478.37   76.275  411.863   4.5295  410.549   4.5046 1.313782 6.388045 
1 1 1    2    3   15 o  195.766   2.3716  790.555   19.149  792.219   27.110  788.898   27.052  195.972   3.3540  195.561   3.3539 0.4111786 4.743234 
1 1 1    2    3   16 o  510.645   3.7827  5380.89   79.652  5338.37  111.349  5425.45  113.988  508.583   5.3083  512.708   5.3904 -4.124969 7.565400 
1 1 1    2    3   17 o   96.854   4.1195  199.198   15.853  219.180   20.525  169.650   24.958  103.061   4.8285   90.646   6.6758 12.41522 8.238961 
1 1 1    2    3   18 o  563.605   4.1007  6556.63   95.310  6519.04  133.567  6595.63  136.046  561.963   5.7627  565.247   5.8356 -3.284363 8.201353 
1 1 1    2    3   19 o  232.397   3.0031  1114.41   28.785  1116.43   40.709  1112.40   40.706  232.607   4.2433  232.187   4.2506 0.4204102 6.006132 
1 1 1    2    3   20 o  272.023   2.6978  1526.34   30.263  1552.31   43.254  1501.45   42.356  274.288   3.8235  269.758   3.8070 4.530273 5.395549 
1 1 1    2    3   21 o  298.520   3.2409  1839.44   39.903  1829.53   56.324  1849.42   56.539  297.713   4.5870  299.327   4.5797 -1.614349 6.481841 
1 1 1    2    3   22 o  151.803   2.7907  474.690   17.454  505.559   25.276  446.554   24.131  156.512   3.9156  147.094   3.9776 9.418716 5.581493 
1 1 1    2    3   23 o  133.532   3.4861  368.616   18.887  370.303   24.622  366.206   29.439  133.921   4.4577  133.142   5.3610 0.7787018 6.972150 
1 1 1    2    3   24 o  194.329   2.8257  779.553   22.643  757.011   31.861  802.554   32.185  191.490   4.0342  197.170   3.9577 -5.680115 5.651371 
1 1 1    2    3   25 o  165.444   2.9647  565.234   20.230  559.875   28.495  570.680   28.724  164.653   4.1960  166.235   4.1894 -1.581543 5.929398 
1 1 1    2    3   26 o   90.673   5.5629  170.392   20.029  169.824   25.119  171.385   33.191   90.541   6.7264   90.805   8.8621 -0.2640228 11.12572 
1 1 1    2    3   27 o  186.071   3.2168  717.144   24.466  703.663   36.977  727.643   32.631  184.482   4.8597  187.659   4.2159 -3.176880 6.433514 
1 1 1    2    3   28 o  103.050   4.4254  220.782   18.724  198.143   26.627  242.925   26.334   97.779   6.6026  108.321   5.8944 -10.54150 8.850863 
1 1 1    2    3   29 o  104.902   4.1779  225.946   17.995  202.659   24.190  254.799   26.927   98.903   5.9302  110.902   5.8868 -11.99916 8.355880 
1 1 1    2    3   30 o   32.162   9.0425   11.210   18.188   3.5724   26.295   18.217   25.186   30.029   12.594   34.295   12.980 -4.266535 18.08508 
1 1 1    2    3   31 o   75.592   5.3326  118.810   16.593  108.955   23.166  129.193   23.778   72.355   7.7626   78.829   7.3136 -6.474106 10.66520 
1 1 1    2    3   32 o   80.247   5.2889  134.545   17.390  116.741   24.558  152.450   24.628   74.853   7.9546   85.640   6.9723 -10.78698 10.57779 
1 1 1    2    3   33 o   98.032   4.4496  200.051   17.932  182.000   25.418  217.936   25.301   93.586   6.5850  102.477   5.9861 -8.890953 8.899232 
1 1 1    2    3   34 o  101.907   4.4662  216.165   18.738  226.477   26.189  205.348   26.822  104.429   6.0803   99.384   6.5434 5.045471 8.932316 
1 1 1    2    3   35 o   63.797   7.6029   88.172   19.365   76.805   27.879   98.769   26.918   59.103   11.849   68.490   9.5292 -9.387115 15.20574 
1 1 1    2    3   36 o  111.699   4.3637  259.769   20.078  241.817   27.953  278.900   28.856  107.693   6.2932  115.705   6.0468 -8.011452 8.727465 
1 1 1    2    3   37 o   93.299   5.6931  181.314   21.651  171.236   28.219  195.735   33.757   90.290   7.5777   96.307   8.4985 -6.017433 11.38621 
1 1 1    2    3   38 o   27.434   8.6781  -9.2376   19.647  -2.1976   31.505 -13.7174   25.132   30.354   13.268   24.515   11.189 5.838255 17.35624 
1 1 1    2    3   39 o   40.718   9.2806   36.446   19.221   14.117   29.035   53.864   25.644   33.265   13.518   48.171   12.719 -14.90658 18.56120 
1 1 1    2    3   40 o   33.271   9.0282   19.335   17.389   20.528   24.772   18.176   24.416   33.757   12.849   32.786   12.686 0.9706306 18.05635 
1 1 1    2    3   41 o   29.267   8.5794   9.4731   16.977   7.9941   23.876   10.986   24.145   28.745   12.024   29.788   12.241 -1.043152 17.15883 
1 1 1    2    3   42 o   39.685   9.3308   36.243   18.489   23.064   26.058   49.605   26.239   34.304   13.150   45.066   13.242 -10.76216 18.66155 
1 1 1    2    3   43 o   23.523   7.6575 -12.8122   17.149 -10.5748   24.199 -15.0695   24.306   23.954   10.951   23.092   10.706 0.8619061 15.31490 
1 1 1    2    3   44 o   41.578   9.5353   43.123   18.706   45.405   26.687   40.919   26.227   42.513   13.525   40.642   13.445 1.871193 19.07060 
1 1 1    2    3   45 o   28.104   8.5272   6.4875   17.860   12.474   25.173   0.4199   25.343   29.700   12.378   26.507   11.731 3.193031 17.05435 
1 1 1    2    3   46 o   27.537   8.7002   0.9934   20.215  -2.2565   28.411   4.3258   28.769   26.750   12.085   28.325   12.519 -1.575054 17.40040 
1 1 1    2    3   47 f   30.487   8.6709   17.175   17.394   30.078   24.454   3.9609   24.748   34.562   12.849   26.413   11.646 8.149744 17.34172 
1 1 1    2    3   48 o   31.027   9.4924   17.568   22.536   8.6882   31.959   26.351   31.782   28.985   12.979   33.068   13.856 -4.082815 18.98479 
1 1 1    2    3   49 f   37.066   8.9502   37.461   17.824   58.091   25.513   17.790   24.913   44.800   13.027   29.332   12.277 15.46852 17.90040 
1 1 1    2    3   50 o   29.711   9.0012   19.559   19.904   10.503   27.768   29.128   28.546   27.276   12.164   32.147   13.272 -4.871347 18.00241 
1 1 1    2    3   51 o   34.823   10.459   32.971   28.767   86.125   42.864 -10.5887   38.803   43.926   16.859   25.720   12.382 18.20542 20.91721 
1 1 1    2    4    0 o  373.435   2.8729  2878.00   62.560  2878.00   62.560  2878.00   62.560  373.435   4.0628  373.435   4.0628 0.000000 0.000000 
1 1 1    2    4    1 o  174.161   2.0364  622.352   14.417  645.306   22.554  606.491   18.748  176.856   3.0920  171.465   2.6510 5.391479 4.072866 
1 1 1    2    4    2 o  172.363   2.6491  612.533   18.824  629.565   27.112  596.682   26.156  174.674   3.7633  170.052   3.7293 4.622116 5.298143 
1 1 1    2    4    3 o  574.813   4.7077  6823.23  111.609  6835.89  158.229  6810.70  157.452  575.343   6.6680  574.284   6.6475 1.058777 9.415455 
1 1 1    2    4    4 o  486.242   3.8240  4884.24   76.097  4921.00  101.706  4837.50  114.695  488.344   5.0496  484.140   5.7439 4.203949 7.647910 
1 1 1    2    4    5 o  443.034   3.2966  4049.62   60.237  4041.21   84.937  4058.13   85.441  442.572   4.6531  443.497   4.6710 -0.9247437 6.593177 
1 1 1    2    4    6 o  225.213   2.3445  1049.31   21.658  1078.44   29.374  1014.61   32.060  228.651   3.1148  221.774   3.5050 6.876740 4.689016 
1 1 1    2    4    7 o  297.054   2.5217  1816.13   30.831  1885.31   45.399  1756.91   42.001  302.289   3.6413  291.819   3.4897 10.46979 5.043488 
1 1 1    2    4    8 o   52.306   2.6451   56.435   5.6985   60.613   8.1576   52.453   7.9637   54.197   3.6494   50.416   3.8299 3.781727 5.290153 
1 1 1    2    4    9 o  236.617   2.6204  1155.35   25.570  1165.24   36.472  1145.80   35.859  237.612   3.7216  235.623   3.6899 1.989426 5.240798 
1 1 1    2    4   10 o  172.412   2.1037  613.156   14.957  623.305   21.389  603.444   20.923  173.807   2.9837  171.016   2.9663 2.790909 4.207320 
1 1 1    2    4   11 o  136.691   2.2695  386.210   12.708  391.553   17.071  379.568   19.031  137.758   3.0046  135.624   3.4022 2.134415 4.539016 
1 1 1    2    4   12 o  225.221   2.2994  1046.61   21.359  1043.56   30.140  1049.68   30.273  224.892   3.2494  225.551   3.2543 -0.6588745 4.598793 
1 1 1    2    4   13 o  511.066   4.3310  5394.72   91.291  5399.98  129.276  5389.49  128.934  511.314   6.1301  510.818   6.1198 0.4957886 8.661923 
1 1 1    2    4   14 o  373.187   2.9953  2873.55   46.103  2868.30   65.094  2878.84   65.306  372.845   4.2330  373.529   4.2390 -0.6840820 5.990620 
1 1 1    2    4   15 o  775.498   5.3715 12419.56  171.798 12373.08  241.456 12467.22  244.489  774.034   7.5633  776.963   7.6294 -2.929321 10.74302 
1 1 1    2    4   16 o  324.018   2.8117  2164.46   37.553  2122.03   52.041  2210.56   54.244  320.709   3.9343  327.327   4.0180 -6.617920 5.623437 
1 1 1    2    4   17 o  321.048   3.2450  2126.73   42.967  2121.23   60.500  2132.33   61.034  320.630   4.5749  321.466   4.6033 -0.8364258 6.490017 
1 1 1    2    4   18 f  258.113   2.6012  1373.86   27.684  1400.14   39.723  1349.05   38.603  260.510   3.6970  255.715   3.6602 4.795486 5.202370 
1 1 1    2    4   19 o  106.933   3.7510  237.096   16.446  208.621   23.354  265.105   23.163  100.529   5.6327  113.337   4.9552 -12.80797 7.502038 
1 1 1    2    4   20 o  414.681   3.8016  3549.51   65.009  3519.47   90.969  3580.87   92.936  412.891   5.3418  416.471   5.4104 -3.580261 7.603162 
1 1 1    2    4   21 o  200.754   2.6103  831.660   21.613  836.233   30.549  827.076   30.581  201.307   3.6794  200.201   3.7036 1.106033 5.220578 
1 1 1    2    4   22 o  269.367   2.9564  1498.68   32.472  1504.23   42.860  1491.21   49.753  269.972   3.8492  268.763   4.4883 1.209106 5.912816 
1 1 1    2    4   23 o  157.832   3.4668  513.748   22.551  493.873   31.189  535.520   32.645  154.639   4.8902  161.026   4.9153 -6.387009 6.933567 
1 1 1    2    4   24 o  245.469   3.0242  1243.62   30.304  1248.28   46.330  1240.15   40.063  245.848   4.5691  245.091   3.9632 0.7570190 6.048470 
1 1 1    2    4   25 o  179.021   3.0988  661.734   22.794  659.328   30.898  664.607   33.764  178.677   4.1928  179.366   4.5640 -0.6898346 6.197551 
1 1 1    2    4   26 o   92.887   4.7157  179.260   17.983  199.389   25.474  159.262   25.391   98.123   6.2946   87.651   7.0235 10.47251 9.431383 
1 1 1    2    4   27 o  166.329   2.9794  570.889   20.423  603.909   29.432  540.227   28.362  170.964   4.1740  161.693   4.2528 9.271133 5.958900 
1 1 1    2    4   28 o   98.494   4.0399  200.737   16.392  187.733   22.915  214.364   23.459   95.220   5.8349  101.767   5.5889 -6.546745 8.079733 
1 1 1    2    4   29 o   84.053   7.2607  146.201   24.832  138.977   32.235  156.743   38.943   81.601   9.5779   86.505   10.915 -4.904335 14.52143 
1 1 1    2    4   30 o  162.390   3.1229  545.441   20.906  547.435   29.137  543.325   30.013  162.704   4.3419  162.076   4.4898 0.6275024 6.245876 
1 1 1    2    4   31 o  151.961   3.2603  477.970   20.426  488.886   28.716  466.793   29.060  153.727   4.5291  150.196   4.6910 3.530930 6.520629 
1 1 1    2    4   32 o  101.364   5.1917  214.571   21.620  229.103   30.028  198.930   31.154  104.989   6.9346   97.739   7.7281 7.249733 10.38332 
1 1 1    2    4   33 o   67.464   6.1746   95.067   16.928   74.699   23.259  118.005   24.682   59.709   9.4448   75.219   7.9560 -15.51023 12.34914 
1 1 1    2    4   34 o   90.283   5.0254  169.530   18.689  181.925   26.916  157.989   25.971   93.481   6.9810   87.085   7.2307 6.396217 10.05076 
1 1 1    2    4   35 o   48.568   8.1707   50.266   17.766   81.478   25.621   21.361   24.656   62.124   9.9993   35.011   12.925 27.11267 16.34142 
1 1 1    2    4   36 o   58.057   7.8756   74.173   18.169   75.160   25.475   73.152   25.920   58.510   10.959   57.604   11.313 0.9065056 15.75116 
1 1 1    2    4   37 o   65.241   9.6426   93.737   25.640  124.861   38.234   68.299   34.565   75.906   12.213   54.577   14.926 21.32940 19.28519 
1 1 1    2    4   38 o   82.275   5.6792  143.199   19.155  122.831   26.382  165.906   27.855   75.991   8.4175   88.558   7.6262 -12.56733 11.35845 
1 1 1    2    4   39 o   25.309   7.9781  -6.2882   16.878  -3.9586   24.291  -8.4629   23.470   26.083   11.517   24.535   11.043 1.548309 15.95618 
1 1 1    2    4   40 o   77.550   7.0196  136.779   21.092  152.454   26.791  111.225   34.206   84.506   7.6865   70.594   11.748 13.91165 14.03920 
1 1 1    2    4   41 o   34.731   9.0386   25.110   17.039   24.121   24.521   26.034   23.693   34.450   12.855   35.013   12.709 -0.5631409 18.07728 
1 1 1    2    4   42 o   59.750   8.0292   82.859   19.295   68.866   26.850   97.802   27.746   53.498   12.409   66.002   10.192 -12.50383 16.05835 
1 1 1    2    4   43 o   23.704   7.5637  -9.5952   16.158   3.0138   22.611 -22.7512   23.097   26.451   11.403   20.958   9.9403 5.493380 15.12732 
1 1 1    2    4   44 o   27.788   8.8404  -3.8598   21.059  -4.1081   27.919  -3.5321   32.077   26.871   12.074   28.704   12.916 -1.832952 17.68071 
1 1 1    2    4   45 f   69.512   6.1841  108.800   17.720  110.569   24.816  106.960   25.312   70.204   8.5703   68.819   8.9176 1.384689 12.36827 
1 1 1    2    4   46 o   54.090   7.7925   72.571   17.032   59.014   24.509   85.236   23.687   47.667   12.362   60.513   9.4908 -12.84603 15.58503 
1 1 1    2    4   47 o   32.403   8.7463   23.375   16.847   11.450   23.565   35.843   24.094   28.003   11.842   36.804   12.875 -8.800999 17.49251 
1 1 1    2    4   48 o   35.473   8.9856   33.400   17.861   16.112   25.529   49.976   24.997   29.214   12.338   41.731   13.066 -12.51707 17.97119 
1 1 1    2    4   49 o   23.964   7.6948  -5.0442   17.198 -22.0626   24.293   12.055   24.350   20.440   9.8294   27.488   11.842 -7.048281 15.38968 
1 1 1    2    4   50 o   26.563   8.8558 -11.3587   26.396 -45.8229   38.401   19.513   36.344   22.580   11.169   30.546   13.746 -7.965916 17.71152 
1 1 1    2    4   51 o   26.343   8.9340  -5.5187   27.860  -5.6409   41.415  -5.4177   37.654   26.691   12.835   25.996   12.431 0.6947498 17.86805 
1 1 1    2    5    0 o   93.507   1.6443  180.660   8.9556  180.660   8.9556  180.660   8.9556   93.507   2.3254   93.507   2.3254 0.000000 0.000000 
1 1 1    2    5    1 o  342.892   2.9170  2428.61   40.937  2401.32   61.656  2450.13   54.746  341.158   4.3818  344.626   3.8516 -3.468079 5.833930 
1 1 1    2    5    2 o  367.602   3.2868  2786.92   49.810  2751.44   69.233  2825.00   71.715  365.179   4.5967  370.024   4.6991 -4.844818 6.573529 
1 1 1    2    5    3 o  443.328   3.7891  4053.37   69.240  4116.49  100.012  3995.27   95.954  446.637   5.4291  440.020   5.2872 6.617584 7.578275 
1 1 1    2    5    4 o  582.298   4.4408  7009.81  106.074  7110.04  143.313  6888.36  157.746  586.938   5.9201  577.657   6.6210 9.280945 8.881695 
1 1 1    2    5    5 o  243.315   2.4190  1223.09   24.072  1235.70   32.123  1206.95   36.354  244.752   3.1822  241.877   3.6441 2.874664 4.838008 
1 1 1    2    5    6 o  398.736   3.5206  3280.15   57.871  3328.37   83.366  3235.30   80.398  401.559   5.0336  395.913   4.9236 5.646088 7.041197 
1 1 1    2    5    7 o  259.571   2.3420  1390.14   25.072  1396.10   35.607  1384.27   35.310  260.123   3.3188  259.019   3.3052 1.104370 4.683936 
1 1 1    2    5    8 o  127.398   1.9729  334.847   10.366  335.537   14.732  334.171   14.589  127.528   2.8008  127.269   2.7793 0.2594376 3.945773 
1 1 1    2    5    9 o  235.338   2.4466  1143.15   23.506  1144.40   31.110  1141.49   35.884  235.499   3.2029  235.176   3.6994 0.3235016 4.893297 
1 1 1    2    5   10 o  191.891   2.7718  760.513   21.470  757.646   34.026  762.409   27.676  191.573   4.3064  192.209   3.4911 -0.6362915 5.543684 
1 1 1    2    5   11 o  161.943   2.1360  541.047   14.266  546.404   20.289  535.808   20.065  162.736   3.0228  161.150   3.0188 1.585602 4.272037 
1 1 1    2    5   12 o  186.031   2.2153  713.578   16.991  728.939   24.454  699.241   23.624  187.965   3.1543  184.098   3.1113 3.867661 4.430575 
1 1 1    2    5   13 o   83.105   3.0639  141.512   10.343  148.180   16.255  136.975   13.407   84.734   4.6511   81.476   3.9897 3.258141 6.127871 
1 1 1    2    5   14 f  447.228   3.6812  4120.50   66.961  4085.64   87.521  4169.72  103.987  444.975   4.7688  449.480   5.6092 -4.505341 7.362401 
1 1 1    2    5   15 o  399.160   3.1577  3287.52   51.985  3284.84   73.479  3290.21   73.556  398.997   4.4651  399.323   4.4661 -0.3258362 6.315313 
1 1 1    2    5   16 o  495.046   4.2676  5057.32   87.100  5003.42  121.214  5114.86  125.240  492.325   5.9694  497.767   6.1003 -5.441833 8.535113 
1 1 1    2    5   17 o  462.472   3.5210  4411.85   67.128  4355.80   93.231  4472.20   96.732  459.427   4.9201  465.517   5.0381 -6.090210 7.042035 
1 1 1    2    5   18 o  265.628   2.8573  1454.48   30.854  1447.96   40.316  1463.71   47.935  264.921   3.6897  266.335   4.3637 -1.414154 5.714547 
1 1 1    2    5   19 o  564.376   4.7577  6578.52  110.746  6589.81  156.987  6567.33  156.253  564.857   6.7385  563.895   6.7184 0.9619141 9.515437 
1 1 1    2    5   20 o  309.573   3.7037  1974.07   46.083  1998.53   74.220  1958.72   58.787  311.092   5.7845  308.055   4.6268 3.037170 7.407308 
1 1 1    2    5   21 o  346.305   3.4303  2473.76   48.962  2419.53   67.733  2533.11   70.857  342.338   4.7971  350.273   4.9047 -7.934387 6.860629 
1 1 1    2    5   22 f  136.383   2.9834  383.936   16.778  382.503   23.456  385.437   24.009  136.124   4.1778  136.643   4.2601 -0.5184784 5.966819 
1 1 1    2    5   23 o  148.926   3.5449  456.953   21.742  425.057   29.969  492.398   31.592  143.451   5.0652  154.402   4.9608 -10.95090 7.089855 
1 1 1    2    5   24 o   70.305   5.1526  103.932   14.565  131.022   20.660   77.165   20.537   79.591   6.2936   61.019   8.1601 18.57169 10.30513 
1 1 1    2    5   25 o  124.041   3.3856  317.956   17.316  327.574   24.551  308.437   24.426  125.911   4.7276  122.172   4.8474 3.739349 6.771129 
1 1 1    2    5   26 o   66.475   6.0720   91.768   16.632   89.777   22.936   93.976   24.153   65.723   8.4614   67.227   8.7110 -1.503929 12.14400 
1 1 1    2    5   27 o  109.428   3.7088  248.244   16.692  267.819   23.505  228.327   23.709  113.804   5.0077  105.051   5.4721 8.753197 7.417589 
1 1 1    2    5   28 o   86.763   4.3340  156.091   15.469  142.065   21.726  170.514   22.030   82.791   6.3625   90.735   5.8868 -7.944473 8.668095 
1 1 1    2    5   29 o  116.972   5.0016  282.201   24.052  311.514   35.696  257.829   32.549  122.500   7.0652  111.444   7.0814 11.05614 10.00318 
1 1 1    2    5   30 o  175.140   3.0143  634.291   21.773  630.936   30.789  637.647   30.795  174.675   4.2737  175.604   4.2519 -0.9289398 6.028507 
1 1 1    2    5   31 o  164.014   3.1636  556.099   21.391  543.053   29.730  570.103   30.802  162.023   4.4489  166.004   4.4988 -3.980301 6.327108 
1 1 1    2    5   32 f   57.352   8.3832   69.670   19.684   41.145   26.430  105.199   29.496   43.874   13.385   70.829   10.097 -26.95494 16.76644 
1 1 1    2    5   33 o  193.797   3.1258  777.263   24.984  775.932   35.175  778.617   35.491  193.632   4.4044  193.962   4.4365 -0.3298035 6.251529 
1 1 1    2    5   34 o   85.478   5.4939  152.936   19.293  137.830   27.331  167.936   27.237   81.206   8.1604   89.749   7.3580 -8.543243 10.98777 
1 1 1    2    5   35 o   59.983   7.3185   77.244   17.725   80.285   25.099   74.218   25.036   61.663   9.8688   58.302   10.810 3.361267 14.63700 
1 1 1    2    5   36 o   49.926   8.6498   55.796   17.773   47.145   25.224   64.326   25.047   46.009   12.817   53.843   11.619 -7.834652 17.29958 
1 1 1    2    5   37 f   61.077   10.443   86.083   25.992   85.423   37.798   86.675   35.800   60.727   15.143   61.427   14.384 -0.6998405 20.88537 
1 1 1    2    5   38 o   72.629   6.2176  113.229   18.483   98.225   26.248  127.986   26.032   67.651   9.4071   77.607   8.1327 -9.956276 12.43518 
1 1 1    2    5   39 o   29.797   8.6343   9.5147   17.023   4.8569   24.271   14.024   23.881   28.427   12.020   31.167   12.399 -2.739862 17.26856 
1 1 1    2    5   40 o   58.076   9.2172   79.884   21.581   89.801   29.805   68.955   31.289   62.458   12.006   53.695   13.988 8.763031 18.43444 
1 1 1    2    5   41 f   26.896   8.2280   0.2244   17.035  -9.0975   23.609   10.350   24.605   24.078   10.933   29.714   12.299 -5.635567 16.45592 
1 1 1    2    5   42 o   26.506   8.1383  -1.4343   17.102 -14.8248   24.294   11.722   24.080   23.178   10.731   29.833   12.238 -6.655083 16.27662 
1 1 1    2    5   43 o   41.447   8.8377   41.968   16.791   51.987   23.241   31.028   24.286   46.220   12.063   36.675   12.919 9.545162 17.67534 
1 1 1    2    5   44 f   46.218   9.7590   54.015   21.639   28.627   30.631   79.306   30.573   36.438   14.178   55.998   13.414 -19.56032 19.51805 
1 1 1    2    5   45 o   37.066   8.5825   31.136   16.928   8.7484   23.931   53.556   23.948   28.114   11.914   46.018   12.357 -17.90321 17.16503 
1 1 1    2    5   46 o   29.137   8.4270   13.662   16.463   4.0722   23.199   23.390   23.365   26.048   11.386   32.225   12.426 -6.176987 16.85390 
1 1 1    2    5   47 o   22.424   7.4728 -21.4364   17.718 -37.5379   23.151   1.3268   27.527   18.149   8.9179   26.699   11.993 -8.549463 14.94564 
1 1 1    2    5   48 o   30.161   8.7531   19.153   17.627   26.844   25.158   11.738   24.703   32.534   12.794   27.787   11.949 4.746481 17.50622 
1 1 1    2    5   49 o   26.365   7.8640   0.5855   16.985 -30.8160   24.113   31.511   23.930   19.078   9.3170   33.651   12.671 -14.57270 15.72807 
1 1 1    2    5   50 f   25.707   8.5897  -9.3023   23.747 -24.8416   31.650   10.715   35.922   22.552   10.936   28.863   13.249 -6.311028 17.17946 
1 1 1    2    5   51 o   25.404   8.6505 -10.8210   27.131 -26.8096   41.133   1.4917   36.096   24.318   11.936   26.491   12.524 -2.173620 17.30102 
1 1 1    2    5   52 f   18.996   9.6218 -82.7044   37.824   0.0000   0.0000 -82.7044   37.824  ?   ?    18.996   9.6218      ?      ? 
1 1 1    2    6    0 o  926.196   7.2569 17718.92  391.934 17718.92  391.934 17718.92  391.934  926.196   10.263  926.196   10.263 0.000000 0.000000 
1 1 1    2    6    1 o  805.605   6.3685 13405.48  211.517 13550.41  304.234 13269.88  294.275  809.801   9.1089  801.410   8.9029 8.390869 12.73709 
1 1 1    2    6    2 o  250.441   2.4269  1290.50   24.713  1274.40   32.247  1313.40   38.470  248.560   3.1456  252.322   3.6966 -3.761932 4.853828 
1 1 1    2    6    3 o  612.822   5.5069  7785.15  138.149  7999.34  185.885  7520.86  206.479  622.344   7.2418  603.301   8.2981 19.04248 11.01371 
1 1 1    2    6    4 o  314.508   2.9793  2040.68   38.640  2061.36   55.256  2020.88   54.056  316.066   4.2387  312.950   4.1880 3.116302 5.958662 
1 1 1    2    6    5 o  382.698   3.1882  3025.97   49.915  3048.40   66.623  2997.25   75.363  384.337   4.2029  381.058   4.7951 3.279236 6.376332 
1 1 1    2    6    6 o  410.407   3.5954  3477.83   60.858  3488.21   86.391  3467.61   85.745  411.013   5.0962  409.801   5.0731 1.212860 7.190780 
1 1 1    2    6    7 o  442.882   3.3089  4049.86   60.441  4035.82   85.103  4064.15   85.854  442.109   4.6671  443.655   4.6919 -1.545807 6.617864 
1 1 1    2    6    8 o  157.465   1.9988  511.563   12.981  513.228   18.427  509.924   18.290  157.719   2.8327  157.211   2.8207 0.5081787 3.997542 
1 1 1    2    6    9 o  166.208   2.0609  569.954   14.128  574.508   20.046  565.460   19.913  166.868   2.9127  165.549   2.9165 1.319336 4.121807 
1 1 1    2    6   10 o  187.002   3.0274  719.806   23.307  755.203   34.254  689.293   31.804  191.268   4.3422  182.736   4.2198 8.531754 6.054852 
1 1 1    2    6   11 f  166.660   2.1468  573.053   14.757  572.139   20.850  573.970   20.890  166.527   3.0356  166.794   3.0366 -0.2663116 4.293698 
1 1 1    2    6   12 o  402.087   3.1270  3335.82   51.844  3370.18   74.322  3303.25   72.355  404.101   4.4593  400.073   4.3850 4.027252 6.254030 
1 1 1    2    6   13 o  294.085   2.6136  1784.19   31.700  1777.96   44.682  1790.51   44.982  293.568   3.6902  294.601   3.7020 -1.033356 5.227102 
1 1 1    2    6   14 o  669.607   5.4445  9257.58  150.307  9167.47  209.296  9353.55  215.994  666.254   7.6165  672.960   7.7819 -6.706055 10.88896 
1 1 1    2    6   15 o  238.857   2.8840  1176.85   28.404  1166.12   39.639  1188.18   40.722  237.739   4.0425  239.976   4.1143 -2.236603 5.767946 
1 1 1    2    6   16 o   89.135   5.1224  163.960   18.831   0.0000   0.0000  163.960   18.831  ?   ?    89.135   5.1224      ?      ? 
1 1 1    2    6   17 o  344.202   3.3580  2444.77   47.669  2458.41   67.810  2431.45   67.025  345.150   4.7634  343.254   4.7343 1.896179 6.715927 
1 1 1    2    6   18 o  247.661   2.7700  1257.66   27.827  1223.93   35.991  1307.78   43.878  243.569   3.5826  251.754   4.2257 -8.184769 5.540031 
1 1 1    2    6   19 o  253.197   2.6092  1322.37   27.243  1305.70   38.069  1339.86   39.001  251.563   3.6691  254.831   3.7107 -3.267868 5.218418 
1 1 1    2    6   20 o  251.766   3.7396  1309.10   38.820  1294.39   55.407  1323.30   54.405  250.371   5.3656  253.161   5.2105 -2.789948 7.479222 
1 1 1    2    6   21 o  333.300   2.9239  2292.17   40.183  2322.02   57.637  2263.95   56.051  335.408   4.1664  331.192   4.1033 4.216278 5.847754 
1 1 1    2    6   22 o  171.769   2.7746  609.005   19.656  611.361   27.869  606.672   27.728  172.100   3.9262  171.439   3.9215 0.6611176 5.549153 
1 1 1    2    6   23 o  181.022   2.8264  675.834   21.090  646.155   29.352  707.512   30.324  176.916   4.0226  185.128   3.9714 -8.211838 5.652723 
1 1 1    2    6   24 o  162.865   3.2699  544.896   21.576  532.287   27.856  563.806   34.112  160.547   4.2069  165.183   5.0070 -4.636826 6.539708 
1 1 1    2    6   25 o  225.417   3.1409  1044.32   29.102  986.205   39.222  1115.50   43.408  218.486   4.3525  232.349   4.5296 -13.86340 6.281836 
1 1 1    2    6   26 o  164.271   2.9862  557.567   20.232  559.784   28.716  555.381   28.510  164.595   4.2300  163.947   4.2163 0.6476898 5.972427 
1 1 1    2    6   27 f   54.472   6.5349   62.869   14.319   57.904   20.372   67.717   20.131   51.871   9.8832   57.073   8.5522 -5.202129 13.06974 
1 1 1    2    6   28 o   83.531   4.5470  145.045   15.590  162.085   22.120  128.226   21.976   88.443   6.0639   78.619   6.7773 9.824745 9.094061 
1 1 1    2    6   29 o  195.915   4.0452  795.515   32.652  784.973   47.110  805.261   45.296  194.642   5.8683  197.188   5.5695 -2.545197 8.090474 
1 1 1    2    6   30 o   59.873   6.2190   74.783   15.357   75.767   21.831   73.819   21.606   60.264   8.7832   59.483   8.8067 0.7814980 12.43800 
1 1 1    2    6   31 o   92.182   4.5075  176.963   17.078  190.408   23.878  162.883   24.435   95.809   6.0426   88.555   6.6902 7.253418 9.015051 
1 1 1    2    6   32 o  217.976   3.2476  979.683   28.767  1004.23   44.935  962.636   37.446  220.219   4.9473  215.732   4.2085 4.486237 6.495165 
1 1 1    2    6   33 o   56.967   7.3664   69.768   16.862   76.332   23.488   62.788   24.220   60.346   9.4371   53.588   11.314 6.757732 14.73279 
1 1 1    2    6   34 o  156.553   3.7864  507.375   24.402  553.750   35.366  465.238   33.711  163.384   5.2482  149.723   5.4591 13.66190 7.572734 
1 1 1    2    6   35 o   79.090   5.6820  131.139   18.533  128.719   26.164  133.577   26.255   78.348   8.0967   79.833   7.9738 -1.484573 11.36391 
1 1 1    2    6   36 o   86.053   5.3521  155.814   18.922  141.870   26.974  169.324   26.552   82.174   7.9587   89.932   7.1583 -7.758087 10.70429 
1 1 1    2    6   37 o   26.750   8.5816 -20.3528   21.480 -43.5255   30.756   1.7136   30.013   22.799   10.988   30.701   13.185 -7.902000 17.16322 
1 1 1    2    6   38 o   40.078   8.9698   35.181   17.140   23.300   24.417   46.723   24.066   34.988   12.871   45.167   12.496 -10.17933 17.93957 
1 1 1    2    6   39 o   27.897   8.3885   3.4370   16.946  -0.8985   23.800   7.8947   24.133   26.551   11.571   29.243   12.148 -2.691164 16.77707 
1 1 1    2    6   40 o   77.231   7.0350  130.708   22.380  125.356   30.707  136.772   32.685   75.596   9.8486   78.866   10.048 -3.270561 14.06993 
1 1 1    2    6   41 o   53.404   8.4936   67.719   18.251   65.518   25.444   70.052   26.193   52.488   12.013   54.319   12.011 -1.830387 16.98718 
1 1 1    2    6   42 o   23.033   7.3924 -20.8100   16.564 -47.5725   23.012   7.9641   23.861   17.483   8.6472   28.582   11.992 -11.09945 14.78479 
1 1 1    2    6   43 o   35.579   8.7795   27.458   16.807   42.731   23.745   12.123   23.794   41.645   12.683   29.514   12.143 12.13033 17.55900 
1 1 1    2    6   44 o   26.191   8.3569  -7.4626   18.960   6.0446   29.502 -16.9677   24.748   29.706   12.915   22.675   10.609 7.031494 16.71389 
1 1 1    2    6   45 o   34.842   9.1878   28.097   17.659   28.852   26.124   27.461   23.962   35.245   13.246   34.438   12.736 0.8070869 18.37568 
1 1 1    2    6   46 o   34.819   8.8928   30.300   16.420   27.711   23.644   32.712   22.820   33.822   12.623   35.816   12.530 -1.994091 17.78566 
1 1 1    2    6   47 o   32.552   9.0258   17.440   20.307   48.186   28.539 -14.0893   28.900   40.928   14.029   24.176   11.360 16.75180 18.05167 
1 1 1    2    6   48 o   28.872   8.2513   6.8773   17.870 -25.1708   25.190   39.341   25.353   20.564   9.9191   37.181   13.189 -16.61731 16.50259 
1 1 1    2    6   49 o   23.394   7.4798 -22.5027   18.005 -69.0484   25.509   23.713   25.418   15.954   8.0601   30.835   12.603 -14.88110 14.95962 
1 1 1    2    6   50 o   30.576   9.3221   18.865   22.186   42.912   32.712  -1.6163   30.190   35.756   14.412   25.396   11.827 10.36068 18.64425 
1 1 1    2    6   51 o   30.532   9.6656   15.311   28.253 -36.7347   41.429   60.564   38.631   23.387   11.574   37.678   15.484 -14.29032 19.33115 
1 1 1    2    7    1 o  416.485   3.9969  3595.54   68.099  3703.56   91.480  3461.30  101.986  423.563   5.2365  409.406   6.0398 14.15738 7.993759 
1 1 1    2    7    2 o  382.432   3.6207  3008.26   53.362  2988.62   64.697  3050.03   94.372  380.558   4.1219  384.306   5.9539 -3.748779 7.241481 
1 1 1    2    7    3 o  221.432   2.7761  989.818   24.167  942.646   29.634  1083.49   41.760  213.746   3.3614  229.118   4.4191 -15.37141 5.552255 
1 1 1    2    7    4 o  455.615   3.8920  4287.01   73.131  4267.40  102.738  4307.15  104.123  454.562   5.4799  456.669   5.5282 -2.106476 7.783924 
1 1 1    2    7    5 o  263.973   2.8345  1452.53   29.592  1490.57   37.193  1386.90   48.848  268.765   3.3552  259.181   4.5696 9.584351 5.669099 
1 1 1    2    7    6 o  347.911   3.1999  2497.77   45.894  2540.52   66.140  2458.08   63.734  350.776   4.5716  345.046   4.4785 5.729523 6.399702 
1 1 1    2    7    7 o  246.344   2.2840  1252.22   23.206  1247.91   32.740  1256.58   32.897  245.917   3.2280  246.771   3.2322 -0.8532104 4.568047 
1 1 1    2    7    8 o  157.887   2.0141  514.042   13.112  500.129   18.304  528.708   18.793  155.694   2.8504  160.081   2.8464 -4.386597 4.028192 
1 1 1    2    7    9 o  295.558   2.7480  1798.45   33.040  1829.62   51.341  1776.42   43.167  297.720   4.1811  293.397   3.5672 4.322510 5.496062 
1 1 1    2    7   10 o  257.450   3.9226  1376.11   36.357  1383.76   42.214  1354.13   71.541  258.939   3.9527  255.961   6.7767 2.977402 7.845181 
1 1 1    2    7   11 f  730.326   5.4709 11038.07  163.650 10921.93  245.678 11130.71  219.415  726.761   8.1961  733.891   7.2489 -7.130371 10.94177 
1 1 1    2    7   12 o  646.008   4.9187  8624.32  129.922  8576.83  196.833  8660.99  172.949  644.368   7.4062  647.649   6.4746 -3.281128 9.837327 
1 1 1    2    7   13 o  204.359   2.5217  859.104   21.009  846.090   27.588  877.068   32.414  202.526   3.3028  206.191   3.8115 -3.664978 5.043367 
1 1 1    2    7   14 o  254.937   2.9264  1340.96   30.770  1342.48   43.453  1339.43   43.577  255.082   4.1303  254.792   4.1467 0.2904816 5.852737 
1 1 1    2    7   15 o  306.641   2.7368  1938.68   34.593  1906.16   47.980  1973.88   49.922  303.966   3.8271  309.316   3.9132 -5.349762 5.473529 
1 1 1    2    7   16 o  226.115   3.1380  1051.83   28.646  1070.18   45.613  1039.89   36.812  227.725   4.8564  224.505   3.9755 3.220383 6.276094 
1 1 1    2    7   17 o  267.383   2.5927  1474.19   28.581  1502.79   41.117  1447.44   39.757  269.891   3.6937  264.876   3.6392 5.014709 5.185305 
1 1 1    2    7   18 o  425.846   3.3224  3742.50   58.354  3742.82   82.567  3742.17   82.485  425.864   4.7008  425.827   4.6965 0.3643799E-01 6.644873 
1 1 1    2    7   19 o  231.196   2.9611  1103.02   28.235  1094.18   39.775  1112.00   40.088  230.263   4.1881  232.130   4.1871 -1.867554 5.922154 
1 1 1    2    7   20 o  319.988   3.2765  2113.06   43.232  2084.91   60.343  2142.75   61.967  317.801   4.6037  322.174   4.6634 -4.373383 6.553005 
1 1 1    2    7   21 o  335.317   2.9357  2318.11   40.558  2263.60   55.855  2378.91   58.988  331.156   4.0894  339.477   4.2130 -8.320526 5.871347 
1 1 1    2    7   22 o  222.756   2.6922  1023.99   24.732  1009.70   34.650  1038.82   35.311  221.173   3.7985  224.339   3.8162 -3.166199 5.384430 
1 1 1    2    7   23 o  292.942   2.8557  1771.75   34.503  1778.41   48.864  1765.14   48.725  293.490   4.0368  292.393   4.0404 1.096771 5.711383 
1 1 1    2    7   24 o  133.937   3.8324  368.900   21.114  342.634   28.638  400.178   31.252  128.743   5.3933  139.131   5.4461 -10.38815 7.664740 
1 1 1    2    7   25 o  146.992   3.4461  446.677   20.889  445.498   29.276  447.901   29.815  146.797   4.8353  147.187   4.9114 -0.3895569 6.892179 
1 1 1    2    7   26 o  142.653   3.1495  420.577   18.530  419.061   26.263  422.081   26.148  142.396   4.4718  142.910   4.4362 -0.5145416 6.298928 
1 1 1    2    7   27 o  178.255   2.9359  656.591   21.583  657.004   30.328  656.166   30.722  178.315   4.1237  178.196   4.1801 0.1186066 5.871770 
1 1 1    2    7   28 o   77.268   5.6777  125.783   17.849  106.312   25.907  143.377   24.627   71.436   8.7929   83.099   7.1853 -11.66293 11.35537 
1 1 1    2    7   29 o   77.936   5.1565  125.852   16.279   96.074   22.210  160.427   23.932   67.947   7.9251   87.924   6.5994 -19.97690 10.31308 
1 1 1    2    7   30 o   93.680   4.3639  182.013   16.855  188.947   23.984  175.245   23.692   95.450   6.0922   91.910   6.2499 3.539619 8.727842 
1 1 1    2    7   31 o  286.394   2.9870  1695.07   35.264  1735.29   50.895  1657.94   48.906  289.652   4.2602  283.137   4.1879 6.514984 5.973959 
1 1 1    2    7   32 o   36.530   7.6272   18.504   15.964 -17.4532   22.315   56.204   22.849   22.366   10.330   50.694   11.224 -28.32790 15.25440 
1 1 1    2    7   33 o  139.470   4.0289  403.434   22.754  402.739   29.492  404.455   35.764  139.402   5.1295  139.538   6.2142 -0.1357574 8.057774 
1 1 1    2    7   34 o   75.223   5.8984  119.744   17.929  148.579   25.554   91.788   25.161   84.366   7.3439   66.079   9.2321 18.28704 11.79685 
1 1 1    2    7   35 o  132.380   3.8815  364.336   21.175  344.671   29.727  384.592   30.169  128.732   5.5989  136.027   5.3773 -7.295609 7.762929 
1 1 1    2    7   36 o   46.495   9.1209   48.351   18.314   39.162   26.091   57.276   25.713   42.446   13.359   50.545   12.422 -8.098663 18.24188 
1 1 1    2    7   37 o   92.885   5.0681  181.465   19.382  167.001   26.865  197.165   27.989   88.989   7.3196   96.780   7.0118 -7.791245 10.13620 
1 1 1    2    7   38 o   39.976   9.3071   33.105   18.644   51.048   27.157   17.110   25.641   46.909   13.381   33.042   12.940 13.86699 18.61421 
1 1 1    2    7   39 o   67.306   6.5303   98.389   18.053  108.221   25.524   88.548   25.537   70.851   8.7345   63.762   9.7103 7.088379 13.06070 
1 1 1    2    7   40 o   34.399   8.9588   23.432   17.092   14.684   24.700   31.469   23.677   31.327   12.560   37.471   12.778 -6.144295 17.91766 
1 1 1    2    7   41 o   26.696   8.1935  -4.2864   17.653 -22.2442   24.543   14.965   25.412   21.972   10.369   31.419   12.689 -9.447706 16.38695 
1 1 1    2    7   42 o   65.151   7.0978   97.324   18.134  119.106   25.508   75.069   25.784   73.819   8.3781   56.483   11.460 17.33569 14.19565 
1 1 1    2    7   43 o   36.509   7.8414   22.607   17.039   62.449   23.977 -18.0407   24.218   50.739   11.697   22.280   10.447 28.45911 15.68286 
1 1 1    2    7   44 o   46.658   8.8762   54.605   17.522   62.747   25.503   47.325   24.115   50.044   12.416   43.272   12.689 6.771214 17.75243 
1 1 1    2    7   45 o   52.341   8.1871   68.555   18.227   38.710   25.456   99.956   26.110   38.881   13.250   65.800   9.6209 -26.91895 16.37423 
1 1 1    2    7   46 o   48.252   8.3547   59.987   16.493   59.724   23.470   60.244   23.181   48.072   11.901   48.432   11.729 -0.3600235 16.70942 
1 1 1    2    7   47 o   36.703   9.7252   30.677   22.943  -4.2763   32.281   66.357   32.615   26.888   12.421   46.519   14.968 -19.63104 19.45030 
1 1 1    2    7   48 o   34.844   9.0817   32.847   17.797   43.404   24.688   21.423   25.680   38.904   13.049   30.785   12.634 8.118904 18.16349 
1 1 1    2    7   49 o   25.981   8.5319  -1.8271   22.076  -8.8357   32.467   4.1994   30.106   25.205   11.904   26.758   12.226 -1.553514 17.06380 
1 1 1    2    7   50 o   33.743   9.6049   31.444   22.565   3.2400   31.941   59.542   31.881   26.539   12.293   40.947   14.761 -14.40715 19.20988 
1 1 1    2    7   51 o   29.800   9.6913   11.911   29.209 -32.1685   41.007   57.304   41.614   23.568   11.636   36.032   15.502 -12.46418 19.38262 
1 1 1    2    8    0 o  205.281   2.8829  870.444   34.488  870.444   34.488  870.444   34.488  205.281   4.0770  205.281   4.0770 0.000000 0.000000 
1 1 1    2    8    1 o  387.248   3.0593  3096.87   47.332  3100.39   59.929  3091.03   77.167  387.590   3.7488  386.905   4.8357 0.6851501 6.118671 
1 1 1    2    8    2 o  348.159   3.5992  2466.09   49.355  2382.48   60.821  2627.31   84.458  339.716   4.3408  356.602   5.7424 -16.88641 7.198464 
1 1 1    2    8    3 o   65.232   2.3263   79.452   5.5641   70.886   6.3834  106.539   11.352   58.617   2.6404   71.846   3.8309 -13.22874 4.652668 
1 1 1    2    8    4 o  149.029   2.0413  458.107   12.401  457.379   16.332  459.098   19.057  148.895   2.6594  149.163   3.0975 -0.2684479 4.082537 
1 1 1    2    8    5 o  115.261   3.2617  288.097   12.902  300.335   14.804  249.449   26.308  120.648   2.9751  109.873   5.8054 10.77522 6.523372 
1 1 1    2    8    6 o  146.825   2.5679  444.723   15.169  444.066   19.415  445.752   24.304  146.699   3.2088  146.952   4.0100 -0.2536163 5.135786 
1 1 1    2    8    7 o  165.710   2.3462  566.467   16.032  574.763   22.943  558.549   22.413  166.895   3.3330  164.525   3.3029 2.369934 4.692343 
1 1 1    2    8    8 o  248.335   2.6844  1272.65   27.494  1261.60   38.686  1283.93   39.082  247.246   3.7937  249.423   3.7990 -2.177368 5.368837 
1 1 1    2    8    9 o  219.571   2.8532  998.468   25.442  1015.62   33.349  974.586   39.352  221.851   3.6447  217.292   4.3909 4.558853 5.706457 
1 1 1    2    8   10 f   73.950   2.8768  114.542   8.6329  125.843   11.609  100.561   12.912   78.097   3.6041   69.803   4.4850 8.294174 5.753641 
1 1 1    2    8   11 o  128.672   2.4611  339.171   12.863  354.915   20.215  328.458   16.674  131.160   3.7369  126.184   3.2039 4.976257 4.922297 
1 1 1    2    8   12 o  344.759   2.8408  2449.82   40.359  2400.45   55.712  2504.34   58.546  341.110   3.9599  348.409   4.0742 -7.298981 5.681580 
1 1 1    2    8   13 o  256.414   2.4813  1356.04   26.236  1371.04   37.556  1341.73   36.667  257.799   3.5321  255.029   3.4860 2.769745 4.962615 
1 1 1    2    8   14 o  253.363   2.7265  1326.19   28.222  1310.58   42.836  1338.18   37.515  252.035   4.1208  254.690   3.5713 -2.654739 5.452995 
1 1 1    2    8   15 o  171.460   3.1026  610.007   21.412  622.890   27.590  590.494   33.954  173.759   3.8498  169.160   4.8667 4.599701 6.205252 
1 1 1    2    8   16 o  331.836   2.8315  2271.26   38.742  2243.29   54.051  2300.82   55.561  329.737   3.9744  333.935   4.0340 -4.198822 5.662957 
1 1 1    2    8   17 f  151.168   2.4843  471.476   15.488  475.748   21.846  467.158   21.962  151.857   3.4879  150.479   3.5386 1.378113 4.968677 
1 1 1    2    8   18 o  443.866   3.4211  4065.72   62.616  4102.59   89.630  4030.57   87.514  445.828   4.8744  441.904   4.8016 3.924835 6.842128 
1 1 1    2    8   19 o  457.966   4.0454  4329.14   76.363  4397.39  110.307  4266.34  105.820  461.421   5.7962  454.511   5.6449 6.909882 8.090780 
1 1 1    2    8   20 o  365.532   3.0600  2757.69   46.127  2736.57   64.635  2779.61   65.849  364.108   4.3040  366.956   4.3508 -2.847992 6.119937 
1 1 1    2    8   21 o  150.604   3.0830  469.306   18.998  459.786   28.575  476.849   25.434  149.220   4.6429  151.987   4.0573 -2.766953 6.165936 
1 1 1    2    8   22 o  186.118   2.7735  715.064   21.285  692.855   29.973  737.654   30.230  183.201   3.9668  189.036   3.8773 -5.834427 5.546978 
1 1 1    2    8   23 o  240.957   2.7401  1198.58   27.229  1209.70   38.840  1187.83   38.183  242.055   3.8904  239.860   3.8597 2.194931 5.480208 
1 1 1    2    8   24 o  418.619   3.9218  3622.80   67.692  3675.02   97.173  3573.57   94.351  421.540   5.5891  415.699   5.5030 5.841003 7.843572 
1 1 1    2    8   25 f  111.832   4.0230  258.891   18.551  262.754   26.080  254.935   26.394  112.682   5.6117  110.982   5.7660 1.699905 8.046013 
1 1 1    2    8   26 o  158.155   2.9852  516.395   19.463  538.420   27.960  495.689   27.110  161.426   4.1995  154.885   4.2438 6.541245 5.970335 
1 1 1    2    8   27 o   60.320   5.8896   75.960   14.542   64.853   20.436   87.355   20.698   55.801   8.8795   64.839   7.7398 -9.038078 11.77921 
1 1 1    2    8   28 o   77.347   5.5543  124.280   17.708  130.626   25.431  118.307   24.672   79.268   7.7786   75.426   7.9307 3.842361 11.10870 
1 1 1    2    8   29 o   44.296   7.9027   42.847   14.644   32.636   20.725   53.029   20.695   39.192   11.830   49.400   10.482 -10.20752 15.80545 
1 1 1    2    8   30 o   90.776   4.9710  171.264   18.578  185.116   26.524  157.925   26.029   94.401   6.8125   87.152   7.2412 7.249084 9.942078 
1 1 1    2    8   31 o  137.001   3.4725  388.668   19.617  384.825   27.956  392.395   27.534  136.327   4.9719  137.675   4.8489 -1.348083 6.944919 
1 1 1    2    8   32 o   67.919   5.8587   96.298   16.410   97.650   23.412   94.992   23.008   68.386   8.3007   67.452   8.2702 0.9341965 11.71737 
1 1 1    2    8   33 o  118.716   5.5426  293.573   27.097  283.720   37.094  304.847   39.678  116.607   7.7128  120.824   7.9621 -4.217354 11.08524 
1 1 1    2    8   34 o  140.379   3.6865  409.031   21.344  410.466   30.249  407.609   30.122  140.624   5.2155  140.134   5.2116 0.4896545 7.373018 
1 1 1    2    8   35 o   36.494   8.6758   21.765   17.288   46.621   25.099  -0.6715   23.846   45.782   12.796   27.205   11.719 18.57626 17.35158 
1 1 1    2    8   36 o   74.959   8.0799  127.084   23.163   85.040   33.309  166.452   32.232   61.250   13.545   88.668   8.8136 -27.41756 16.15985 
1 1 1    2    8   37 o   39.224   9.1421   33.216   17.199   29.534   24.140   37.012   24.509   37.571   12.901   40.876   12.957 -3.304512 18.28426 
1 1 1    2    8   38 o   54.398   8.5329   68.302   18.683   59.646   26.527   76.824   26.318   50.633   12.719   58.163   11.378 -7.530575 17.06585 
1 1 1    2    8   39 f   36.884   8.2619   24.456   16.692  -3.5264   23.330   53.806   23.893   25.611   11.299   48.157   12.057 -22.54625 16.52372 
1 1 1    2    8   40 o   47.433   8.3017   53.395   16.918   31.878   23.719   75.679   24.139   37.475   12.790   57.392   10.588 -19.91754 16.60349 
1 1 1    2    8   41 o   32.397   9.3295   15.845   19.500   17.895   25.541   12.979   30.196   32.378   12.841   32.416   13.538 -0.3791046E-01 18.65894 
1 1 1    2    8   42 f   53.302   8.1341   67.371   17.347   68.311   24.049   66.351   25.045   53.877   11.188   52.726   11.810 1.151062 16.26822 
1 1 1    2    8   43 o   49.273   9.9310   62.316   21.679   78.421   30.951   46.806   30.374   55.639   13.602   42.907   14.474 12.73175 19.86199 
1 1 1    2    8   44 o   27.079   8.2018   5.6888   16.429   0.7854   23.071   10.734   23.402   25.595   11.267   28.563   11.922 -2.968645 16.40369 
1 1 1    2    8   45 o   62.998   7.4428   95.170   18.810  105.676   26.750   84.896   26.454   67.415   9.6208   58.581   11.359 8.833260 14.88566 
1 1 1    2    8   46 f   39.262   8.0227   38.112   16.211   8.9641   23.143   66.188   22.713   27.203   11.628   51.321   11.057 -24.11777 16.04536 
1 1 1    2    8   47 o   42.699   8.9456   51.062   17.795   33.491   25.029   69.024   25.305   35.019   13.004   50.380   12.288 -15.36098 17.89114 
1 1 1    2    8   48 o   34.621   9.1697   32.420   18.264   44.052   25.670   20.493   25.993   38.812   13.305   30.431   12.622 8.381687 18.33931 
1 1 1    2    8   49 o   33.514   9.8384   32.591   22.587   44.080   32.709   22.119   31.229   36.422   14.504   30.606   13.297 5.815355 19.67679 
1 1 1    2    8   50 o   25.042   8.2646  -8.2513   22.195 -38.2363   32.221   18.823   30.617   20.994   10.355   29.090   12.883 -8.096340 16.52918 
1 1 1    2    8   51 o   24.499   8.3966 -12.9981   26.234 -11.6796   38.425 -14.1492   35.903   24.913   12.074   24.086   11.672 0.8271675 16.79320 
1 1 1    2    9    0 f   24.274   2.9355   13.172   3.7913   13.172   3.7913   13.172   3.7913   24.274   4.1515   24.274   4.1515 0.000000 0.000000 
1 1 1    2    9    1 o  204.026   2.2094  860.399   18.432  870.519   24.589  847.417   27.849  205.406   2.9024  202.646   3.3320 2.759827 4.418829 
1 1 1    2    9    2 o  421.970   3.6600  3677.70   63.696  3668.96   89.746  3686.57   90.418  421.467   5.1628  422.474   5.1891 -1.006500 7.319909 
1 1 1    2    9    3 o  138.344   2.1550  394.881   12.296  391.630   17.309  398.192   17.470  137.769   3.0461  138.919   3.0490 -1.149246 4.309909 
1 1 1    2    9    4 o  223.776   3.1064  1032.37   28.643  1002.67   39.464  1065.44   41.638  220.382   4.3417  227.170   4.4440 -6.787872 6.212858 
1 1 1    2    9    5 o  131.125   3.0353  354.755   16.415  354.755   16.415   0.0000   0.0000  131.125   3.0353  ?   ?       ?      ? 
1 1 1    2    9    6 o  222.892   2.3533  1028.61   21.520  1064.35   29.285  986.653   31.730  227.123   3.1262  218.661   3.5183 8.462006 4.706532 
1 1 1    2    9    7 o  262.374   2.4404  1418.20   25.465  1411.94   31.986  1429.04   42.081  261.605   2.9645  263.143   3.8773 -1.538330 4.880702 
1 1 1    2    9    8 o  106.106   2.4482  232.440   10.704  220.913   15.139  243.964   15.137  103.472   3.5475  108.739   3.3751 -5.267342 4.896479 
1 1 1    2    9    9 o  311.032   3.0192  1996.32   38.730  1988.99   54.624  2003.72   54.923  310.458   4.2660  311.606   4.2735 -1.147308 6.038312 
1 1 1    2    9   10 o  271.750   2.4685  1523.01   27.661  1542.57   39.633  1504.42   38.625  273.451   3.5140  270.049   3.4678 3.401642 4.937049 
1 1 1    2    9   11 o  329.674   3.1870  2241.48   43.319  2206.93   60.320  2278.27   62.251  327.053   4.4718  332.295   4.5421 -5.241699 6.373971 
1 1 1    2    9   12 o  396.088   3.1109  3237.04   50.819  3226.88   71.570  3247.36   72.172  395.462   4.3879  396.714   4.4109 -1.251923 6.221734 
1 1 1    2    9   13 o  442.399   3.3767  4038.01   61.601  4006.08   86.153  4071.41   88.114  440.612   4.7407  444.186   4.8096 -3.573914 6.753321 
1 1 1    2    9   14 o  280.935   2.5992  1628.06   30.115  1615.28   42.301  1641.19   42.882  279.818   3.6653  282.053   3.6862 -2.234619 5.198318 
1 1 1    2    9   15 o  304.197   3.8043  1908.29   47.703  1959.77   68.910  1860.92   66.103  308.131   5.4222  300.263   5.3377 7.867310 7.608635 
1 1 1    2    9   16 o  219.549   2.4379  994.124   22.072  978.641   30.883  1010.29   31.556  217.802   3.4379  221.295   3.4574 -3.493317 4.875722 
1 1 1    2    9   17 o  170.748   2.4644  601.470   17.355  607.778   24.637  595.256   24.452  171.637   3.4803  169.859   3.4902 1.777390 4.928894 
1 1 1    2    9   18 o  218.900   2.5167  988.669   22.721  974.210   32.031  1003.31   32.234  217.289   3.5741  220.512   3.5442 -3.222717 5.033423 
1 1 1    2    9   19 o  266.612   3.0676  1465.37   33.706  1421.47   46.561  1513.72   48.857  262.424   4.3018  270.801   4.3744 -8.377380 6.135179 
1 1 1    2    9   20 o  188.744   2.6210  735.189   20.403  739.695   29.015  730.781   28.696  189.316   3.7160  188.173   3.6974 1.143433 5.242050 
1 1 1    2    9   21 o  206.675   3.0624  882.164   26.091  873.168   37.398  890.695   36.417  205.643   4.4093  207.706   4.2509 -2.062668 6.124723 
1 1 1    2    9   22 o  203.976   2.7187  858.638   22.867  837.246   32.018  880.911   32.671  201.383   3.8549  206.569   3.8347 -5.185822 5.437331 
1 1 1    2    9   23 o   81.550   4.4964  137.618   15.122  140.370   21.409  134.878   21.361   82.366   6.3022   80.734   6.4151 1.632141 8.992804 
1 1 1    2    9   24 o  103.990   4.6502  223.738   19.419  225.295   31.301  222.763   24.761  104.230   7.2811  103.749   5.7865 0.4806442 9.300468 
1 1 1    2    9   25 o  127.481   3.7184  336.512   19.077  337.819   24.466  334.484   30.471  127.839   4.6402  127.122   5.8116 0.7172089 7.436776 
1 1 1    2    9   26 o  191.771   2.8116  759.762   22.238  764.331   31.560  755.256   31.341  192.344   3.9782  191.199   3.9743 1.144852 5.623269 
1 1 1    2    9   27 o  240.883   3.0010  1200.44   29.616  1208.27   39.724  1190.65   44.437  241.802   3.9832  239.964   4.4899 1.838242 6.002047 
1 1 1    2    9   28 o   56.011   7.6214   69.225   16.968   47.909   24.627   88.489   23.412   46.866   12.508   65.156   8.7120 -18.29016 15.24274 
1 1 1    2    9   29 o   48.989   7.1960   52.726   14.470   76.535   20.486   29.023   20.440   60.613   8.1946   37.365   11.831 23.24702 14.39199 
1 1 1    2    9   30 o   86.366   4.9949  155.144   17.777  152.983   25.579  157.163   24.723   85.767   7.2308   86.965   6.8928 -1.197357 9.989772 
1 1 1    2    9   31 o   55.846   6.9308   66.457   15.599   61.804   22.047   71.123   22.075   53.383   10.387   58.310   9.1788 -4.926823 13.86151 
1 1 1    2    9   32 o   60.563   6.9098   78.537   16.625   63.290   23.261   94.461   23.771   53.901   10.839   67.224   8.5736 -13.32300 13.81969 
1 1 1    2    9   33 o   72.971   8.6750  117.012   25.018  131.222   33.844   99.891   37.148   78.853   10.406   67.090   13.883 11.76318 17.35005 
1 1 1    2    9   34 o  120.092   4.0451  300.830   19.935  265.770   28.152  336.087   28.231  112.995   6.0407  127.189   5.3817 -14.19385 8.090285 
1 1 1    2    9   35 o   72.078   6.1757  109.930   18.244  124.236   25.863   95.761   25.739   76.864   8.1581   67.293   9.2738 9.570496 12.35145 
1 1 1    2    9   36 o   82.489   6.6878  146.978   22.452  127.624   32.904  163.839   30.712   77.069   10.352   87.908   8.4706 -10.83887 13.37558 
1 1 1    2    9   37 o   40.227   8.4185   32.718   17.054   6.5649   23.770   60.460   24.481   28.907   12.036   51.547   11.773 -22.63959 16.83696 
1 1 1    2    9   38 o   51.925   8.8229   62.735   18.803   74.872   26.936   51.201   26.259   57.095   11.827   46.755   13.095 10.33970 17.64581 
1 1 1    2    9   39 o   37.204   8.9761   29.599   16.887   20.272   23.804   39.049   23.960   33.255   12.611   41.153   12.777 -7.897640 17.95215 
1 1 1    2    9   40 o   29.427   8.6433   9.1644   17.418   3.2279   24.836   14.911   24.436   27.744   11.956   31.110   12.486 -3.365616 17.28668 
1 1 1    2    9   41 o   33.043   9.2494   9.7237   21.493   39.928   29.473 -24.5837   31.411   41.011   14.245   25.074   11.801 15.93733 18.49870 
1 1 1    2    9   42 o   26.900   8.1509   4.0030   16.247  -1.1011   22.778   9.2900   23.182   25.325   11.169   28.476   11.874 -3.150574 16.30189 
1 1 1    2    9   43 o   79.708   6.8484  144.243   22.447  132.811   31.786  155.616   31.705   76.229   10.110   83.186   9.2407 -6.957329 13.69684 
1 1 1    2    9   44 o   21.916   7.1077 -21.0707   15.712   7.4107   22.786 -46.8881   21.694   27.279   11.596   16.552   8.2231 10.72667 14.21545 
1 1 1    2    9   45 o   37.894   8.9619   37.269   16.487   35.061   23.298   39.484   23.335   36.924   12.675   38.865   12.674 -1.940628 17.92381 
1 1 1    2    9   46 o   28.417   8.2567   14.007   15.646   8.8844   22.024   19.226   22.230   26.690   11.374   30.145   11.972 -3.455391 16.51350 
1 1 1    2    9   47 o   35.227   8.9446   33.165   17.514   17.911   25.188   47.445   24.370   29.665   12.374   40.790   12.919 -11.12488 17.88920 
1 1 1    2    9   48 o   42.880   9.1602   45.126   20.267   11.090   25.871   99.194   32.607   27.609   12.047   58.152   13.802 -30.54291 18.32031 
1 1 1    2    9   49 o   24.629   8.2016 -16.6733   22.214   16.420   32.336 -46.2457   30.568   29.387   13.114   19.872   9.8534 9.514246 16.40320 
1 1 1    2    9   50 f   27.382   8.8070   11.324   21.729   18.716   32.002   5.0019   29.597   28.919   12.965   25.844   11.923 3.074726 17.61409 
1 1 1    2    9   51 o   27.957   9.2392   13.119   26.722   1.1838   39.493   23.198   36.290   26.527   12.697   29.386   13.425 -2.859106 18.47840 
1 1 1    2   10    0 o   80.464   2.4912  134.329   11.641  134.329   11.641  134.329   11.641   80.464   3.5230   80.464   3.5230 0.000000 0.000000 
1 1 1    2   10    1 o  294.881   3.0135  1801.33   34.756  1815.21   42.912  1774.85   59.261  296.586   3.5080  293.177   4.9009 3.408936 6.027004 
1 1 1    2   10    2 o  307.457   4.0445  1985.30   45.939  2027.72   54.360  1879.31   85.926  313.422   4.2051  301.492   6.9101 11.92996 8.089056 
1 1 1    2   10    3 o  171.703   2.5033  610.213   17.321  617.163   22.307  599.659   27.487  172.950   3.1272  170.455   3.9098 2.494766 5.006585 
1 1 1    2   10    4 o  370.228   3.7274  2832.50   55.749  2839.88   71.975  2821.42   88.139  370.884   4.7052  369.571   5.7823 1.313416 7.454832 
1 1 1    2   10    5 o  319.446   3.0283  2103.24   39.852  2165.62   58.074  2047.71   54.789  323.912   4.3470  314.979   4.2174 8.933319 6.056630 
1 1 1    2   10    6 o  199.445   2.2791  822.005   18.581  830.874   24.754  810.560   28.120  200.685   2.9907  198.204   3.4398 2.480881 4.558118 
1 1 1    2   10    7 o   62.545   2.5360   82.367   6.1957   86.249   7.7229   75.357   10.378   64.661   2.8958   60.430   4.1640 4.230865 5.071963 
1 1 1    2   10    8 o  409.623   3.3937  3454.58   56.432  3417.57   73.380  3508.16   88.286  406.969   4.3717  412.277   5.1920 -5.307922 6.787393 
1 1 1    2   10    9 o  374.792   3.1944  2895.25   48.821  2878.17   64.297  2918.50   75.026  373.503   4.1738  376.082   4.8369 -2.578766 6.388713 
1 1 1    2   10   10 o  276.492   2.4938  1576.88   28.437  1563.81   39.962  1590.28   40.473  275.332   3.5191  277.651   3.5343 -2.319611 4.987504 
1 1 1    2   10   11 o  427.326   3.7839  3768.21   66.679  3734.46   93.268  3803.50   95.364  425.372   5.3161  429.281   5.3861 -3.909607 7.567823 
1 1 1    2   10   12 o  551.089   3.9930  6266.56   90.724  6204.45  126.354  6332.66  130.346  548.276   5.5876  553.902   5.7056 -5.626099 7.985931 
1 1 1    2   10   13 o  112.249   2.5291  259.916   11.708  261.381   16.654  258.485   16.463  112.562   3.5872  111.937   3.5660 0.6250610 5.058120 
1 1 1    2   10   14 o  361.359   2.9485  2694.31   43.944  2691.76   62.111  2696.88   62.181  361.187   4.1694  361.530   4.1701 -0.3430176 5.896901 
1 1 1    2   10   15 o  572.959   5.8531  6784.31  138.306  6758.42  194.246  6810.93  196.972  571.857   8.2357  574.061   8.3192 -2.204712 11.70621 
1 1 1    2   10   16 o  236.758   2.4823  1156.43   24.239  1162.25   34.396  1150.70   34.164  237.349   3.5136  236.166   3.5074 1.182297 4.964605 
1 1 1    2   10   17 o  144.734   2.5788  432.233   15.388  416.154   21.659  448.622   21.867  142.015   3.6978  147.453   3.5956 -5.438110 5.157678 
1 1 1    2   10   18 o  140.931   3.1038  410.402   18.021  391.103   25.626  429.283   25.347  137.646   4.5139  144.216   4.2614 -6.569885 6.207685 
1 1 1    2   10   19 o  450.945   3.4745  4198.66   64.615  4171.48   90.633  4226.75   92.144  449.464   4.8891  452.426   4.9380 -2.962341 6.948905 
1 1 1    2   10   20 o  238.498   2.6507  1173.70   26.071  1155.04   36.474  1193.19   37.278  236.561   3.7383  240.435   3.7591 -3.874390 5.301495 
1 1 1    2   10   21 o  163.789   3.2382  554.083   21.872  550.864   31.163  557.209   30.705  163.318   4.6264  164.261   4.5321 -0.9427490 6.476399 
1 1 1    2   10   22 o  196.885   2.7444  800.362   22.286  800.067   31.495  800.657   31.540  196.849   3.8792  196.921   3.8833 -0.7240295E-01 5.488882 
1 1 1    2   10   23 o  227.126   2.7297  1064.96   25.565  1047.16   35.685  1083.73   36.643  225.179   3.8423  229.074   3.8784 -3.895248 5.459395 
1 1 1    2   10   24 o   64.630   5.9374   86.748   15.793   79.199   22.010   94.759   22.674   61.719   8.6465   67.541   8.1393 -5.822590 11.87480 
1 1 1    2   10   25 o  106.820   4.4289  236.480   19.487  239.691   26.988  232.982   28.168  107.591   6.0817  106.049   6.4399 1.542519 8.857779 
1 1 1    2   10   26 o   75.380   4.7745  117.648   14.826  126.075   21.436  109.921   20.527   77.969   6.6659   72.792   6.8373 5.176941 9.548966 
1 1 1    2   10   27 o   79.988   5.3047  132.426   17.467  143.160   25.607  123.087   23.886   83.009   7.4793   76.967   7.5246 6.042694 10.60941 
1 1 1    2   10   28 o   69.067   5.2351   99.115   14.892  106.543   21.354   92.081   20.779   71.598   7.2314   66.537   7.5718 5.061356 10.47018 
1 1 1    2   10   29 o   44.764   7.7699   44.149   15.765   66.127   21.283   17.429   23.467   56.258   9.1724   33.270   12.544 22.98801 15.53986 
1 1 1    2   10   30 o  212.101   3.2917  931.086   28.793  916.836   40.726  945.328   40.713  210.472   4.6915  213.730   4.6186 -3.257324 6.583408 
1 1 1    2   10   31 o   60.959   6.6892   80.368   15.946  101.820   22.585   59.045   22.517   69.882   7.8361   52.037   10.843 17.84461 13.37831 
1 1 1    2   10   32 o  117.200   3.9574  284.943   19.128  281.295   26.879  288.685   27.227  116.440   5.5970  117.960   5.5963 -1.519791 7.914857 
1 1 1    2   10   33 o  117.203   4.1380  285.490   19.994  273.596   28.065  297.747   28.490  114.713   5.9318  119.694   5.7711 -4.981987 8.276006 
1 1 1    2   10   34 o   79.589   5.7291  133.016   18.805  130.488   26.487  135.584   26.701   78.819   8.1479   80.360   8.0561 -1.540756 11.45815 
1 1 1    2   10   35 o   62.584   8.3438   87.988   20.324   76.586   32.530   95.289   26.030   58.130   13.778   67.037   9.4145 -8.907532 16.68762 
1 1 1    2   10   36 o   50.277   8.4483   57.359   17.478   43.488   24.467   71.813   24.976   43.859   12.758   56.696   11.078 -12.83665 16.89654 
1 1 1    2   10   37 f   29.770   8.6097   9.5794   16.786   11.286   24.156   7.9858   23.341   30.487   12.351   29.054   11.998 1.433638 17.21949 
1 1 1    2   10   38 o   37.001   8.7435   28.557   16.773   43.766   23.160   11.781   24.324   43.456   12.343   30.545   12.387 12.91059 17.48708 
1 1 1    2   10   39 o   37.221   8.6777   29.347   16.550   46.638   23.592   12.593   23.222   44.372   12.407   30.071   12.135 14.30073 17.35534 
1 1 1    2   10   40 o   26.013   7.8422 -11.2395   17.199 -43.9818   24.324   21.497   24.322   18.685   9.1730   33.342   12.722 -14.65659 15.68431 
1 1 1    2   10   41 o   52.489   9.8608   68.655   21.713   70.839   29.819   66.190   31.678   53.641   13.491   51.337   14.385 2.304264 19.72163 
1 1 1    2   10   42 o   31.133   8.7184   17.006   16.716   22.138   23.963   12.141   23.330   32.961   12.616   29.305   12.037 3.656351 17.43676 
1 1 1    2   10   43 f   28.301   8.3957   7.9143   16.945  -2.3899   24.021   18.120   23.906   25.336   11.305   31.265   12.416 -5.928862 16.79134 
1 1 1    2   10   44 o   31.247   8.5986   19.014   16.166   27.257   23.314   11.382   22.435   34.219   12.579   28.275   11.727 5.943741 17.19726 
1 1 1    2   10   45 o   25.640   7.8419   0.9829   16.094   17.433   22.747 -15.5076   22.775   29.876   12.027   21.404   10.066 8.471588 15.68371 
1 1 1    2   10   46 o   21.695   7.2781 -18.0912   17.535 -23.6163   26.318 -13.6806   23.514   21.537   10.324   21.853   10.262 -0.3166084 14.55623 
1 1 1    2   10   47 o   38.561   9.2146   42.340   17.533   48.159   24.894   36.610   24.700   40.970   13.066   36.152   12.997 4.817661 18.42910 
1 1 1    2   10   48 o   31.626   10.505  -6.8460   37.017   56.394   52.630 -68.7564   52.074   38.402   16.955   24.850   12.409 13.55146 21.01070 
1 1 1    2   10   49 o   25.798   8.4700  -0.3017   21.631   5.4646   31.258  -5.6008   29.965   26.928   12.360   24.668   11.584 2.260075 16.93992 
1 1 1    2   10   50 o   34.600   9.7925   40.459   22.071   62.011   32.255   21.484   30.266   40.159   14.790   29.041   12.838 11.11805 19.58498 
1 1 1    2   11    0 o  319.725   2.5982  2109.56   48.439  2109.56   48.439  2109.56   48.439  319.725   3.6743  319.725   3.6743 0.000000 0.000000 
1 1 1    2   11    1 o  242.907   2.4080  1218.88   23.915  1228.79   31.860  1206.09   36.194  244.048   3.1653  241.766   3.6297 2.281525 4.816009 
1 1 1    2   11    2 o  487.473   3.8429  4905.24   76.402  4896.88  100.767  4916.55  117.180  487.030   5.0164  487.915   5.8229 -0.8854370 7.685786 
1 1 1    2   11    3 o  293.711   3.2492  1753.28   37.573  1692.59   46.272  1870.75   64.375  286.398   3.9172  301.023   5.1851 -14.62448 6.498431 
1 1 1    2   11    4 o  423.954   5.2025  3710.41   90.969  3710.41   90.969   0.0000   0.0000  423.954   5.2025  ?   ?       ?      ? 
1 1 1    2   11    5 o  257.566   2.8913  1373.49   28.804  1382.28   35.153  1355.54   50.246  258.850   3.2927  256.281   4.7536 2.568268 5.782594 
1 1 1    2   11    6 o  588.094   5.1220  7136.31  116.765  7122.92  142.511  7163.63  203.667  587.410   5.8822  588.779   8.3869 -1.368469 10.24408 
1 1 1    2   11    7 o  253.541   3.5117  1370.84   31.682  1417.55   36.849  1238.44   62.039  262.142   3.4081  244.940   6.1410 17.20142 7.023341 
1 1 1    2   11    8 o  646.909   7.4945  8587.04  169.796  8527.37  193.948  8782.85  351.349  642.611   7.3177  651.207   13.081 -8.596436 14.98901 
1 1 1    2   11    9 o  283.157   2.9038  1653.30   33.890  1629.76   46.960  1678.88   48.959  281.056   4.0511  285.257   4.1613 -4.200134 5.807541 
1 1 1    2   11   10 o  237.777   2.3638  1166.19   23.181  1153.91   32.587  1178.77   32.981  236.509   3.3407  239.044   3.3452 -2.534805 4.727612 
1 1 1    2   11   11 o  374.928   3.2374  2900.39   49.532  2899.61   65.457  2901.43   75.765  374.885   4.2334  374.972   4.8990 -0.8712769E-01 6.474719 
1 1 1    2   11   12 o  300.291   2.8635  1856.31   34.944  1884.60   54.469  1836.52   45.553  302.219   4.3698  298.362   3.7018 3.856628 5.726976 
1 1 1    2   11   13 o  387.134   3.0701  3092.40   49.018  3079.12   68.905  3106.00   69.747  386.294   4.3248  387.974   4.3587 -1.680603 6.140187 
1 1 1    2   11   14 o  203.436   2.6723  853.830   22.422  861.162   31.819  846.599   31.600  204.303   3.7762  202.568   3.7823 1.734940 5.344614 
1 1 1    2   11   15 o  181.176   2.5591  677.894   18.887  673.011   29.031  681.477   24.869  180.603   3.8974  181.749   3.3176 -1.145920 5.118198 
1 1 1    2   11   16 o  309.175   2.9817  1971.02   37.532  1962.12   49.230  1983.38   57.999  308.360   3.8708  309.989   4.5364 -1.629181 5.963416 
1 1 1    2   11   17 o  243.375   2.5257  1222.09   25.351  1232.71   36.133  1211.80   35.578  244.416   3.5843  242.335   3.5596 2.081314 5.051500 
1 1 1    2   11   18 o  233.325   2.9585  1123.53   28.468  1105.62   39.953  1142.01   40.573  231.436   4.1856  235.214   4.1823 -3.777542 5.916949 
1 1 1    2   11   19 o  193.121   2.6037  769.682   20.737  777.214   29.515  762.338   29.143  194.054   3.6877  192.188   3.6765 1.865601 5.207301 
1 1 1    2   11   20 o   76.268   4.2652  119.900   13.356  136.837   19.428  104.724   18.390   81.367   5.7891   71.168   6.2652 10.19881 8.530372 
1 1 1    2   11   21 o  425.054   3.3842  3732.53   59.328  3741.20   83.866  3723.85   83.940  425.549   4.7783  424.559   4.7936 0.9902649 6.768363 
1 1 1    2   11   22 o  288.134   3.0625  1710.08   35.898  1744.23   55.800  1685.96   46.891  290.544   4.6564  285.724   3.9790 4.819244 6.124931 
1 1 1    2   11   23 o  291.642   2.8391  1757.05   34.149  1768.28   48.506  1746.01   48.086  292.566   4.0198  290.718   4.0104 1.847229 5.678172 
1 1 1    2   11   24 f  207.422   3.1025  889.059   26.541  884.334   37.305  893.901   37.767  206.865   4.3724  207.978   4.4028 -1.112900 6.205022 
1 1 1    2   11   25 o  184.066   3.4074  700.664   25.859  702.196   36.140  699.056   37.018  184.279   4.7549  183.853   4.8817 0.4259033 6.814707 
1 1 1    2   11   26 o   80.483   4.4501  134.466   14.685  153.532   21.024  116.302   20.521   86.085   5.9214   74.880   6.6446 11.20561 8.900272 
1 1 1    2   11   27 o  124.711   3.9487  321.425   20.285  337.237   29.617  307.454   27.839  127.589   5.6282  121.833   5.5402 5.755699 7.897477 
1 1 1    2   11   28 o   94.779   4.1346  188.022   15.993  160.835   23.012  213.422   22.242   88.044   6.3369  101.513   5.3124 -13.46893 8.269114 
1 1 1    2   11   29 o   44.054   7.4866   41.197   14.935   66.563   21.138   15.909   21.106   56.436   9.0809   31.672   11.905 24.76420 14.97328 
1 1 1    2   11   30 o  116.514   3.7549  281.732   18.016  268.111   25.743  294.808   25.223  113.730   5.4880  119.297   5.1263 -5.566826 7.509810 
1 1 1    2   11   31 o   86.454   5.0758  153.242   17.954  181.818   27.287  131.423   23.843   93.465   7.0784   79.442   7.2769 14.02235 10.15167 
1 1 1    2   11   32 o  104.751   4.5853  228.495   19.794  235.031   27.718  221.693   28.276  106.304   6.3219  103.198   6.6433 3.105827 9.170620 
1 1 1    2   11   33 o   78.921   5.5743  131.247   18.017  146.394   25.206  115.422   25.764   83.692   7.3022   74.150   8.4243 9.541931 11.14857 
1 1 1    2   11   34 o  136.077   4.6911  387.850   26.254  412.747   36.670  361.669   37.604  140.650   6.3213  131.505   6.9331 9.144928 9.382290 
1 1 1    2   11   35 o   62.822   8.7147   88.425   22.011   74.698   31.886  100.922   30.423   57.156   13.703   68.487   10.770 -11.33087 17.42942 
1 1 1    2   11   36 o   32.841   8.9142   17.565   17.049   22.131   24.015   12.926   24.209   34.482   12.751   31.199   12.461 3.282930 17.82846 
1 1 1    2   11   37 o   77.678   5.5394  128.965   17.714  136.989   24.955  120.818   25.148   80.212   7.5432   75.144   8.1142 5.068222 11.07879 
1 1 1    2   11   38 o   67.362   6.3437   97.867   17.403  119.364   25.379   78.784   23.911   74.570   8.2516   60.154   9.6375 14.41648 12.68741 
1 1 1    2   11   39 o   24.297   7.7963  -9.0843   16.956  -7.4885   23.921 -10.6958   24.038   24.623   11.109   23.971   10.941 0.6520424 15.59269 
1 1 1    2   11   40 o   41.368   7.9664   38.201   16.387   7.5382   23.110   69.213   23.241   28.132   11.803   54.603   10.703 -26.47007 15.93270 
1 1 1    2   11   41 o   34.285   8.1924   20.025   16.620  -9.8344   23.837   48.274   23.185   23.907   10.906   44.663   12.228 -20.75625 16.38485 
1 1 1    2   11   42 o   53.641   9.7719   73.542   21.824   80.426   30.860   66.654   30.868   56.489   13.440   50.792   14.188 5.696014 19.54373 
1 1 1    2   11   43 o   25.874   8.0055   0.1910   16.536   10.401   23.759  -9.4009   23.029   28.589   11.979   23.160   10.623 5.428371 16.01097 
1 1 1    2   11   44 o   46.378   7.2104   50.185   17.039   1.4811   23.651  102.747   24.569   25.712   11.358   67.045   8.8852 -41.33264 14.42079 
1 1 1    2   11   45 o   28.657   8.3704   14.100   16.095   11.960   23.388   16.025   22.182   28.181   11.851   29.133   11.824 -0.9517803 16.74084 
1 1 1    2   11   46 o   30.200   9.0289   17.701   19.423   21.062   27.023   14.109   27.936   31.058   12.875   29.342   12.662 1.716362 18.05772 
1 1 1    2   11   47 o   32.430   8.8404   25.668   17.358   38.968   24.835   12.968   24.269   36.942   13.059   27.918   11.919 9.023811 17.68074 
1 1 1    2   11   48 o   27.277   9.4923 -35.2576   37.672 -15.6071   52.811 -55.6159   53.754   28.761   13.988   25.793   12.835 2.967787 18.98460 
1 1 1    2   11   49 o   31.046   10.131   21.178   28.182   18.046   33.230   29.203   53.188   29.405   13.196   32.686   15.376 -3.280569 20.26186 
1 1 1    2   11   50 o   25.326   8.6829 -12.6124   25.258   18.764   44.450 -27.5737   30.694   29.479   13.925   21.173   10.376 8.306042 17.36572 
1 1 1    2   12    0 o  706.852   5.6572 10317.34  233.175 10317.34  233.175 10317.34  233.175  706.852   8.0004  706.852   8.0004 0.000000 0.000000 
1 1 1    2   12    1 o  334.349   3.4939  2297.70   46.819  2268.34   59.374  2345.98   76.134  331.563   4.3417  337.135   5.4753 -5.572021 6.987811 
1 1 1    2   12    2 o  245.304   2.4524  1239.12   24.491  1227.75   32.081  1255.01   37.917  243.964   3.1883  246.644   3.7273 -2.679871 4.904898 
1 1 1    2   12    3 o  639.408   4.8506  8435.89  126.399  8404.00  166.267  8479.56  194.558  638.037   6.3182  640.778   7.3616 -2.740906 9.701214 
1 1 1    2   12    4 o  177.593   3.2152  650.579   23.551  650.579   23.551   0.0000   0.0000  177.593   3.2152  ?   ?       ?      ? 
1 1 1    2   12    5 o  490.723   4.3655  5002.32   84.579  5082.55  105.786  4860.16  140.817  496.282   5.1681  485.165   7.0372 11.11673 8.731074 
1 1 1    2   12    6 o  250.588   2.8114  1289.69   25.659  1283.18   29.901  1307.88   49.979  249.418   2.9066  251.758   4.8133 -2.340332 5.622799 
1 1 1    2   12    7 o  672.312   5.0591  9350.71  139.665  9514.48  189.770  9157.18  206.295  678.796   6.7783  665.829   7.5121 12.96729 10.11818 
1 1 1    2   12    8 o  119.417   3.4920  294.186   17.199  294.186   17.199   0.0000   0.0000  119.417   3.4920  ?   ?       ?      ? 
1 1 1    2   12    9 f  472.668   3.7844  4618.80   73.371  4690.75   99.143  4531.69  109.094  476.765   5.0419  468.572   5.6450 8.193604 7.568768 
1 1 1    2   12   10 o  407.436   3.6417  3420.13   61.097  3521.76   89.467  3331.31   83.637  413.092   5.2511  401.779   5.0472 11.31317 7.283378 
1 1 1    2   12   11 o  372.802   3.4272  2866.50   52.669  2916.69   75.971  2820.05   73.083  375.940   4.8997  369.665   4.7934 6.275024 6.854460 
1 1 1    2   12   12 o  250.170   3.8909  1263.89   34.764  1236.99   39.938  1347.97   70.622  244.855   3.9547  255.485   6.7021 -10.62950 7.781882 
1 1 1    2   12   13 o  349.154   3.2972  2515.78   47.481  2511.56   66.959  2520.05   67.339  348.860   4.6537  349.448   4.6722 -0.5881348 6.594366 
1 1 1    2   12   14 o   51.589   4.5489   54.738   9.6009   65.127   14.063   45.669   13.139   56.159   6.0715   47.019   6.7753 9.139725 9.097719 
1 1 1    2   12   15 o   38.653   5.8227   33.052   9.2877   17.851   13.544   46.545   12.760   29.841   9.6502   47.465   6.5182 -17.62370 11.64535 
1 1 1    2   12   16 o  219.323   2.8996  992.553   26.226  978.966   36.716  1006.71   37.474  217.792   4.0875  220.855   4.1139 -3.062988 5.799268 
1 1 1    2   12   17 o  252.824   2.5755  1318.70   26.850  1337.73   38.466  1300.61   37.497  254.602   3.6631  251.046   3.6214 3.555634 5.150991 
1 1 1    2   12   18 f  115.395   3.1505  273.369   14.948  255.009   20.195  295.616   22.231  111.136   4.4058  119.654   4.5047 -8.518578 6.301034 
1 1 1    2   12   19 f  134.818   2.8275  375.257   15.720  367.621   22.225  382.902   22.237  133.444   4.0382  136.192   3.9588 -2.747986 5.655001 
1 1 1    2   12   20 o  188.891   2.6645  736.488   20.755  717.572   29.174  755.872   29.532  186.434   3.7941  191.348   3.7420 -4.913574 5.329006 
1 1 1    2   12   21 o  268.049   2.7264  1483.35   30.137  1468.91   42.180  1498.41   43.075  266.718   3.8343  269.379   3.8770 -2.661163 5.452851 
1 1 1    2   12   22 o  202.419   3.1051  846.600   25.919  824.605   36.440  869.120   36.872  199.755   4.4230  205.082   4.3592 -5.326996 6.210123 
1 1 1    2   12   23 o  137.430   3.6646  385.689   20.546  359.320   26.804  423.262   31.995  131.825   4.9298  143.034   5.4234 -11.20949 7.329145 
1 1 1    2   12   24 o  181.888   2.7860  682.438   20.883  647.349   28.943  720.545   30.162  177.016   3.9643  186.760   3.9157 -9.743744 5.572075 
1 1 1    2   12   25 o  232.077   3.0143  1110.24   28.403  1130.92   44.438  1095.95   36.930  233.853   4.6073  230.301   3.8880 3.551651 6.028591 
1 1 1    2   12   26 o  164.443   2.9548  559.118   20.034  564.399   28.043  553.614   28.630  165.242   4.1147  163.644   4.2419 1.598358 5.909638 
1 1 1    2   12   27 o   96.242   4.2730  189.208   16.827  162.004   22.367  224.682   25.541   88.382   6.1358  104.102   5.9486 -15.71997 8.545964 
1 1 1    2   12   28 o   55.092   6.6168   64.619   14.605   73.785   20.817   55.732   20.497   59.477   8.4858   50.706   10.155 8.771133 13.23368 
1 1 1    2   12   29 o  149.381   3.1981  461.710   19.697  445.256   27.713  478.506   28.000  146.685   4.5808  152.077   4.4641 -5.391510 6.396204 
1 1 1    2   12   30 o  145.845   3.3618  440.468   20.221  443.823   28.534  437.083   28.660  146.406   4.7255  145.283   4.7829 1.123169 6.723558 
1 1 1    2   12   31 o   91.123   5.0818  173.601   19.018  157.243   27.122  189.424   26.675   86.834   7.5730   95.412   6.7785 -8.577751 10.16357 
1 1 1    2   12   32 o  156.473   3.6911  507.867   23.815  520.977   34.159  495.470   33.219  158.435   5.2274  154.511   5.2127 3.924362 7.382267 
1 1 1    2   12   33 o  107.523   4.2572  240.871   18.875  238.633   26.909  243.039   26.482  107.017   6.0966  108.028   5.9436 -1.010933 8.514361 
1 1 1    2   12   34 o   60.888   9.1580   84.722   22.657  104.806   30.683   60.641   33.597   70.051   10.620   51.724   14.923 18.32645 18.31594 
1 1 1    2   12   35 o   72.368   7.6292  115.947   21.906   99.932   31.971  130.118   30.074   66.734   12.060   78.003   9.3480 -11.26925 15.25847 
1 1 1    2   12   36 o   24.877   7.7409  -9.9329   16.436 -29.5068   23.434   9.0196   23.059   20.475   9.7952   29.279   11.989 -8.804132 15.48180 
1 1 1    2   12   37 o   70.873   6.0015  108.266   17.462   96.473   24.634  120.177   24.756   66.826   8.9379   74.920   8.0117 -8.094330 12.00303 
1 1 1    2   12   38 o   20.784   6.9340 -21.4492   15.538 -25.5812   22.033 -17.3608   21.917   20.067   9.5716   21.502   10.035 -1.435289 13.86798 
1 1 1    2   12   39 o   38.654   9.4017   33.116   18.495   45.748   27.197   22.248   25.227   43.433   13.634   33.876   12.949 9.557068 18.80334 
1 1 1    2   12   40 o   45.401   8.7223   49.533   17.002   39.049   23.770   60.515   24.327   40.451   12.753   50.350   11.902 -9.899059 17.44457 
1 1 1    2   12   41 o   43.799   8.6350   47.128   17.019   29.486   24.274   64.183   23.867   35.927   12.888   51.672   11.496 -15.74427 17.26992 
1 1 1    2   12   42 o   53.669   11.003   78.608   30.359  126.201   41.614   24.453   44.390   69.493   14.962   37.845   16.138 31.64730 22.00652 
1 1 1    2   12   43 o   50.225   8.3967   62.787   17.113   62.358   24.620   63.187   23.804   49.898   12.090   50.552   11.655 -0.6548691 16.79334 
1 1 1    2   12   44 o   29.415   8.4813   15.206   16.428   8.7703   23.604   21.253   22.879   27.491   11.747   31.338   12.237 -3.846745 16.96259 
1 1 1    2   12   45 o   54.845   7.6301   75.516   16.813  100.443   24.099   51.878   23.467   65.679   8.8964   44.010   12.399 21.66978 15.26011 
1 1 1    2   12   46 o   25.067   8.0342  -7.8269   18.954   17.107   27.189 -31.4014   26.437   29.844   12.676   20.290   9.8750 9.553864 16.06832 
1 1 1    2   12   47 o   26.931   8.6921   2.2871   20.608  -2.0813   25.830   9.9385   34.185   24.577   11.264   29.286   13.241 -4.708954 17.38413 
1 1 1    2   12   48 o   37.455   10.970   51.587   29.095   31.155   45.255   65.981   37.986   33.287   15.123   41.623   15.895 -8.336426 21.94007 
1 1 1    2   12   49 o   32.710   9.2127   15.561   22.551   75.511   34.073 -31.1705   30.082   44.572   15.326   20.848   10.228 23.72458 18.42545 
1 1 1    2   12   50 f   22.389   7.6872 -19.5484   22.182  -7.0307   32.431 -30.5529   30.408   24.096   11.526   20.683   10.174 3.412664 15.37445 
1 1 1    2   13    0 o  139.209   2.1544  400.267   17.474  400.267   17.474  400.267   17.474  139.209   3.0467  139.209   3.0467 0.000000 0.000000 
1 1 1    2   13    1 o  520.982   3.8711  5612.26   80.902  5647.07  103.227  5556.84  130.255  523.130   4.7843  518.834   6.0870 4.295349 7.742150 
1 1 1    2   13    2 o  533.877   4.1365  5890.68   90.458  5947.31  121.344  5819.85  135.712  536.799   5.4808  530.954   6.1972 5.844727 8.273091 
1 1 1    2   13    3 o  152.609   2.3022  470.284   12.865  458.892   14.971  502.460   25.160  149.160   2.4334  156.059   3.9089 -6.899445 4.604486 
1 1 1    2   13    4 o  437.492   4.6513  3948.74   83.837  3885.90  115.502  4018.72  121.882  433.826   6.4552  441.158   6.6986 -7.331207 9.302682 
1 1 1    2   13    5 o  293.469   3.1223  1777.00   35.387  1776.87   43.057  1777.27   62.120  293.482   3.5571  293.457   5.1324 0.2474976E-01 6.244551 
1 1 1    2   13    6 o  516.414   4.4186  5534.94   85.944  5578.45  102.659  5433.01  157.137  519.939   4.7872  512.889   7.4283 7.049988 8.837256 
1 1 1    2   13    7 o  150.660   2.2124  463.315   13.456  445.505   17.191  491.495   21.623  146.964   2.8360  154.356   3.3965 -7.392212 4.424840 
1 1 1    2   13    8 o  571.505   4.8528  6727.59  102.781  6706.15  121.088  6782.83  194.405  570.044   5.1502  572.965   8.2265 -2.921021 9.705666 
1 1 1    2   13    9 o  454.680   3.5161  4264.59   63.706  4259.06   80.307  4273.98  104.634  454.326   4.2857  455.034   5.5753 -0.7074890 7.032105 
1 1 1    2   13   10 o  439.481   3.4327  3985.41   60.139  3983.67   75.863  3988.36   98.655  439.393   4.1861  439.568   5.4416 -0.1748962 6.865498 
1 1 1    2   13   11 o  234.238   2.5492  1133.87   24.413  1146.91   32.550  1117.09   36.909  235.787   3.3471  232.689   3.8459 3.098572 5.098395 
1 1 1    2   13   12 o  278.833   2.7529  1601.98   31.271  1590.38   41.057  1618.01   48.258  277.643   3.5854  280.022   4.1784 -2.379547 5.505861 
1 1 1    2   13   13 o  277.876   2.7848  1592.87   31.532  1596.14   48.528  1590.47   41.482  278.111   4.2307  277.642   3.6225 0.4684753 5.569694 
1 1 1    2   13   14 o  209.354   2.5358  904.946   21.709  899.978   32.874  908.788   28.910  208.836   3.8166  209.872   3.3399 -1.035690 5.071613 
1 1 1    2   13   15 o  112.480   2.9178  264.053   13.300  243.513   20.356  279.352   17.569  108.611   4.5443  116.350   3.6611 -7.738937 5.835564 
1 1 1    2   13   16 o   81.566   4.3588  136.402   13.404  140.152   24.742  134.844   15.947   82.319   7.2873   80.812   4.7845 1.507416 8.717572 
1 1 1    2   13   17 o  385.543   3.5960  3069.67   57.172  3097.40   81.777  3043.16   79.960  387.241   5.1202  383.844   5.0507 3.397186 7.192045 
1 1 1    2   13   18 o  241.786   2.8149  1205.47   27.779  1197.34   36.670  1216.41   42.553  240.849   3.6915  242.724   4.2506 -1.874908 5.629824 
1 1 1    2   13   19 o  291.637   2.9586  1755.75   35.282  1760.64   53.550  1752.00   46.901  291.970   4.4468  291.303   3.9037 0.6670532 5.917178 
1 1 1    2   13   20 o   84.896   4.0252  151.000   13.884  134.801   20.809  163.995   18.639   80.715   6.2508   89.078   5.0732 -8.362991 8.050433 
1 1 1    2   13   21 o  175.721   2.7178  637.769   19.690  637.643   28.228  637.888   27.480  175.700   3.8952  175.741   3.7912 -0.4127502E-01 5.435643 
1 1 1    2   13   22 f  231.508   3.0473  1107.44   29.095  1113.08   41.455  1101.97   40.844  232.087   4.3307  230.930   4.2883 1.156509 6.094656 
1 1 1    2   13   23 o  122.167   3.5236  308.798   17.730  305.233   25.667  312.052   24.521  121.482   5.1227  122.851   4.8394 -1.368774 7.047164 
1 1 1    2   13   24 f  182.368   2.7393  686.620   20.595  710.893   29.613  663.878   28.663  185.487   3.8708  179.248   3.8771 6.239059 5.478538 
1 1 1    2   13   25 f  111.984   3.4131  259.380   15.763  262.798   22.463  256.064   22.125  112.711   4.8322  111.258   4.8215 1.452675 6.826198 
1 1 1    2   13   26 o   41.326   10.624   30.517   23.409   31.314   33.867   29.787   32.394   41.799   15.192   40.853   14.856 0.9457893 21.24812 
1 1 1    2   13   27 o   91.423   4.1517  173.308   15.652  171.752   22.276  174.826   21.998   91.013   5.9343   91.834   5.8079 -0.8212357 8.303452 
1 1 1    2   13   28 f  104.422   3.8449  226.231   16.539  216.139   23.593  235.981   23.190  102.114   5.6019  106.730   5.2680 -4.615631 7.689839 
1 1 1    2   13   29 o  220.427   3.0961  1002.27   27.914  982.083   36.996  1028.95   42.536  217.901   4.1165  222.953   4.6257 -5.051697 6.192102 
1 1 1    2   13   30 f  136.649   3.4670  386.952   19.532  381.083   27.912  392.584   27.341  135.623   4.9898  137.676   4.8149 -2.053421 6.934088 
1 1 1    2   13   31 o   57.770   7.7894   72.285   17.771   68.115   23.606   77.739   26.998   55.913   10.625   59.628   11.393 -3.714912 15.57874 
1 1 1    2   13   32 o  188.335   3.5343  736.269   27.448  717.044   38.745  755.641   38.891  185.853   5.0545  190.818   4.9415 -4.964264 7.068694 
1 1 1    2   13   33 o   35.893   8.8218   24.312   16.683   11.428   24.192   35.994   23.037   31.081   12.441   40.706   12.510 -9.624777 17.64353 
1 1 1    2   13   34 o   59.943   9.9824   85.239   23.468   67.850   42.524   92.854   28.141   54.124   17.057   65.762   10.375 -11.63747 19.96488 
1 1 1    2   13   35 o  118.955   4.0323  296.204   19.782  297.073   28.182  295.361   27.773  119.117   5.7364  118.794   5.6684 0.3227539 8.064592 
1 1 1    2   13   36 o   25.884   7.9641  -1.2197   15.962  -5.3861   22.660   2.8837   22.488   24.798   11.028   26.969   11.493 -2.170683 15.92819 
1 1 1    2   13   37 o   95.576   4.5457  193.293   17.883  179.641   25.310  206.904   25.271   92.116   6.6617   99.036   6.1868 -6.919884 9.091474 
1 1 1    2   13   38 o   45.398   8.4428   48.543   16.232   60.888   23.690   37.617   22.287   50.843   11.559   39.953   12.309 10.88926 16.88568 
1 1 1    2   13   39 f   37.116   9.3310   30.289   18.143   22.767   25.124   38.487   26.227   33.959   12.937   40.273   13.450 -6.313965 18.66210 
1 1 1    2   13   40 o   28.509   8.1967   5.8101   16.463 -13.8080   23.540   24.591   23.032   22.933   10.598   34.085   12.507 -11.15184 16.39332 
1 1 1    2   13   41 o   25.949   7.9289  -2.1142   16.425   15.559   23.489 -19.0246   22.976   30.484   12.239   21.414   10.083 9.070175 15.85775 
1 1 1    2   13   42 o   37.864   9.9650   33.834   21.178   23.570   29.839   44.251   30.062   34.347   13.793   41.381   14.386 -7.034035 19.93009 
1 1 1    2   13   43 o   31.969   8.6764   20.656   16.610   32.240   23.619   9.3203   23.365   36.093   12.738   27.845   11.784 8.248211 17.35285 
1 1 1    2   13   44 o   25.447   7.8400  -1.0718   16.364   17.699   23.485 -18.7836   22.814   30.085   12.182   20.808   9.8722 9.277346 15.67993 
1 1 1    2   13   45 o   51.029   8.4593   57.566   20.824  136.642   34.893   13.823   25.952   73.108   11.572   28.950   12.342 44.15781 16.91855 
1 1 1    2   13   46 o   22.945   7.6263 -14.0443   18.371 -23.4314   24.782  -2.5929   27.371   20.608   9.9148   25.282   11.591 -4.673283 15.25263 
1 1 1    2   13   47 o   28.311   8.7602   2.7867   22.131 -37.4740   32.626   37.098   30.120   21.697   10.646   34.925   13.915 -13.22840 17.52035 
1 1 1    2   13   48 o   31.335   9.4489   22.157   22.726   47.076   32.725  -1.0530   31.583   36.863   14.562   25.807   12.045 11.05584 18.89783 
1 1 1    2   13   49 o   25.539   8.4882   1.3523   22.840   1.3786   32.006   1.3250   32.604   25.481   11.968   25.598   12.041 -0.1168766 16.97640 
1 1 1    2   14    0 o   65.877   2.6171   90.358   9.9839   90.358   9.9839   90.358   9.9839   65.877   3.7012   65.877   3.7012 0.000000 0.000000 
1 1 1    2   14    1 o  179.459   2.6539  659.738   19.016  646.309   23.931  682.744   31.322  177.007   3.2779  181.911   4.1747 -4.904480 5.307797 
1 1 1    2   14    2 o  389.805   3.0933  3141.35   48.342  3161.95   61.626  3108.40   77.943  391.494   3.8166  388.117   4.8691 3.376923 6.186644 
1 1 1    2   14    3 o  130.729   2.2994  350.593   11.502  347.387   13.851  357.717   20.647  129.778   2.5877  131.679   3.8016 -1.901749 4.598723 
1 1 1    2   14    4 o  536.034   4.4671  5931.29   98.747  5897.95  138.346  5965.91  140.990  534.503   6.2756  537.566   6.3590 -3.062988 8.934208 
1 1 1    2   14    5 o  590.484   5.0993  7241.92  118.800  7344.56  148.397  7058.76  198.244  596.474   6.0321  584.495   8.2234 11.97845 10.19857 
1 1 1    2   14    6 o  299.927   3.3392  1862.87   40.623  1893.67   53.089  1819.37   63.097  302.947   4.2489  296.906   5.1526 6.040619 6.678445 
1 1 1    2   14    7 o  233.890   3.6922  1125.76   27.501  1123.85   30.400  1134.34   64.524  233.410   3.1579  234.370   6.6750 -0.9599609 7.384322 
1 1 1    2   14    8 o  394.856   3.1669  3210.48   49.646  3192.38   62.194  3242.27   82.424  393.359   3.8335  396.354   5.0420 -2.995270 6.333831 
1 1 1    2   14    9 o  216.270   2.3160  967.825   19.978  976.605   25.283  953.232   32.596  217.589   2.8173  214.950   3.6767 2.638748 4.631967 
1 1 1    2   14   10 o  408.460   3.2566  3438.11   52.894  3424.50   66.431  3461.70   87.428  407.395   3.9536  409.525   5.1761 -2.129486 6.513278 
1 1 1    2   14   11 o  181.593   2.2756  682.263   16.399  687.570   20.600  673.080   27.095  182.570   2.7357  180.617   3.6372 1.953506 4.551190 
1 1 1    2   14   12 o   95.901   2.7373  191.083   10.746  204.209   14.671  175.888   15.785   99.483   3.5755   92.319   4.1457 7.164581 5.474524 
1 1 1    2   14   13 o  251.416   3.4271  1304.98   35.537  1305.74   50.415  1304.23   50.101  251.488   4.8605  251.344   4.8329 0.1437073 6.854293 
1 1 1    2   14   14 o  361.748   2.9547  2701.03   44.084  2693.86   62.190  2708.27   62.498  361.266   4.1738  362.230   4.1833 -0.9640198 5.909337 
1 1 1    2   14   15 o  157.201   2.4565  510.146   15.922  500.244   22.661  519.799   22.375  155.692   3.5290  158.710   3.4181 -3.017441 4.912938 
1 1 1    2   14   16 o  207.647   2.7145  887.375   22.846  903.957   35.950  876.141   29.589  209.253   4.1654  206.042   3.4819 3.211105 5.429014 
1 1 1    2   14   17 o  173.658   3.4039  618.269   23.725  603.499   30.082  642.576   38.589  170.963   4.2661  176.352   5.3053 -5.388947 6.807808 
1 1 1    2   14   18 o   99.074   3.2569  202.617   13.302  206.941   19.188  198.616   18.457  100.090   4.6480   98.059   4.5636 2.030838 6.513876 
1 1 1    2   14   19 o  295.237   2.7640  1799.76   33.655  1779.70   47.334  1820.26   47.861  293.574   3.9092  296.901   3.9085 -3.326630 5.527917 
1 1 1    2   14   20 o  193.707   2.6264  774.947   20.982  773.386   29.789  776.483   29.559  193.512   3.7324  193.902   3.6960 -0.3899231 5.252738 
1 1 1    2   14   21 o  277.042   2.9746  1583.90   33.532  1597.81   51.957  1573.98   43.898  278.040   4.5308  276.044   3.8556 1.996307 5.949282 
1 1 1    2   14   22 o   96.690   5.5290  209.806   20.011  242.342   24.946  151.079   33.515  108.217   5.5891   85.163   9.5417 23.05370 11.05809 
1 1 1    2   14   23 o   88.074   4.9828  161.597   18.014  144.617   25.618  178.205   25.335   83.447   7.4433   92.700   6.6265 -9.252357 9.965562 
1 1 1    2   14   24 o   73.791   4.9729  113.140   15.092  123.934   21.481  102.619   21.208   77.290   6.7385   70.293   7.3153 6.997383 9.945886 
1 1 1    2   14   25 o   68.528   5.2148   97.430   14.682   99.734   21.854   95.534   19.820   69.245   7.6522   67.812   7.0866 1.432144 10.42957 
1 1 1    2   14   26 o  100.730   6.6839  211.100   26.982  285.232   40.072  149.613   36.495  116.991   8.3048   84.470   10.475 32.52098 13.36786 
1 1 1    2   14   27 o  132.056   3.3070  360.805   18.000  378.858   25.689  343.390   25.230  135.308   4.6032  128.804   4.7492 6.503540 6.613912 
1 1 1    2   14   28 o   81.616   4.7009  138.319   15.801  139.895   23.034  136.918   21.717   82.040   6.8072   81.192   6.4851 0.8483734 9.401857 
1 1 1    2   14   29 o   69.586   5.6186  101.669   16.013   89.997   22.993  112.662   22.314   65.626   8.4948   73.547   7.3562 -7.920700 11.23725 
1 1 1    2   14   30 o   61.223   6.6737   80.615   16.264   70.464   23.680   89.682   22.378   56.967   10.464   65.480   8.2861 -8.512535 13.34737 
1 1 1    2   14   31 o  163.858   3.8652  555.330   26.001  534.207   34.864  581.798   39.028  160.405   5.2699  167.312   5.6556 -6.906982 7.730314 
1 1 1    2   14   32 f   38.759   8.3768   25.776   16.834   57.397   25.221   0.3691   22.607   50.711   12.206   26.807   11.476 23.90405 16.75351 
1 1 1    2   14   33 o   25.122   7.8702  -6.6066   16.241  -1.6497   23.172 -11.3923   22.768   26.473   11.478   23.772   10.772 2.700684 15.74043 
1 1 1    2   14   34 o   33.435   9.0733   13.792   19.332 -10.8060   28.931   33.637   25.986   27.202   12.250   39.667   13.388 -12.46539 18.14660 
1 1 1    2   14   35 o   48.348   9.3868   54.613   18.980   56.121   24.009   52.101   30.992   49.441   11.914   47.256   14.509 2.184868 18.77356 
1 1 1    2   14   36 o   26.312   7.9125  -0.6329   15.729 -14.5794   22.227   13.357   22.261   22.384   10.328   30.241   11.990 -7.857609 15.82496 
1 1 1    2   14   37 o   30.589   8.4258   14.715   15.611   22.613   22.060   6.7909   22.094   33.469   12.246   27.708   11.577 5.761320 16.85165 
1 1 1    2   14   38 o   27.714   8.1771   6.1939   15.824   14.967   22.762  -2.0116   22.013   30.506   12.115   24.921   10.986 5.585743 16.35415 
1 1 1    2   14   39 o   23.666   7.5709 -10.4217   16.128 -21.4618   22.303   1.6783   23.349   20.786   9.8323   26.546   11.515 -5.760120 15.14189 
1 1 1    2   14   40 o   31.710   8.5472   8.7459   17.783   42.117   26.772 -17.6042   23.789   41.251   13.581   22.169   10.382 19.08167 17.09440 
1 1 1    2   14   41 o   48.664   9.5526   59.429   21.015   86.584   30.687   35.448   28.837   58.868   12.987   38.461   14.012 20.40741 19.10518 
1 1 1    2   14   42 o   33.380   9.2769   15.596   20.830 -11.8549   29.147   44.255   29.781   25.535   11.798   41.226   14.319 -15.69037 18.55387 
1 1 1    2   14   43 o   44.610   9.1964   52.481   17.887   60.005   27.028   46.618   23.859   47.203   13.309   42.017   12.695 5.186211 18.39274 
1 1 1    2   14   44 o   34.028   8.6341   28.459   15.916   17.951   22.515   38.954   22.501   29.777   11.973   38.279   12.443 -8.502131 17.26815 
1 1 1    2   14   45 o   35.478   8.8359   33.215   17.467   14.341   25.159   50.776   24.269   28.626   12.177   42.330   12.807 -13.70364 17.67184 
1 1 1    2   14   46 o   23.754   7.6846  -4.4662   17.136   5.8266   24.305 -14.6392   24.163   25.904   11.475   21.605   10.224 4.299473 15.36921 
1 1 1    2   14   47 o   28.398   9.1451   8.5928   24.504 -18.2205   41.655   22.781   30.301   26.195   12.665   30.601   13.196 -4.406158 18.29018 
1 1 1    2   14   48 o   31.241   9.4693   27.433   22.316   15.044   32.284   38.770   30.882   28.453   12.866   34.029   13.898 -5.575888 18.93866 
1 1 1    2   14   49 o   31.622   10.725   34.546   40.378   39.466   55.601   29.056   58.734   32.126   15.291   31.119   15.044 1.006819 21.45049 
1 1 1    2   15    0 o  742.558   5.9234 11387.62  256.483 11387.62  256.483 11387.62  256.483  742.558   8.3770  742.558   8.3770 0.000000 0.000000 
1 1 1    2   15    1 o  298.511   2.5899  1841.38   30.931  1850.83   39.288  1825.98   50.166  299.535   3.1801  297.487   4.0886 2.048096 5.179733 
1 1 1    2   15    2 o  446.451   3.4076  4131.12   61.402  4202.46   79.435  4025.22   96.782  451.295   4.2676  441.607   5.3137 9.688538 6.815253 
1 1 1    2   15    3 o  242.921   3.1804  1215.45   31.822  1259.44   46.495  1176.68   43.646  247.046   4.5632  238.796   4.4315 8.249939 6.360868 
1 1 1    2   15    4 o  218.225   2.8830  976.204   25.098  958.058   31.556  1007.44   41.404  215.497   3.5504  220.954   4.5434 -5.456451 5.766032 
1 1 1    2   15    5 o  394.000   3.7354  3213.11   57.378  3231.90   70.566  3176.46   98.569  395.762   4.3231  392.238   6.0929 3.523438 7.470805 
1 1 1    2   15    6 o  347.043   3.4593  2481.44   46.256  2473.93   56.120  2497.34   81.690  346.273   3.9295  347.814   5.6945 -1.540649 6.918676 
1 1 1    2   15    7 o  218.371   3.9826  997.374   33.775  1024.38   41.613  945.235   57.821  222.800   4.5284  213.941   6.5527 8.858826 7.965247 
1 1 1    2   15    8 o  662.883   5.4787  9116.63  136.543  9168.42  162.810  8993.83  250.700  666.361   5.9239  659.405   9.2180 6.956238 10.95736 
1 1 1    2   15    9 o   99.262   3.1220  200.572   11.149  197.752   12.878  209.012   22.277   97.906   3.1892  100.618   5.3680 -2.712761 6.243922 
1 1 1    2   15   10 o  322.536   2.7931  2149.07   35.942  2155.93   45.438  2137.59   58.748  323.252   3.4081  321.819   4.4260 1.432831 5.586143 
1 1 1    2   15   11 o  338.556   3.0228  2370.12   41.928  2405.39   56.369  2326.45   62.729  341.399   4.0032  335.714   4.5304 5.684479 6.045692 
1 1 1    2   15   12 o  131.356   2.5196  356.155   13.512  356.798   17.887  355.301   20.620  131.500   3.2980  131.212   3.8102 0.2882233 5.039275 
1 1 1    2   15   13 o  113.233   3.3689  263.085   15.684  288.883   23.282  241.649   21.223  118.283   4.7723  108.183   4.7564 10.10085 6.737827 
1 1 1    2   15   14 o  260.015   2.7486  1394.90   29.091  1399.21   44.951  1391.79   38.160  260.342   4.1863  259.688   3.5628 0.6536255 5.497121 
1 1 1    2   15   15 f   34.445   6.4319   25.688   9.2506   22.997   14.174   27.686   12.210   33.043   9.7387   35.846   8.4044 -2.802811 12.86376 
1 1 1    2   15   16 o   43.827   5.9348   41.078   10.252   41.454   15.633   40.795   13.579   43.924   8.9331   43.730   7.8158 0.1939583 11.86959 
1 1 1    2   15   17 o   86.839   4.7595  151.283   16.776  128.388   21.554  186.466   26.720   78.765   6.6349   94.913   6.8256 -16.14823 9.518996 
1 1 1    2   15   18 o  138.923   2.8922  397.222   16.479  386.299   22.031  411.094   24.828  136.772   3.9054  141.074   4.2670 -4.302444 5.784421 
1 1 1    2   15   19 o  248.298   2.6205  1273.10   26.830  1281.53   38.419  1265.07   37.485  249.098   3.7394  247.499   3.6721 1.598358 5.241001 
1 1 1    2   15   20 o   46.572   6.1674   45.471   11.563   53.649   17.189   38.710   15.628   50.819   8.2009   42.324   9.2138 8.494770 12.33486 
1 1 1    2   15   21 o  184.954   2.6075  706.447   19.890  712.731   28.315  700.326   27.946  185.766   3.6956  184.143   3.6796 1.622391 5.215067 
1 1 1    2   15   22 o   70.814   4.8014  104.204   13.984  101.196   20.378  106.882   19.226   69.828   7.0757   71.799   6.4923 -1.971107 9.602880 
1 1 1    2   15   23 o   46.792   7.3128   47.048   13.709   54.194   20.483   41.250   18.451   50.028   10.271   43.556   10.412 6.472858 14.62551 
1 1 1    2   15   24 o  119.098   3.2216  293.386   15.819  293.891   22.687  292.909   22.070  119.193   4.6149  119.003   4.4965 0.1898117 6.443250 
1 1 1    2   15   25 o  110.701   3.5757  254.068   16.295  246.434   23.557  261.073   22.565  109.088   5.2357  112.313   4.8713 -3.224785 7.151372 
1 1 1    2   15   26 o  235.527   3.1127  1153.85   29.850  1105.45   45.496  1190.43   39.554  231.102   4.7731  239.952   3.9967 -8.849670 6.225463 
1 1 1    2   15   27 o  178.818   3.5435  661.236   26.106  643.040   35.920  681.607   38.007  176.224   4.9420  181.411   5.0796 -5.186813 7.087060 
1 1 1    2   15   28 o  137.895   3.9828  394.528   22.634  391.121   32.582  397.706   31.466  137.302   5.7535  138.488   5.5090 -1.185730 7.965688 
1 1 1    2   15   29 o   38.234   8.9996   27.229   16.732   17.255   21.668   41.958   26.332   32.372   12.084   44.096   13.340 -11.72374 17.99912 
1 1 1    2   15   30 o   40.768   8.9186   35.540   16.536   32.818   22.968   38.469   23.826   39.410   12.548   42.127   12.677 -2.717571 17.83720 
1 1 1    2   15   31 o   85.432   5.3948  153.516   18.934  141.083   27.163  165.265   26.405   81.981   8.0333   88.883   7.2030 -6.901733 10.78967 
1 1 1    2   15   32 o   42.245   9.4113   37.134   18.430   50.267   28.164   27.299   24.373   47.398   13.660   37.092   12.950 10.30550 18.82269 
1 1 1    2   15   33 o   55.472   7.4578   67.840   16.644   61.077   24.041   74.065   23.065   52.100   11.496   58.844   9.5035 -6.743816 14.91566 
1 1 1    2   15   34 o   92.146   4.8029  179.081   18.246  177.500   26.094  180.593   25.524   91.716   6.8982   92.576   6.6847 -0.8597107 9.605745 
1 1 1    2   15   35 o   37.730   9.8731   27.879   20.704   36.637   28.861   18.593   29.718   40.753   14.100   34.708   13.824 6.044525 19.74611 
1 1 1    2   15   36 o   28.390   8.3358   7.3681   16.072   9.6123   22.969   5.2152   22.497   29.199   11.962   27.582   11.612 1.616919 16.67156 
1 1 1    2   15   37 o   36.269   8.4524   27.709   15.876   45.735   22.658   10.322   22.253   43.790   12.129   28.748   11.776 15.04252 16.90487 
1 1 1    2   15   38 o   38.536   9.1608   34.565   17.487   26.619   25.482   41.639   24.042   35.454   13.130   41.618   12.779 -6.163910 18.32162 
1 1 1    2   15   39 o   48.118   8.4323   55.856   16.767   64.303   23.614   47.267   23.812   52.135   11.307   44.101   12.512 8.033787 16.86458 
1 1 1    2   15   40 f   44.477   9.2477   52.670   20.162   20.425   33.594   70.824   25.206   34.784   14.382   54.171   11.629 -19.38705 18.49533 
1 1 1    2   15   41 o   27.189   8.2945   4.2171   17.264   12.428   23.505  -5.4017   25.441   29.149   12.039   25.229   11.413 3.919479 16.58909 
1 1 1    2   15   42 o   27.592   8.1597   5.7508   16.524   23.102   23.568 -11.0256   23.175   32.481   12.493   22.703   10.500 9.777998 16.31948 
1 1 1    2   15   43 o   32.222   8.4748   21.691   16.307   39.219   23.065   4.1742   23.058   38.546   12.602   25.899   11.335 12.64673 16.94954 
1 1 1    2   15   44 o   25.199   7.7027   4.5866   15.083  -5.7517   21.436   14.724   21.227   22.390   10.262   28.009   11.490 -5.619057 15.40545 
1 1 1    2   15   45 o   42.535   9.0764   51.237   17.714   64.406   25.379   38.726   24.737   48.093   12.632   36.978   13.037 11.11538 18.15286 
1 1 1    2   15   46 o   22.279   7.3752  -9.1791   16.960  -7.8459   23.939 -10.5227   24.031   22.509   10.499   22.049   10.360 0.4600410 14.75042 
1 1 1    2   15   47 o   26.498   8.8101  -7.6493   25.837 -39.3041   38.932   17.266   34.540   23.246   11.450   29.751   13.393 -6.504749 17.62030 
1 1 1    2   15   48 o   29.375   8.8881   16.327   21.548 -17.5848   31.241   47.101   29.761   22.673   10.963   36.077   13.993 -13.40373 17.77623 
1 1 1    2   16    0 o  479.366   3.5090  4742.26   98.091  4742.26   98.091  4742.26   98.091  479.366   4.9625  479.366   4.9625 0.000000 0.000000 
1 1 1    2   16    1 o  299.910   2.6049  1855.55   31.158  1855.07   39.336  1856.35   51.046  299.875   3.1805  299.944   4.1262 -0.6951904E-01 5.209709 
1 1 1    2   16    2 o  330.602   3.1649  2261.02   39.132  2268.70   46.456  2242.26   72.607  331.617   3.3966  329.586   5.3413 2.030914 6.329774 
1 1 1    2   16    3 o  206.162   2.7391  878.372   22.984  868.055   35.394  885.894   30.222  205.105   4.1840  207.220   3.5361 -2.114517 5.478164 
1 1 1    2   16    4 o  267.386   2.7639  1473.75   30.457  1510.39   44.123  1440.41   42.095  270.556   3.9541  264.217   3.8628 6.339478 5.527711 
1 1 1    2   16    5 f  168.949   2.7718  587.354   18.602  583.015   23.309  594.962   30.868  168.105   3.3618  169.794   4.4078 -1.688202 5.543561 
1 1 1    2   16    6 o  473.152   4.9706  4625.46   96.993  4612.58  136.258  4638.68  138.098  472.490   6.9920  473.815   7.0667 -1.325165 9.941131 
1 1 1    2   16    7 o  405.375   4.9258  3425.87   66.575  3447.27   74.826  3344.59  145.842  408.685   4.4391  402.064   8.7947 6.621246 9.851504 
1 1 1    2   16    8 o  337.619   3.3971  2373.72   45.039  2422.54   56.044  2284.69   75.681  342.620   3.9660  332.619   5.5166 10.00128 6.794284 
1 1 1    2   16    9 o   79.916   2.3193  129.789   7.3431  124.943   9.1086  138.785   12.411   77.822   2.8378   82.009   3.6692 -4.187050 4.638523 
1 1 1    2   16   10 o  332.866   2.8433  2286.48   37.692  2285.57   47.484  2288.03   61.976  332.811   3.4592  332.920   4.5135 -0.1087952 5.686679 
1 1 1    2   16   11 o  200.740   2.3224  832.742   18.525  836.193   23.292  826.801   30.563  201.322   2.8051  200.157   3.7022 1.165588 4.644854 
1 1 1    2   16   12 o  388.702   3.6282  3104.52   52.025  3084.72   61.069  3156.92   99.345  386.589   3.8300  390.814   6.1633 -4.225586 7.256392 
1 1 1    2   16   13 o  114.362   2.8205  270.367   13.283  285.440   18.678  254.946   18.893  117.595   3.8511  111.128   4.1220 6.466324 5.641063 
1 1 1    2   16   14 o  246.799   2.8883  1257.40   29.395  1263.42   41.983  1251.61   41.172  247.377   4.1148  246.222   4.0542 1.154861 5.776505 
1 1 1    2   16   15 o  282.351   2.6339  1645.57   30.668  1657.41   43.802  1634.19   42.952  283.345   3.7482  281.357   3.7014 1.987579 5.267714 
1 1 1    2   16   16 o  235.577   2.8860  1140.64   27.931  1204.69   41.773  1088.85   37.564  241.521   4.1934  229.633   3.9662 11.88815 5.771946 
1 1 1    2   16   17 o  391.134   3.4299  3156.00   54.454  3196.17   85.155  3128.21   70.829  393.159   5.2514  389.108   4.4134 4.050171 6.859733 
1 1 1    2   16   18 o  249.755   2.8417  1287.06   28.865  1279.17   37.743  1298.16   44.800  248.871   3.6770  250.639   4.3338 -1.768234 5.683478 
1 1 1    2   16   19 o  111.066   3.0234  254.500   13.807  259.758   20.429  250.078   18.734  112.113   4.4181  110.019   4.1285 2.094086 6.046822 
1 1 1    2   16   20 o   59.516   4.9363   75.796   11.730   58.166   17.399   90.483   15.881   52.920   7.9716   66.113   5.8241 -13.19340 9.872531 
1 1 1    2   16   21 o  209.203   2.6086  903.106   22.485  925.392   32.699  883.118   30.967  211.642   3.7460  206.763   3.6313 4.879486 5.217195 
1 1 1    2   16   22 o  411.370   3.7940  3501.11   64.331  3557.15   92.923  3449.53   89.151  414.509   5.4353  408.231   5.2948 6.277802 7.588009 
1 1 1    2   16   23 o  241.703   3.0693  1206.78   30.570  1237.32   44.372  1179.19   42.177  244.601   4.3983  238.805   4.2822 5.796631 6.138587 
1 1 1    2   16   24 o  129.637   3.2469  345.289   17.190  364.171   26.505  331.580   22.584  132.651   4.8445  126.622   4.3244 6.029144 6.493778 
1 1 1    2   16   25 o  414.169   4.3305  3561.58   72.794  3574.51   94.959  3543.14  113.360  415.306   5.5437  413.031   6.6544 2.274719 8.661060 
1 1 1    2   16   26 o   65.263   5.3317   88.844   14.301   97.673   20.266   80.088   20.182   68.529   7.1701   61.998   7.8928 6.530571 10.66331 
1 1 1    2   16   27 o  194.845   3.5349  785.424   28.388  755.890   39.301  817.646   41.050  191.022   4.9883  198.668   5.0098 -7.646103 7.069788 
1 1 1    2   16   28 o   59.403   7.7446   86.611   17.008   46.409   28.153  109.717   21.343   46.221   13.751   72.585   7.1292 -26.36399 15.48924 
1 1 1    2   16   29 o  131.596   3.5697  359.148   19.358  339.124   27.146  379.864   27.612  127.849   5.1481  135.342   4.9465 -7.493034 7.139410 
1 1 1    2   16   30 o   57.217   7.4569   70.760   17.204   67.448   24.737   73.863   23.943   55.344   11.221   59.091   9.8240 -3.746429 14.91376 
1 1 1    2   16   31 o  144.057   3.6397  432.024   21.554  440.649   29.485  422.125   31.587  145.655   4.9081  142.460   5.3759 3.195679 7.279416 
1 1 1    2   16   32 o   57.011   7.4751   71.132   17.160   62.943   24.130   79.513   24.409   53.025   11.374   60.997   9.7024 -7.972202 14.95028 
1 1 1    2   16   33 o   31.913   9.1644   11.304   19.155   1.8668   28.504   19.076   25.867   29.871   12.840   33.955   13.080 -4.084242 18.32871 
1 1 1    2   16   34 o   39.356   9.4552   33.117   17.944   38.828   29.017   29.581   22.834   41.714   14.146   36.999   12.549 4.714382 18.91038 
1 1 1    2   16   35 o   45.295   10.995   39.104   23.293   72.886   43.472   25.500   27.588   54.238   17.263   36.351   13.622 17.88694 21.98967 
1 1 1    2   16   36 o   20.302   7.0150 -44.8965   18.024 -57.4336   22.906 -24.5133   29.207   16.441   8.2127   24.163   11.375 -7.721682 14.02992 
1 1 1    2   16   37 o   30.036   9.1497  -8.3847   23.323   26.732   31.747 -49.5587   34.376   36.894   14.413   23.179   11.276 13.71503 18.29945 
1 1 1    2   16   38 o   20.936   7.0775 -34.9413   18.134 -65.1140   27.581 -11.9655   24.068   18.229   9.0908   23.643   10.850 -5.414400 14.15509 
1 1 1    2   16   39 o   21.999   7.2580 -18.2920   16.352  -5.9175   23.815 -29.3298   22.492   24.574   11.086   19.425   9.3706 5.148773 14.51600 
1 1 1    2   16   40 o   66.247   9.3286  109.898   24.443  109.946   36.771  109.860   32.718   65.485   14.036   67.008   12.291 -1.522804 18.65721 
1 1 1    2   16   41 o   50.656   8.1635   63.305   16.676   63.833   23.558   62.775   23.609   50.911   11.492   50.402   11.598 0.5098763 16.32697 
1 1 1    2   16   42 o   39.971   8.8305   41.877   16.155   41.626   23.123   42.116   22.580   39.813   12.581   40.129   12.395 -0.3162689 17.66107 
1 1 1    2   16   43 o   30.610   9.0212   15.371   19.404   29.383   28.015   2.4510   26.901   34.460   13.517   26.761   11.950 7.699760 18.04233 
1 1 1    2   16   44 o   26.456   8.1046   7.0159   16.724   17.702   23.537  -3.8804   23.768   29.260   12.062   23.652   10.828 5.608282 16.20921 
1 1 1    2   16   45 o   31.085   8.1813   16.677   16.630 -11.6300   23.031   47.520   24.040   21.625   10.155   40.544   12.830 -18.91882 16.36254 
1 1 1    2   16   46 o   26.257   8.5014   2.9679   21.023  -8.2760   31.881   11.619   27.964   24.929   11.781   27.585   12.260 -2.655283 17.00276 
1 1 1    2   16   47 o   30.699   9.7007   18.744   26.245   48.495   37.805  -8.9326   36.463   35.879   15.077   25.520   12.211 10.35986 19.40150 
1 1 1    2   16   48 o   22.465   7.6235 -12.4709   20.463 -16.8743   29.803  -8.5431   28.147   22.134   10.704   22.795   10.858 -0.6612377 15.24703 
1 1 1    2   17    0 o  225.746   2.1655  1051.72   28.502  1051.72   28.502  1051.72   28.502  225.746   3.0624  225.746   3.0624 0.000000 0.000000 
1 1 1    2   17    1 o  792.824   5.6134 13021.14  178.695 13102.22  228.386 12893.13  286.950  796.261   6.9542  789.387   8.8135 6.873474 11.22674 
1 1 1    2   17    2 o  277.545   3.4291  1589.37   39.253  1589.37   39.253   0.0000   0.0000  277.545   3.4291  ?   ?       ?      ? 
1 1 1    2   17    3 o  259.962   3.0299  1389.80   31.741  1417.99   50.845  1371.80   40.630  262.092   4.7036  257.832   3.8207 4.260345 6.059831 
1 1 1    2   17    4 f  150.263   2.7337  464.324   16.313  460.002   20.426  471.934   27.107  149.315   3.3168  151.212   4.3464 -1.896774 5.467390 
1 1 1    2   17    5 o  365.322   3.7527  2762.88   55.589  2794.92   72.500  2717.16   86.593  367.945   4.7774  362.699   5.7885 5.245972 7.505382 
1 1 1    2   17    6 f  176.372   3.7971  641.491   25.362  640.111   30.342  644.692   46.205  176.107   4.1773  176.638   6.3421 -0.5314789 7.594235 
1 1 1    2   17    7 o  232.868   3.0322  1125.82   28.459  1151.29   36.776  1087.81   44.934  236.193   3.7751  229.543   4.7462 6.650909 6.064480 
1 1 1    2   17    8 o  222.383   2.8742  1021.00   24.262  1021.39   29.095  1020.11   43.959  222.490   3.1706  222.275   4.7950 0.2156067 5.748429 
1 1 1    2   17    9 o  200.678   2.3971  829.975   19.573  824.624   25.620  837.478   30.335  199.913   3.1072  201.443   3.6511 -1.530838 4.794280 
1 1 1    2   17   10 o  255.917   2.6124  1356.58   27.463  1422.49   37.788  1282.80   39.982  262.541   3.4898  249.294   3.8885 13.24660 5.224843 
1 1 1    2   17   11 o  440.586   3.4559  4000.72   60.513  3977.88   75.917  4040.52  100.214  438.953   4.1933  442.220   5.4945 -3.266998 6.911771 
1 1 1    2   17   12 o  277.432   3.0364  1598.00   32.896  1616.94   40.590  1561.75   56.154  279.898   3.5161  274.966   4.9515 4.931122 6.072894 
1 1 1    2   17   13 o  251.249   2.5439  1294.35   25.209  1273.86   31.241  1332.59   42.679  248.452   3.0487  254.046   4.0732 -5.594269 5.087769 
1 1 1    2   17   14 o  142.825   2.5838  416.542   15.043  393.101   19.602  450.122   23.462  137.999   3.4440  147.651   3.8526 -9.652252 5.167570 
1 1 1    2   17   15 o  204.747   2.7980  865.826   23.624  847.731   33.418  883.903   33.401  202.605   3.9991  206.889   3.9144 -4.283524 5.595977 
1 1 1    2   17   16 o  122.514   3.2566  309.950   16.418  306.286   22.412  314.193   24.119  121.741   4.4635  123.286   4.7434 -1.544510 6.513207 
1 1 1    2   17   17 f  134.105   2.6031  371.691   14.385  364.156   20.669  378.769   20.032  132.781   3.7742  135.430   3.5862 -2.648224 5.206293 
1 1 1    2   17   18 o  239.892   3.0170  1185.24   29.785  1246.15   43.937  1133.46   40.516  245.567   4.3380  234.217   4.1942 11.35080 6.034033 
1 1 1    2   17   19 o  285.007   2.9079  1680.62   33.934  1697.24   45.461  1659.71   50.996  286.635   3.8454  283.378   4.3632 3.256927 5.815881 
1 1 1    2   17   20 o  221.311   2.5653  1011.37   23.407  1026.55   33.661  997.150   32.570  222.916   3.6612  219.707   3.5942 3.208786 5.130545 
1 1 1    2   17   21 o   32.078   7.0081   18.939   11.535   2.3251   16.383   35.267   16.242   23.855   9.9679   40.301   9.8537 -16.44673 14.01620 
1 1 1    2   17   22 f   51.441   5.8081   57.085   11.762   45.727   17.124   67.232   16.185   45.984   9.3471   56.898   6.8968 -10.91348 11.61610 
1 1 1    2   17   23 o   95.588   3.5808  190.141   14.040  176.080   20.438  202.708   19.322   92.200   5.3744   98.975   4.7331 -6.775047 7.161501 
1 1 1    2   17   24 o   44.577   7.5950   43.713   13.829   38.154   20.315   48.514   18.878   41.895   11.437   47.260   9.9971 -5.364697 15.18996 
1 1 1    2   17   25 o  118.011   3.9527  288.381   19.211  294.162   28.048  283.272   26.367  119.111   5.7093  116.912   5.4681 2.199524 7.905484 
1 1 1    2   17   26 o   66.268   5.2994   91.249   14.457   99.520   20.986   83.779   19.944   69.130   7.3602   63.405   7.6264 5.724899 10.59881 
1 1 1    2   17   27 o  146.241   3.9631  443.640   23.891  442.159   33.218  445.227   34.386  146.002   5.5163  146.480   5.6917 -0.4781036 7.926187 
1 1 1    2   17   28 o  138.217   3.3344  395.879   19.007  400.865   27.085  391.042   26.679  139.073   4.7219  137.361   4.7092 1.712708 6.668770 
1 1 1    2   17   29 o   42.334   8.3809   39.477   15.270   35.279   21.865   43.473   21.335   40.333   12.146   44.334   11.551 -4.001637 16.76170 
1 1 1    2   17   30 o   99.534   4.6503  208.000   18.910  174.863   26.657  241.566   26.830   91.413   7.0704  107.654   6.0425 -16.24061 9.300666 
1 1 1    2   17   31 o   59.255   6.8631   76.269   16.228   64.217   22.834   88.570   23.068   53.850   10.658   64.660   8.6498 -10.80986 13.72629 
1 1 1    2   17   32 o   24.384   7.4694 -13.6798   15.686   13.777   22.210 -41.0087   22.158   30.699   12.038   18.069   8.8469 12.62920 14.93885 
1 1 1    2   17   33 o   64.288   8.5458   96.248   21.525   78.087   33.223  109.386   28.259   57.497   14.114   71.079   9.6392 -13.58247 17.09152 
1 1 1    2   17   34 o   26.198   8.2655  -7.7529   17.652 -14.0373   22.392   2.5629   28.689   22.600   10.406   29.797   12.845 -7.197189 16.53098 
1 1 1    2   17   35 o   76.597   6.0778  132.345   18.339  101.330   27.974  155.720   24.286   67.726   10.015   85.468   6.8895 -17.74203 12.15566 
1 1 1    2   17   36 f   25.833   8.3592  -9.9141   19.000  -6.1799   23.038 -17.8552   33.596   24.426   10.972   27.239   12.614 -2.813408 16.71850 
1 1 1    2   17   37 o   51.867   8.1703   63.882   17.101   53.258   24.080   74.691   24.290   47.008   12.284   56.725   10.776 -9.716770 16.34052 
1 1 1    2   17   38 o   24.349   7.7475  -5.6814   16.327  -5.0652   23.029  -6.3041   23.151   24.463   10.981   24.235   10.933 0.2273712 15.49509 
1 1 1    2   17   39 o   62.152   6.9176   88.930   17.169   78.198   24.553   99.200   24.018   57.558   10.738   66.747   8.7244 -9.188892 13.83516 
1 1 1    2   17   40 o   55.079   8.7955   77.753   20.319   52.215   29.624  100.444   27.924   44.405   14.263   65.753   10.297 -21.34753 17.59095 
1 1 1    2   17   41 o   42.755   9.3651   49.508   18.414   41.070   29.865   54.684   23.389   39.366   14.272   46.145   12.130 -6.778656 18.73014 
1 1 1    2   17   42 o   24.090   7.8608 -14.9087   19.057 -37.1621   27.111   6.8249   26.793   20.279   9.8980   27.900   12.215 -7.621061 15.72167 
1 1 1    2   17   43 o   37.516   11.069   36.931   25.584   29.757   29.578   58.244   50.984   34.044   13.711   40.988   17.381 -6.944588 22.13771 
1 1 1    2   17   44 o   24.066   7.8885  -9.1235   18.393 -19.2774   24.090   5.0720   28.483   20.917   9.9859   27.216   12.215 -6.298416 15.77704 
1 1 1    2   17   45 o   26.657   8.1809   8.6436   17.292   22.174   24.343  -5.1387   24.569   30.083   12.319   23.232   10.769 6.850725 16.36176 
1 1 1    2   17   46 f   32.738   9.6820   31.604   22.038   24.813   31.226   38.344   31.108   30.954   13.372   34.521   14.005 -3.566853 19.36402 
1 1 1    2   17   47 o   34.313   9.7190   41.461   20.983   37.126   29.962   45.633   29.394   32.980   13.604   35.645   13.884 -2.665024 19.43805 
1 1 1    2   18    0 o   67.132   2.0385   93.471   7.9487   93.471   7.9487   93.471   7.9487   67.132   2.8829   67.132   2.8829 0.000000 0.000000 
1 1 1    2   18    1 o  185.681   2.2170  713.953   16.858  735.430   22.729  687.692   25.133  188.803   2.9188  182.560   3.3378 6.242783 4.434009 
1 1 1    2   18    2 o  317.394   3.2491  2058.23   39.525  2022.58   47.569  2137.71   71.032  313.064   3.6841  321.725   5.3531 -8.660919 6.498280 
1 1 1    2   18    3 o  122.450   2.7486  306.204   13.321  298.253   16.542  320.871   22.467  120.226   3.3359  124.675   4.3692 -4.449112 5.497130 
1 1 1    2   18    4 o  140.864   2.7740  410.492   15.531  413.129   19.546  405.975   25.582  141.495   3.3493  140.233   4.4230 1.262238 5.548018 
1 1 1    2   18    5 o  105.177   2.9786  240.142   11.079  252.668   12.917  205.266   21.554  110.664   2.8299   99.690   5.2421 10.97433 5.957158 
1 1 1    2   18    6 o  354.380   5.8142  2600.05   84.971  2609.01  121.257  2591.40  119.105  354.970   8.2823  353.790   8.1624 1.180084 11.62845 
1 1 1    2   18    7 o  213.536   3.3413  941.600   29.427  940.245   41.525  942.966   41.707  213.382   4.7183  213.689   4.7322 -0.3077087 6.682551 
1 1 1    2   18    8 o  362.326   3.7859  2722.32   55.705  2772.83   73.043  2652.12   86.119  366.417   4.8332  358.234   5.8286 8.183746 7.571827 
1 1 1    2   18    9 o  139.218   2.9350  402.707   14.723  405.457   17.107  394.854   28.910  140.178   2.9589  138.257   5.0698 1.921158 5.870078 
1 1 1    2   18   10 o  139.877   3.1547  400.880   17.390  393.543   21.517  414.697   29.527  138.074   3.7784  141.680   5.0530 -3.606583 6.309456 
1 1 1    2   18   11 o  243.501   2.4641  1227.12   23.888  1236.45   30.142  1211.38   39.171  244.778   2.9857  242.225   3.9208 2.553329 4.928198 
1 1 1    2   18   12 o  166.773   2.5976  571.894   16.662  567.869   20.163  580.560   29.585  165.884   2.9470  167.662   4.2783 -1.778137 5.195112 
1 1 1    2   18   13 o  126.470   2.3884  329.672   11.877  328.510   14.708  331.849   20.134  126.169   2.8264  126.770   3.8508 -0.6011658 4.776711 
1 1 1    2   18   14 o  292.322   2.8596  1766.23   34.138  1772.79   45.265  1757.56   51.987  292.987   3.7458  291.656   4.3218 1.330811 5.719156 
1 1 1    2   18   15 f  190.478   3.1235  754.192   24.027  727.531   37.695  772.434   31.182  187.582   4.8722  193.374   3.9096 -5.791840 6.246919 
1 1 1    2   18   16 o  171.905   2.7411  609.766   17.482  608.934   20.620  611.894   32.965  171.758   2.9108  172.052   4.6455 -0.2940674 5.482118 
1 1 1    2   18   17 o   34.556   6.4753   25.877   9.6114   18.048   13.898   33.053   13.307   29.978   9.7810   39.134   8.4884 -9.156229 12.95068 
1 1 1    2   18   18 o  233.980   2.7924  1126.79   26.393  1152.71   42.003  1109.88   33.928  236.151   4.3125  231.809   3.5486 4.342102 5.584832 
1 1 1    2   18   19 o   80.814   4.1718  137.722   13.420  145.611   17.175  125.357   21.502   83.893   4.9638   77.736   6.7064 6.157082 8.343512 
1 1 1    2   18   20 o  253.866   2.6204  1331.55   27.437  1318.03   38.720  1345.19   38.883  252.570   3.7169  255.163   3.6947 -2.592621 5.240829 
1 1 1    2   18   21 o  126.713   3.1206  331.674   16.290  340.104   23.727  324.157   22.404  128.228   4.4863  125.198   4.3387 3.030251 6.241126 
1 1 1    2   18   22 o  109.707   3.1845  248.891   14.385  250.397   20.991  247.556   19.752  110.010   4.6263  109.403   4.3774 0.6071091 6.368992 
1 1 1    2   18   23 o  118.600   3.1209  290.828   15.244  293.849   22.223  288.143   20.949  119.172   4.5213  118.028   4.3033 1.144325 6.241865 
1 1 1    2   18   24 o   27.080   7.9206   3.1241   14.093   11.124   23.059  -1.6459   17.806   30.749   12.199   23.412   10.106 7.336720 15.84122 
1 1 1    2   18   25 o  108.997   3.5750  246.226   16.058  243.831   23.126  248.455   22.314  108.474   5.1691  109.521   4.9399 -1.046669 7.149994 
1 1 1    2   18   26 o   71.272   5.0806  107.863   14.599   84.131   21.047  129.867   20.267   63.480   8.0389   79.064   6.2149 -15.58413 10.16114 
1 1 1    2   18   27 o  163.701   3.0813  551.992   20.748  604.636   30.650  507.468   28.188  170.868   4.3492  156.534   4.3660 14.33318 6.162589 
1 1 1    2   18   28 o  200.946   3.2944  832.663   26.802  813.436   34.554  861.698   42.463  198.150   4.2281  203.743   5.0532 -5.593216 6.588708 
1 1 1    2   18   29 o   92.220   4.4194  177.191   16.748  198.662   24.153  157.306   23.244   97.636   5.9978   86.804   6.4923 10.83283 8.838799 
1 1 1    2   18   30 o  130.615   3.6026  355.043   19.407  351.508   27.481  358.560   27.409  129.958   5.1271  131.271   5.0624 -1.312286 7.205211 
1 1 1    2   18   31 o   48.617   8.2872   58.007   17.970   79.970   22.750   21.578   29.300   61.201   9.0129   36.034   13.910 25.16713 16.57436 
1 1 1    2   18   32 o  101.762   5.3894  205.574   20.983  259.653   39.233  183.908   24.833  110.093   8.6402   93.431   6.4442 16.66131 10.77873 
1 1 1    2   18   33 o   46.735   8.3747   48.963   17.110   76.092   25.358   26.289   23.183   57.901   11.021   35.570   12.612 22.33127 16.74940 
1 1 1    2   18   34 o   59.614   6.7576   78.088   15.934   99.719   23.560   59.852   21.632   67.990   8.4016   51.237   10.587 16.75301 13.51529 
1 1 1    2   18   35 o   51.319   7.7631   61.564   15.942   55.979   22.745   66.956   22.351   48.702   11.506   53.936   10.424 -5.234215 15.52626 
1 1 1    2   18   36 o   36.238   9.2485   23.585   19.595  -0.2614   27.297   48.938   28.146   27.872   12.262   44.604   13.848 -16.73285 18.49704 
1 1 1    2   18   37 o   65.950   6.9441   99.757   17.934   76.880   25.530  122.047   25.199   57.180   11.226   74.720   8.1769 -17.53925 13.88813 
1 1 1    2   18   38 o   73.510   5.6831  118.862   17.227  119.936   24.638  117.835   24.098   73.802   8.0940   73.218   7.9799 0.5843506 11.36626 
1 1 1    2   18   39 o   25.896   7.9974   1.9564   16.199  -1.4916   22.962   5.3728   22.857   24.998   11.110   26.793   11.507 -1.794514 15.99476 
1 1 1    2   18   40 o   18.411   6.3371 -32.0628   15.425 -34.4069   21.877 -29.7456   21.752   18.120   8.8543   18.702   9.0685 -0.5825176 12.67419 
1 1 1    2   18   41 o   34.547   8.6341   26.186   17.421   2.0145   24.921   49.287   24.363   26.136   11.597   42.958   12.795 -16.82279 17.26825 
1 1 1    2   18   42 o   63.526   6.2569   94.549   16.309   87.036   23.451  101.586   22.696   60.613   9.3807   66.439   8.2824 -5.826225 12.51381 
1 1 1    2   18   43 o   34.054   8.6004   15.806   17.873   65.745   29.238 -13.9907   22.585   46.982   14.022   21.126   9.9626 25.85596 17.20078 
1 1 1    2   18   44 o   27.538   8.2446   13.718   16.185   12.393   22.644   15.102   23.143   27.070   11.534   28.006   11.784 -0.9354095 16.48925 
1 1 1    2   18   45 f   31.770   8.4291   22.973   18.864 -20.2915   30.065   51.062   24.225   22.608   10.888   40.931   12.870 -18.32231 16.85812 
1 1 1    2   18   46 o   23.139   7.8128 -12.0427   20.893 -15.3484   30.228  -9.0191   28.909   22.886   10.995   23.392   11.102 -0.5054455 15.62554 
1 1 1    2   18   47 o   28.351   8.7972   10.573   21.189   48.050   31.802 -19.3418   28.414   35.354   14.225   21.349   10.355 14.00546 17.59436 
1 1 1    2   19    0 o  525.703   3.7911  5706.09  116.221  5706.09  116.221  5706.09  116.221  525.703   5.3614  525.703   5.3614 0.000000 0.000000 
1 1 1    2   19    1 o  202.871   2.3120  845.672   19.061  828.738   24.797  870.130   29.801  200.410   3.0000  205.332   3.5189 -4.922180 4.624093 
1 1 1    2   19    2 o  323.371   3.4058  2161.19   44.572  2168.08   57.767  2151.06   70.068  324.054   4.3221  322.688   5.2647 1.365936 6.811582 
1 1 1    2   19    3 o  110.892   2.4044  253.797   10.992  253.093   15.763  254.464   15.336  110.741   3.4512  111.043   3.3486 -0.3020401 4.808750 
1 1 1    2   19    4 o   96.083   3.2310  198.844   11.873  215.496   14.675  167.286   20.202  102.184   3.4820   89.981   5.4436 12.20314 6.462003 
1 1 1    2   19    5 o   59.454   7.6840   98.341   15.984   30.275   29.289  127.210   19.075   40.457   14.192   78.451   5.8952 -37.99424 15.36809 
1 1 1    2   19    6 o  198.007   4.0581  796.198   30.845  772.816   37.075  848.774   55.595  193.443   4.6469  202.571   6.6542 -9.128128 8.116133 
1 1 1    2   19    7 o   37.848   7.3672   28.147   12.893   11.034   17.412   48.918   19.183   28.052   10.750   47.645   10.077 -19.59286 14.73449 
1 1 1    2   19    8 o  106.770   3.9697  235.666   17.480  238.440   24.706  232.885   24.736  107.401   5.5773  106.139   5.6505 1.261765 7.939360 
1 1 1    2   19    9 o  195.593   3.0548  786.703   23.621  778.297   29.393  802.030   39.690  194.165   3.6703  197.021   4.8843 -2.856339 6.109600 
1 1 1    2   19   10 o  311.751   3.3471  1991.67   39.533  1967.12   47.196  2049.39   72.377  308.672   3.7072  314.830   5.5739 -6.158600 6.694113 
1 1 1    2   19   11 o  277.040   3.0209  1595.97   33.009  1622.29   41.241  1549.06   55.062  280.311   3.5672  273.770   4.8764 6.540161 6.041856 
1 1 1    2   19   12 o  292.771   2.7818  1771.17   33.054  1774.19   43.091  1766.84   51.523  293.118   3.5643  292.425   4.2719 0.6928406 5.563596 
1 1 1    2   19   13 o  140.945   2.2999  408.115   12.744  403.517   15.750  416.832   21.687  139.825   2.7311  142.064   3.7013 -2.239578 4.599856 
1 1 1    2   19   14 o   37.867   5.1968   33.058   7.8220   15.217   11.557   48.137   10.625   27.494   8.9168   48.239   5.3404 -20.74509 10.39370 
1 1 1    2   19   15 o   24.517   6.2893   10.332   8.1286   9.0507   12.813   11.195   10.516   24.525   9.2636   24.508   8.5092 0.1641655E-01 12.57858 
1 1 1    2   19   16 o   79.825   3.0232  135.067   9.5318  145.090   12.137  118.938   15.397   83.817   3.5110   75.834   4.9227 7.982635 6.046480 
1 1 1    2   19   17 o  113.300   2.5602  260.366   11.364  250.399   13.907  280.397   19.716  110.124   3.0619  116.477   4.1040 -6.353050 5.120314 
1 1 1    2   19   18 o  201.536   2.6685  833.042   21.857  804.884   28.360  874.232   34.301  197.401   3.4834  205.671   4.0436 -8.270660 5.337094 
1 1 1    2   19   19 o   60.705   7.1788   83.223   16.428   96.826   21.016   61.852   26.342   68.247   7.4662   53.164   12.264 15.08387 14.35758 
1 1 1    2   19   20 o  132.041   2.7497  360.647   14.962  350.943   21.409  369.912   20.918  130.296   3.9839  133.786   3.7909 -3.490128 5.499312 
1 1 1    2   19   21 o  236.598   3.5409  1158.85   34.552  1147.10   48.630  1170.84   49.102  235.386   5.0091  237.810   5.0062 -2.423691 7.081843 
1 1 1    2   19   22 o   95.514   3.4359  186.771   13.459  210.725   20.365  168.196   17.933  100.889   4.8942   90.140   4.8237 10.74900 6.871809 
1 1 1    2   19   23 o   73.502   4.3367  111.094   13.076  128.387   19.499   96.962   17.627   78.662   6.0100   68.343   6.2536 10.31858 8.673371 
1 1 1    2   19   24 o   33.566   8.2847   18.223   14.713   33.972   22.372   6.2203   19.531   39.998   12.335   27.134   11.064 12.86360 16.56941 
1 1 1    2   19   25 o  168.941   3.2690  591.463   22.755  561.391   32.209  621.429   32.152  164.633   4.7435  173.250   4.4995 -8.617615 6.538037 
1 1 1    2   19   26 o   49.052   7.2181   52.588   14.108   52.311   20.554   52.835   19.401   48.866   10.510   49.238   9.8966 -0.3728218 14.43624 
1 1 1    2   19   27 o  149.797   3.1567  464.776   19.495  478.608   28.060  451.868   27.106  151.948   4.4774  147.647   4.4512 4.301117 6.313481 
1 1 1    2   19   28 o  130.652   4.2963  355.444   23.105  325.452   32.136  387.540   33.244  124.914   6.2375  136.389   5.9097 -11.47429 8.592543 
1 1 1    2   19   29 o   40.422   9.1545   37.132   19.032  -4.2784   37.316   51.691   22.127   32.750   14.375   48.093   11.340 -15.34334 18.30894 
1 1 1    2   19   30 o   22.931   7.3443 -11.4319   15.125 -19.0807   21.285  -3.6296   21.497   21.059   9.8487   24.802   10.898 -3.742989 14.68867 
1 1 1    2   19   31 o   38.814   8.0824   32.891   15.219   12.277   22.116   51.432   20.975   29.976   11.930   47.653   10.908 -17.67720 16.16474 
1 1 1    2   19   32 o   52.889   8.8766   63.902   19.086   80.199   29.011   51.465   25.343   58.863   12.344   46.914   12.760 11.94908 17.75321 
1 1 1    2   19   33 o   46.565   8.3090   50.284   15.956   52.491   22.899   48.201   22.245   47.560   11.744   45.569   11.757 1.990425 16.61803 
1 1 1    2   19   34 o   81.692   4.9502  142.715   16.656  153.077   24.185  133.365   22.974   84.534   6.9365   78.849   7.0643 5.684769 9.900438 
1 1 1    2   19   35 f   26.314   7.8967   3.9563   15.124  -3.2703   22.089   10.334   20.752   24.594   10.915   28.035   11.414 -3.441175 15.79331 
1 1 1    2   19   36 o   35.823   8.1812   26.827   17.037 -11.2312   27.514   50.495   21.698   25.546   11.678   46.100   11.461 -20.55340 16.36234 
1 1 1    2   19   37 o   40.208   8.7307   39.613   15.877   38.594   22.699   40.589   22.216   39.721   12.453   40.694   12.240 -0.9728928 17.46149 
1 1 1    2   19   38 o   45.409   8.4877   50.962   16.430   63.708   23.609   38.990   22.881   51.168   11.470   39.651   12.514 11.51688 16.97533 
1 1 1    2   19   39 o   25.719   8.1095 -11.7268   18.411   17.067   27.746 -34.3806   24.610   31.737   13.091   19.702   9.5745 12.03474 16.21903 
1 1 1    2   19   40 o   46.264   8.2929   54.987   15.966   47.072   22.758   62.657   22.404   42.452   12.292   50.077   11.135 -7.624729 16.58572 
1 1 1    2   19   41 o   77.005   5.7893  135.939   18.283  123.691   26.241  147.496   25.489   73.139   8.6988   80.872   7.6417 -7.733093 11.57867 
1 1 1    2   19   42 o   38.981   8.6721   42.035   15.554   42.533   22.043   41.542   21.951   39.203   12.269   38.760   12.259 0.4432983 17.34416 
1 1 1    2   19   43 o   43.871   8.6166   53.573   16.388   44.159   23.171   62.997   23.183   39.428   12.609   48.314   11.748 -8.886292 17.23316 
1 1 1    2   19   44 o   42.407   12.959   54.399   24.758   54.399   24.758   0.0000   0.0000   42.407   12.959  ?   ?       ?      ? 
1 1 1    2   19   45 o   36.017   9.9039   43.265   21.617   31.904   30.921   54.127   30.234   32.524   13.649   39.510   14.354 -6.985626 19.80779 
1 1 1    2   19   46 o   21.900   7.4781 -16.9333   20.354 -16.5370   29.569 -17.2903   28.061   22.193   10.716   21.606   10.434 0.5868969 14.95612 
1 1 1    2   20    0 o   69.876   2.0912  101.265   8.4887  101.265   8.4887  101.265   8.4887   69.876   2.9574   69.876   2.9574 0.000000 0.000000 
1 1 1    2   20    1 o   56.890   2.2306   66.878   5.1720   67.361   6.8242   66.228   7.9281   57.134   2.8959   56.645   3.3934 0.4890823 4.461123 
1 1 1    2   20    2 o  183.789   2.3714  697.418   17.970  710.313   25.244  684.171   25.586  185.514   3.2992  182.064   3.4073 3.450775 4.742851 
1 1 1    2   20    3 o   83.229   2.5381  142.371   8.6845  150.490   12.926  135.692   11.725   85.381   3.6708   81.078   3.5062 4.302673 5.076212 
1 1 1    2   20    4 o  468.762   4.4965  4558.81   85.789  4628.27  113.025  4464.39  131.770  473.114   5.7922  464.410   6.8794 8.703461 8.993065 
1 1 1    2   20    5 o  444.758   5.9961  4033.24  100.052  4271.03  187.486  3938.56  118.307  453.256   10.029  436.259   6.5750 16.99683 11.99218 
1 1 1    2   20    6 o  285.018   4.5179  1671.31   49.511  1654.58   59.864  1707.53   88.079  282.945   5.1297  287.092   7.4385 -4.147125 9.035819 
1 1 1    2   20    7 o   51.946   6.2771   56.861   13.161   56.781   18.200   56.947   19.053   52.310   8.4356   51.582   9.2978 0.7284203 12.55427 
1 1 1    2   20    8 o   46.377   7.3049   47.202   13.655   55.387   18.721   37.898   19.961   50.843   9.2692   41.911   11.293 8.932262 14.60977 
1 1 1    2   20    9 o   95.809   4.1878  189.623   16.524  175.593   22.870  204.947   23.900   92.102   6.0204   99.515   5.8230 -7.413101 8.375689 
1 1 1    2   20   10 o  207.230   3.0788  884.818   25.349  877.749   31.770  897.201   42.050  206.151   3.7365  208.309   4.8944 -2.157867 6.157643 
1 1 1    2   20   11 o  146.080   3.7913  429.665   17.288  423.608   18.951  459.697   42.200  143.242   3.2078  148.918   6.8707 -5.676682 7.582619 
1 1 1    2   20   12 o  204.189   2.4705  860.953   20.520  860.938   26.885  860.973   31.760  204.210   3.1920  204.169   3.7716 0.4083252E-01 4.941022 
1 1 1    2   20   13 o  182.937   2.3125  686.677   16.604  677.243   20.471  704.820   28.388  181.144   2.7400  184.730   3.7259 -3.586090 4.624921 
1 1 1    2   20   14 o  200.743   2.7426  832.075   22.701  808.872   31.695  856.517   32.529  197.870   3.8837  203.616   3.8735 -5.745132 5.485122 
1 1 1    2   20   15 o  132.180   2.9541  353.387   15.821  322.757   20.227  401.659   25.392  124.978   3.9239  139.383   4.4170 -14.40450 5.908242 
1 1 1    2   20   16 o  169.253   2.5046  594.750   17.245  611.303   22.770  572.485   26.408  172.054   3.2087  166.452   3.8466 5.601730 5.009241 
1 1 1    2   20   17 o  255.446   2.7281  1346.30   28.281  1336.53   36.777  1360.43   44.238  254.360   3.5056  256.531   4.1811 -2.171173 5.456275 
1 1 1    2   20   18 o  149.680   2.6140  462.767   15.829  461.938   20.475  463.997   24.956  149.543   3.3196  149.816   4.0387 -0.2735748 5.227937 
1 1 1    2   20   19 o   48.867   4.2585   43.395   8.0215   29.530   9.6386   74.635   14.468   37.730   6.1937   60.003   5.8462 -22.27249 8.517082 
1 1 1    2   20   20 o  222.404   4.1486  1009.74   30.091  999.794   33.446  1051.97   68.936  219.945   3.6869  224.863   7.4330 -4.917999 8.297109 
1 1 1    2   20   21 o   87.160   3.5612  157.200   12.773  159.029   18.749  155.617   17.450   87.622   5.1880   86.699   4.8799 0.9230347 7.122375 
1 1 1    2   20   22 o  190.796   3.0222  758.064   23.319  779.932   30.392  726.761   36.362  194.229   3.7939  187.364   4.7055 6.864517 6.044397 
1 1 1    2   20   23 o  259.928   3.1480  1398.14   33.745  1376.52   47.362  1420.43   48.092  257.888   4.4528  261.969   4.4510 -4.081085 6.295932 
1 1 1    2   20   24 o   66.458   5.3025   92.377   14.485   96.370   19.968   87.943   21.043   68.015   7.1183   64.902   7.8610 3.113235 10.60499 
1 1 1    2   20   25 o  106.995   5.6871  239.672   24.976  209.799   34.804  271.388   35.862  100.041   8.4350  113.950   7.6305 -13.90854 11.37428 
1 1 1    2   20   26 f  128.012   3.6088  340.199   18.814  340.728   29.000  339.814   24.723  128.029   5.4919  127.996   4.6833 0.3339386E-01 7.217621 
1 1 1    2   20   27 o   30.610   7.7909   10.635   14.467 -10.7810   20.318   32.655   20.603   22.404   10.161   38.815   11.813 -16.41097 15.58183 
1 1 1    2   20   28 o   93.848   4.6989  181.983   17.668  194.769   29.028  174.458   22.269   96.280   7.3099   91.416   5.9062 4.864197 9.397731 
1 1 1    2   20   29 o   90.123   5.9053  176.633   20.702  186.369   25.811  159.075   34.662   94.171   6.6455   86.075   9.7635 8.096481 11.81056 
1 1 1    2   20   30 o   83.609   4.6237  146.609   15.862  168.851   23.226  127.166   21.716   89.592   6.2856   77.625   6.7827 11.96705 9.247314 
1 1 1    2   20   31 o   83.493   4.7128  148.128   16.158  136.571   23.279  158.873   22.445   80.215   7.0362   86.771   6.2717 -6.555527 9.425672 
1 1 1    2   20   32 o   88.497   4.8772  164.475   17.702  144.439   23.740  189.565   26.566   82.461   6.9801   94.533   6.8136 -12.07191 9.754302 
1 1 1    2   20   33 o   25.634   7.5285   1.1069   14.119   17.635   20.172 -14.7672   19.769   30.686   11.616   20.582   9.5808 10.10325 15.05701 
1 1 1    2   20   34 o   42.398   8.2320   42.871   16.052   21.483   23.227   62.423   22.208   33.005   12.471   51.790   10.749 -18.78530 16.46404 
1 1 1    2   20   35 o   36.140   8.4338   29.399   15.106   18.824   21.559   39.599   21.173   31.480   11.986   40.800   11.868 -9.320238 16.86759 
1 1 1    2   20   36 o   71.159   6.2092  112.547   18.211  115.279   26.355  110.051   25.192   71.923   8.8844   70.395   8.6766 1.528137 12.41842 
1 1 1    2   20   37 o   38.229   8.8866   25.705   18.451  -0.9911   23.755   66.305   29.295   25.638   11.352   50.820   13.676 -25.18233 17.77313 
1 1 1    2   20   38 o   73.902   5.5513  120.612   16.822  138.879   24.454  104.204   23.176   79.444   7.4632   68.359   8.2200 11.08466 11.10261 
1 1 1    2   20   39 o   69.215   6.7355  109.697   17.948   74.226   23.795  156.508   27.336   54.963   10.882   83.467   7.9405 -28.50485 13.47096 
1 1 1    2   20   40 o   43.874   8.2507   49.899   15.235   54.048   21.448   45.674   21.645   45.979   11.373   41.770   11.956 4.209515 16.50149 
1 1 1    2   20   41 o   20.893   6.8937 -10.6683   14.626 -12.6814   20.713  -8.6664   20.655   20.497   9.6271   21.288   9.8697 -0.7907028 13.78737 
1 1 1    2   20   42 o   34.015   8.3583   30.309   14.749   21.015   20.673   39.943   21.048   29.878   11.642   38.153   11.997 -8.275171 16.71668 
1 1 1    2   20   43 o   19.593   6.6492 -19.7184   15.587 -14.6704   21.907 -24.8948   22.183   20.341   9.6575   18.845   9.1422 1.496666 13.29835 
1 1 1    2   20   44 o   30.875   9.3784   23.981   21.703   15.788   30.988   31.869   30.407   28.942   12.882   32.809   13.633 -3.866816 18.75688 
1 1 1    2   20   45 o   31.092   9.2664   27.869   20.673   42.658   30.132   14.717   28.415   34.745   13.893   27.439   12.265 7.306669 18.53273 
1 1 1    2   20   46 o   29.627   9.1508   25.930   21.125   27.325   30.843   24.697   28.994   29.968   13.113   29.287   12.767 0.6810341 18.30166 
1 1 1    2   21    0 o  190.652   2.4147  750.716   26.833  750.716   26.833  750.716   26.833  190.652   3.4149  190.652   3.4149 0.000000 0.000000 
1 1 1    2   21    1 o  408.059   3.3424  3444.03   55.802  3464.56   74.476  3417.75   84.257  409.502   4.4095  406.615   5.0241 2.887238 6.684734 
1 1 1    2   21    2 o  295.863   3.2683  1798.27   38.776  1853.77   63.099  1764.58   49.153  299.443   5.1091  292.284   4.0774 7.158905 6.536647 
1 1 1    2   21    3 o  237.262   2.6360  1161.12   25.773  1194.28   37.398  1131.12   35.567  240.480   3.7706  234.043   3.6846 6.437759 5.271941 
1 1 1    2   21    4 o  124.595   3.2152  321.029   16.509  327.225   23.026  314.475   23.683  125.840   4.4364  123.351   4.6550 2.488625 6.430442 
1 1 1    2   21    5 o  140.526   4.2179  401.144   22.528  428.424   41.360  389.637   26.862  143.761   6.9755  137.290   4.7438 6.470901 8.435724 
1 1 1    2   21    6 o  170.344   3.2556  599.792   22.870  599.954   32.098  599.626   32.595  170.371   4.5679  170.318   4.6400 0.5279541E-01 6.511226 
1 1 1    2   21    7 o  175.842   3.3123  639.170   24.019  638.462   33.664  639.905   34.280  175.746   4.6442  175.937   4.7240 -0.1912537 6.624591 
1 1 1    2   21    8 o  335.302   4.0312  2326.54   55.746  2343.62   79.374  2309.92   78.309  336.512   5.7189  334.091   5.6831 2.421051 8.062428 
1 1 1    2   21    9 o  308.838   3.8614  1973.34   49.185  1978.82   69.722  1967.92   69.396  309.263   5.4661  308.412   5.4555 0.8505554 7.722778 
1 1 1    2   21   10 o  105.212   4.0551  229.330   17.572  243.117   24.833  215.504   24.868  108.394   5.5548  102.030   5.9094 6.363777 8.110272 
1 1 1    2   21   11 o  245.833   4.9621  1252.14   50.258  1229.78   69.240  1277.05   73.064  243.539   6.8932  248.127   7.1395 -4.588303 9.924103 
1 1 1    2   21   12 o  103.773   3.5870  214.751   13.867  204.817   16.235  241.541   26.661   99.562   3.9537  107.984   5.9862 -8.422302 7.173983 
1 1 1    2   21   13 o   99.123   2.4462  203.145   9.8040  203.982   12.684  201.905   15.452   99.393   3.0942   98.854   3.7898 0.5384750 4.892491 
1 1 1    2   21   14 o  104.638   2.6339  225.216   11.289  218.206   15.006  234.356   17.135  102.779   3.5399  106.496   3.9010 -3.716698 5.267704 
1 1 1    2   21   15 o   64.006   3.5303   82.737   9.0895   60.256   11.961  113.460   13.983   53.946   5.3759   74.066   4.5774 -20.12013 7.060692 
1 1 1    2   21   16 o   95.125   3.1626  187.835   12.351  178.668   18.084  195.851   16.910   92.926   4.7184   97.324   4.2126 -4.398453 6.325273 
1 1 1    2   21   17 o   73.220   3.1304  113.520   9.0698  121.516   11.563  100.734   14.622   76.685   3.6559   69.754   5.0825 6.930252 6.260745 
1 1 1    2   21   18 o  182.595   2.8741  689.560   21.633  662.448   30.558  716.800   30.630  178.987   4.1393  186.203   3.9884 -7.216003 5.748157 
1 1 1    2   21   19 o  111.232   2.7697  259.071   12.051  266.596   14.966  245.200   20.320  113.605   3.1942  108.860   4.5257 4.745338 5.539396 
1 1 1    2   21   20 o  184.327   4.2423  704.741   25.622  704.633   28.590  705.183   57.751  184.629   3.7544  184.025   7.6088 0.6032104 8.484673 
1 1 1    2   21   21 o  101.295   3.4668  211.486   14.428  201.448   19.409  223.886   21.572   98.633   4.7710  103.957   5.0312 -5.324226 6.933638 
1 1 1    2   21   22 f  140.115   4.1280  407.626   23.379  408.342   30.218  406.559   36.901  140.358   5.2199  139.872   6.3965 0.4854279 8.256009 
1 1 1    2   21   23 o  149.060   3.6935  468.404   22.236  416.359   33.945  507.522   29.429  141.586   5.8129  156.533   4.5583 -14.94760 7.386983 
1 1 1    2   21   24 o  127.587   3.1717  334.782   16.614  382.774   24.633  294.729   22.503  135.925   4.3938  119.249   4.5754 16.67603 6.343474 
1 1 1    2   21   25 o   50.592   6.5928   53.291   13.204   79.909   20.458   34.286   17.287   61.703   8.0387   39.482   10.452 22.22099 13.18560 
1 1 1    2   21   26 o  114.381   3.7379  270.276   17.421  283.164   27.070  261.164   22.761  116.631   5.6273  112.132   4.9214 4.499252 7.475769 
1 1 1    2   21   27 o   77.384   4.6350  125.592   14.749  123.260   21.588  127.634   20.199   76.658   6.8278   78.109   6.2700 -1.451263 9.269936 
1 1 1    2   21   28 o   30.840   7.9049   14.537   14.027   29.912   20.000  -0.3491   19.679   37.031   11.701   24.650   10.632 12.38102 15.80971 
1 1 1    2   21   29 o   65.724   7.1671   93.767   19.414   93.250   26.915   94.328   28.028   65.595   9.9486   65.852   10.320 -0.2569885 14.33418 
1 1 1    2   21   30 f   23.590   7.3194  -3.3611   13.693   2.4385   20.316  -8.1895   18.537   25.645   10.926   21.536   9.7423 4.108938 14.63877 
1 1 1    2   21   31 o   92.355   5.0497  182.136   19.137  172.352   28.009  190.702   26.208   89.851   7.5581   94.860   6.6986 -5.009041 10.09933 
1 1 1    2   21   32 o   45.197   7.8918   47.944   14.641   51.154   20.753   44.763   20.658   46.799   10.947   43.595   11.371 3.203770 15.78368 
1 1 1    2   21   33 o   42.896   7.7329   43.188   14.762   21.679   20.804   65.002   20.951   32.467   11.890   53.325   9.8900 -20.85820 15.46579 
1 1 1    2   21   34 o   24.337   7.6537  -5.6100   15.775 -15.7795   22.476   4.2624   22.146   21.967   10.222   26.707   11.394 -4.739529 15.30731 
1 1 1    2   21   35 o   31.648   7.1683   10.044   14.574 -27.7918   20.569   48.186   20.652   18.516   8.9394   44.780   11.208 -26.26427 14.33660 
1 1 1    2   21   36 f   93.298   4.9268  188.961   18.934  182.171   27.109  195.428   26.456   91.517   7.1820   95.079   6.7464 -3.562080 9.853674 
1 1 1    2   21   37 o   78.482   6.8112  141.172   21.895  161.052   31.343  122.225   30.598   84.376   9.0063   72.588   10.220 11.78862 13.62234 
1 1 1    2   21   38 o   50.132   9.1821   66.581   19.273   58.198   28.308   73.824   26.313   46.371   13.787   53.894   12.130 -7.522194 18.36416 
1 1 1    2   21   39 o   79.898   5.1859  142.957   17.020  131.932   24.390  153.423   23.762   76.552   7.7248   83.244   6.9210 -6.692619 10.37173 
1 1 1    2   21   40 o   24.732   7.5141   1.6534   14.772 -15.1591   20.920   18.370   20.860   20.218   9.5509   29.246   11.603 -9.028202 15.02820 
1 1 1    2   21   41 o   33.706   8.3869   30.110   14.489   28.553   20.554   31.649   20.426   33.011   11.858   34.401   11.864 -1.390892 16.77385 
1 1 1    2   21   42 o   34.676   9.1987   34.155   17.806   39.473   26.118   29.537   24.340   36.466   13.328   32.886   12.682 3.580593 18.39745 
1 1 1    2   21   43 o   25.223   7.8539   7.3001   16.033   0.8812   22.978   13.390   22.382   23.696   10.770   26.750   11.434 -3.053844 15.70784 
1 1 1    2   21   44 o   26.448   8.7169  -1.7986   25.595 -80.2525   52.955   22.116   29.237   23.382   11.788   29.513   12.844 -6.131342 17.43373 
1 1 1    2   21   45 o   21.441   7.3515 -19.5940   20.270 -12.9486   28.440 -26.4544   28.896   22.224   10.674   20.658   10.112 1.566359 14.70306 
1 1 1    2   22    0 o  244.848   2.2576  1237.64   32.230  1237.64   32.230  1237.64   32.230  244.848   3.1927  244.848   3.1927 0.000000 0.000000 
1 1 1    2   22    1 o  448.270   3.5980  4157.14   65.906  4166.62   87.513  4144.72  100.174  448.947   4.7262  447.592   5.4263 1.355133 7.195976 
1 1 1    2   22    2 o  263.421   3.0631  1431.38   32.563  1446.16   51.818  1421.74   41.862  264.487   4.7502  262.354   3.8687 2.133728 6.126260 
1 1 1    2   22    3 o  128.389   2.7991  340.912   14.173  341.882   17.643  339.147   23.798  128.679   3.3242  128.099   4.5044 0.5802307 5.598217 
1 1 1    2   22    4 o  130.158   3.1986  350.232   17.159  352.608   23.869  347.690   24.685  130.621   4.4305  129.695   4.6146 0.9259033 6.397187 
1 1 1    2   22    5 o  365.960   5.9861  2781.43   90.278  2832.18  130.814  2735.28  124.746  369.102   8.5930  362.819   8.3363 6.283783 11.97214 
1 1 1    2   22    6 o  149.638   3.2652  462.981   20.146  471.938   28.352  453.847   28.632  151.105   4.5492  148.171   4.6852 2.934814 6.530371 
1 1 1    2   22    7 o  210.849   3.3559  919.028   29.176  914.742   40.737  923.543   41.806  210.350   4.6955  211.348   4.7959 -0.9982147 6.711813 
1 1 1    2   22    8 o  128.237   3.6003  340.677   19.012  358.732   26.694  322.090   27.084  131.704   4.9142  124.770   5.2631 6.933540 7.200689 
1 1 1    2   22    9 o   62.190   5.5456   79.926   14.177   71.779   19.308   89.458   20.884   58.763   7.9665   65.617   7.7168 -6.854500 11.09110 
1 1 1    2   22   10 o  212.294   4.1812  931.427   34.723  926.579   42.746  940.831   59.536  211.636   4.8971  212.952   6.7785 -1.315247 8.362420 
1 1 1    2   22   11 o  119.810   4.4748  296.565   21.633  302.452   34.509  292.755   27.765  120.723   6.9308  118.896   5.6620 1.826523 8.949525 
1 1 1    2   22   12 o  339.163   4.1215  2383.04   57.653  2387.47   81.616  2378.63   81.453  339.477   5.8291  338.848   5.8282 0.6287842 8.242942 
1 1 1    2   22   13 o  148.990   3.0312  453.831   16.088  448.854   18.505  469.233   32.557  147.434   3.0432  150.547   5.2433 -3.113373 6.062469 
1 1 1    2   22   14 f  195.494   2.8440  792.969   22.479  805.300   29.172  774.944   35.271  197.421   3.5827  193.567   4.4179 3.853439 5.688021 
1 1 1    2   22   15 o  280.871   2.5434  1628.79   29.444  1663.31   42.578  1597.15   40.761  283.715   3.6386  278.028   3.5546 5.687195 5.086746 
1 1 1    2   22   16 o   68.637   3.1900   98.331   8.9019  117.638   12.614   79.174   12.565   75.430   4.0544   61.843   4.9260 13.58665 6.379970 
1 1 1    2   22   17 o   61.586   3.2283   78.633   7.6982   78.922   9.3997   78.046   13.416   61.795   3.6881   61.378   5.2995 0.4162483 6.456548 
1 1 1    2   22   18 o  138.008   3.6318  399.176   18.854  406.180   22.562  382.964   34.325  140.166   3.9027  135.851   6.1260 4.315186 7.263578 
1 1 1    2   22   19 o   77.974   4.9537  129.346   14.163  120.078   26.636  132.999   16.723   75.821   8.5175   80.126   5.0604 -4.304619 9.907324 
1 1 1    2   22   20 o  148.178   3.0324  454.269   18.527  456.702   26.573  451.969   25.843  148.558   4.3370  147.798   4.2394 0.7604218 6.064831 
1 1 1    2   22   21 o   61.887   6.5530   88.097   10.529   90.410   11.319   73.228   28.699   66.100   4.1518   57.674   12.431 8.426075 13.10604 
1 1 1    2   22   22 o  310.263   3.3330  1994.52   42.642  2019.74   61.102  1970.58   59.538  312.163   4.7457  308.362   4.6813 3.800934 6.666081 
1 1 1    2   22   23 o  157.299   3.4934  509.988   22.546  482.141   30.089  545.639   34.045  152.465   4.7849  162.133   5.0912 -9.667984 6.986804 
1 1 1    2   22   24 o   85.856   4.0563  153.593   14.349  159.755   20.147  147.251   20.441   87.627   5.5744   84.085   5.8940 3.542801 8.112557 
1 1 1    2   22   25 o   89.027   3.8909  166.328   14.163  145.553   20.423  185.576   19.658   83.561   5.9257   94.493   5.0440 -10.93129 7.781766 
1 1 1    2   22   26 o   48.626   6.6921   50.912   13.102   64.754   19.405   39.315   17.762   55.258   8.5142   41.993   10.327 13.26468 13.38416 
1 1 1    2   22   27 o   76.145   4.5887  121.817   14.402  122.123   20.747  121.532   20.008   76.213   6.6002   76.077   6.3766 0.1360397 9.177381 
1 1 1    2   22   28 o   65.236   5.7837   91.407   15.453   84.542   22.639   97.395   21.144   62.770   8.7448   67.703   7.5720 -4.932976 11.56743 
1 1 1    2   22   29 o   50.251   7.7673   58.471   15.438   50.229   25.515   63.230   19.389   46.329   12.885   54.173   8.6778 -7.843975 15.53460 
1 1 1    2   22   30 o   36.164   8.7899   22.671   15.767   10.799   19.347   46.156   27.210   27.980   11.151   44.349   13.591 -16.36859 17.57984 
1 1 1    2   22   31 o   58.962   7.2707   79.289   17.133   70.906   24.880   86.848   23.627   55.087   11.329   62.837   9.1165 -7.750034 14.54131 
1 1 1    2   22   32 o   55.884   6.7606   70.426   15.079   58.575   21.104   82.785   21.552   50.247   10.520   61.520   8.4939 -11.27230 13.52126 
1 1 1    2   22   33 o   46.667   7.5043   50.303   15.016   74.588   21.670   27.872   20.827   58.155   9.0346   35.180   11.985 22.97533 15.00854 
1 1 1    2   22   34 o   25.327   7.6988   3.0805   14.510   4.8769   20.596   1.3102   20.446   25.901   11.017   24.753   10.757 1.147535 15.39767 
1 1 1    2   22   35 f   22.628   7.3472 -11.5046   15.763 -18.7793   22.115  -3.9908   22.475   20.947   9.8722   24.309   10.884 -3.361599 14.69449 
1 1 1    2   22   36 o   58.222   6.7936   79.177   15.637   63.803   22.280   94.100   21.951   51.437   10.844   65.006   8.1870 -13.56878 13.58714 
1 1 1    2   22   37 o   75.521   5.9781  130.091   17.969  123.171   28.875  134.465   22.956   72.908   9.6024   78.135   7.1235 -5.226898 11.95617 
1 1 1    2   22   38 o   53.688   10.174   74.991   21.925   61.408   26.615  103.675   38.677   47.705   13.118   59.672   15.556 -11.96704 20.34878 
1 1 1    2   22   39 o   28.946   8.1393   17.374   14.530   18.895   21.168   16.019   19.979   29.618   11.708   28.274   11.310 1.344248 16.27867 
1 1 1    2   22   40 o   25.594   7.6560   6.6901   14.445   19.931   21.088  -5.0130   19.826   29.572   11.687   21.615   9.8930 7.956575 15.31194 
1 1 1    2   22   41 o   29.057   8.0515   19.150   14.241   12.484   19.753   26.366   20.551   26.359   10.974   31.756   11.785 -5.396793 16.10291 
1 1 1    2   22   42 o   26.941   8.1869   13.210   16.289   11.852   21.803   14.925   24.506   26.195   11.244   27.687   11.903 -1.492186 16.37384 
1 1 1    2   22   43 o   27.341   7.9772   11.720   16.285   34.313   22.888 -11.4421   23.174   33.606   12.444   21.076   9.9849 12.52991 15.95438 
1 1 1    2   22   44 o   19.727   6.8421 -31.4415   19.314 -51.5771   28.521 -14.3855   26.249   18.093   9.0563   21.362   10.259 -3.269867 13.68411 
1 1 1    2   23    0 o  224.828   2.1698  1043.57   28.442  1043.57   28.442  1043.57   28.442  224.828   3.0685  224.828   3.0685 0.000000 0.000000 
1 1 1    2   23    1 o  161.600   2.5154  534.223   16.399  515.768   20.941  563.491   26.372  158.048   3.2125  165.151   3.8716 -7.103653 5.030824 
1 1 1    2   23    2 o  196.642   3.0350  798.690   24.574  790.380   33.709  808.115   35.899  195.562   4.1792  197.721   4.4022 -2.158783 6.069963 
1 1 1    2   23    3 o   23.084   5.0630   10.747   6.7129   18.929   7.7106 -14.8741   13.645   29.648   6.4860   16.519   7.7760 13.12880 10.12594 
1 1 1    2   23    4 o  237.199   3.3401  1163.43   32.674  1179.36   46.510  1147.90   45.913  238.803   4.7221  235.596   4.7250 3.206924 6.680146 
1 1 1    2   23    5 o   69.390   5.8528   98.046   14.637   95.861   16.898  104.610   29.292   68.019   6.0234   70.761   10.037 -2.741676 11.70550 
1 1 1    2   23    6 o  136.191   3.2877  383.832   18.447  389.454   25.609  377.769   26.595  137.238   4.5243  135.143   4.7714 2.094894 6.575390 
1 1 1    2   23    7 o  146.064   3.3951  441.495   20.441  458.340   28.883  424.591   28.933  148.865   4.7042  143.262   4.8966 5.602829 6.790183 
1 1 1    2   23    8 o  183.801   3.3890  697.999   25.666  681.789   35.375  716.017   37.296  181.558   4.7241  186.043   4.8605 -4.485519 6.778025 
1 1 1    2   23    9 o  226.405   3.5007  1060.39   32.682  1050.97   45.649  1070.30   46.811  225.379   4.9108  227.430   4.9904 -2.051392 7.001419 
1 1 1    2   23   10 o  113.988   4.6571  270.736   20.928  273.505   26.097  265.747   35.031  114.914   5.5062  113.062   7.5123 1.852249 9.314107 
1 1 1    2   23   11 o  101.747   4.2712  214.245   17.906  205.686   24.645  223.814   26.059   99.603   5.9992  103.892   6.0814 -4.289055 8.542495 
1 1 1    2   23   12 o  171.336   3.6132  607.405   25.521  634.906   36.547  581.232   35.654  175.125   5.0599  167.547   5.1594 7.578812 7.226492 
1 1 1    2   23   13 o  160.789   3.6945  535.243   24.484  531.536   33.955  539.258   35.338  160.221   5.1383  161.358   5.3098 -1.137512 7.388959 
1 1 1    2   23   14 o  114.717   5.2042  254.523   19.014  244.337   20.846  304.948   46.381  108.662   4.6513  120.771   9.3114 -12.10909 10.40849 
1 1 1    2   23   15 o  172.669   3.2677  614.848   22.049  623.673   37.927  610.343   27.099  173.507   5.2999  171.831   3.8237 1.675964 6.535309 
1 1 1    2   23   16 o  200.328   2.2809  828.418   18.835  846.126   27.198  812.102   26.108  202.380   3.2584  198.276   3.1925 4.103821 4.561769 
1 1 1    2   23   17 o  156.722   2.8375  507.949   18.332  486.688   25.786  529.678   26.067  153.399   4.0756  160.045   3.9490 -6.645859 5.674949 
1 1 1    2   23   18 o  141.667   2.9337  414.663   17.107  379.329   23.765  452.664   24.646  135.400   4.2556  147.934   4.0393 -12.53459 5.867397 
1 1 1    2   23   19 o  128.187   2.8992  338.974   14.847  336.047   18.754  343.887   24.302  127.498   3.5663  128.876   4.5719 -1.377823 5.798381 
1 1 1    2   23   20 o  169.429   2.6813  593.347   18.342  591.503   23.622  596.147   29.108  169.151   3.3859  169.707   4.1586 -0.5561523 5.362651 
1 1 1    2   23   21 o  158.236   2.9098  518.866   18.975  532.502   26.532  504.590   27.147  160.382   4.0110  156.091   4.2167 4.291519 5.819686 
1 1 1    2   23   22 o  215.077   3.7250  955.082   31.637  940.536   39.281  981.937   53.373  212.985   4.4717  217.169   5.9588 -4.184357 7.450062 
1 1 1    2   23   23 o   80.122   3.4663  125.920   10.556  115.478   12.459  152.486   19.872   74.652   4.0464   85.592   5.6292 -10.94080 6.932605 
1 1 1    2   23   24 o  177.695   2.9230  651.990   21.189  636.139   27.825  673.867   32.690  175.202   3.8506  180.188   4.3987 -4.985611 5.845974 
1 1 1    2   23   25 o   67.983   3.8859   93.614   10.124   88.998   12.106  104.353   18.464   65.420   4.4867   70.546   6.3460 -5.126373 7.771849 
1 1 1    2   23   26 o   58.623   5.3979   72.843   13.035   68.490   18.363   77.264   18.508   56.814   7.8364   60.431   7.4256 -3.616264 10.79576 
1 1 1    2   23   27 o   28.733   7.7237   13.815   12.535   14.928   19.233   12.993   16.528   29.714   11.319   27.753   10.512 1.960655 15.44748 
1 1 1    2   23   28 o   23.679   7.1539   1.0828   12.483  -4.0645   18.579   5.3180   16.853   22.675   10.039   24.682   10.194 -2.007519 14.30776 
1 1 1    2   23   29 o   84.618   4.2623  151.121   14.873  153.590   21.272  148.760   20.804   85.288   6.0471   83.948   6.0085 1.339218 8.524644 
1 1 1    2   23   30 o   45.084   10.473   50.321   22.366   43.477   37.434   54.120   27.891   43.141   15.926   47.027   13.605 -3.886326 20.94586 
1 1 1    2   23   31 o   36.824   8.0761   31.175   13.991   21.034   19.939   41.011   19.637   31.962   11.650   41.687   11.188 -9.724859 16.15210 
1 1 1    2   23   32 o   78.120   4.8264  130.703   15.539  137.932   22.356  123.947   21.613   80.238   6.7555   76.002   6.8949 4.235718 9.652823 
1 1 1    2   23   33 o   29.680   8.0400   14.935   14.210   25.776   20.691   5.2573   19.551   33.849   11.925   25.512   10.787 8.336491 16.07998 
1 1 1    2   23   34 o   88.153   4.4789  166.383   16.199  191.366   23.637  144.259   22.243   94.519   6.0632   81.787   6.5940 12.73193 8.957856 
1 1 1    2   23   35 o   39.832   8.9020   37.707   17.497   59.050   25.676   19.201   23.908   48.164   12.732   31.499   12.445 16.66569 17.80407 
1 1 1    2   23   36 o   30.061   8.2356   17.517   14.662   25.108   21.790   11.236   19.821   32.975   12.155   27.148   11.116 5.826714 16.47130 
1 1 1    2   23   37 o   39.535   8.2911   39.712   14.926   52.732   21.710   28.041   20.555   45.383   11.565   33.688   11.883 11.69526 16.58220 
1 1 1    2   23   38 o   49.427   9.1587   66.785   18.937   71.174   26.632   62.297   26.932   51.462   12.639   47.392   13.258 4.070286 18.31743 
1 1 1    2   23   39 o   25.239   7.4587   5.6535   14.033 -10.7223   19.937   21.730   19.754   20.411   9.5411   30.067   11.467 -9.656157 14.91749 
1 1 1    2   23   40 o   34.007   7.8125   28.124   14.489   50.612   20.588   6.0562   20.395   43.396   11.367   24.617   10.720 18.77847 15.62499 
1 1 1    2   23   41 o   40.287   8.6712   47.533   15.710   46.148   22.437   48.865   22.004   39.554   12.378   41.021   12.147 -1.466682 17.34231 
1 1 1    2   23   42 f   22.655   7.3796  -2.5624   15.969   0.5224   22.732  -5.5679   22.438   23.355   10.652   21.956   10.216 1.398775 14.75916 
1 1 1    2   23   43 o   25.662   8.3204   4.2541   20.983 -19.0280   32.729   20.502   27.341   22.860   11.094   28.464   12.404 -5.604328 16.64084 
1 1 1    2   24    0 o   66.905   2.0535   92.883   7.9793   92.883   7.9793   92.883   7.9793   66.905   2.9041   66.905   2.9041 0.000000 0.000000 
1 1 1    2   24    1 o  129.720   2.2547  346.264   11.354  343.889   13.861  351.108   19.797  129.076   2.6036  130.364   3.6818 -1.288437 4.509418 
1 1 1    2   24    2 o  169.300   2.6240  595.896   18.140  562.576   27.212  622.546   24.336  164.989   3.9989  173.612   3.3987 -8.623077 5.248048 
1 1 1    2   24    3 o   98.556   4.8264  200.947   19.619   0.0000   0.0000  200.947   19.619  ?   ?    98.556   4.8264      ?      ? 
1 1 1    2   24    4 o  112.716   4.2696  256.715   18.444  281.163   33.534  246.112   22.084  116.371   6.9868  109.062   4.9095 7.308846 8.539189 
1 1 1    2   24    5 o  160.008   4.1040  518.054   24.295  503.025   28.424  558.802   46.803  155.964   4.4187  164.053   6.9170 -8.089813 8.207961 
1 1 1    2   24    6 f  189.358   3.2710  741.260   25.523  730.952   35.242  752.630   37.012  187.984   4.5455  190.731   4.7050 -2.746567 6.542011 
1 1 1    2   24    7 o  253.898   3.5446  1334.13   37.115  1353.44   52.931  1315.46   52.056  255.703   5.0189  252.092   5.0066 3.610489 7.089106 
1 1 1    2   24    8 o  105.642   3.9035  232.096   16.941  249.640   23.609  213.475   24.324  109.800   5.2134  101.485   5.8112 8.314384 7.807039 
1 1 1    2   24    9 o  245.516   3.5583  1247.85   36.031  1251.86   50.887  1243.83   51.026  245.913   5.0172  245.118   5.0472 0.7955322 7.116590 
1 1 1    2   24   10 o  198.254   4.7126  813.509   38.411  785.641   51.936  847.159   57.070  194.556   6.4723  201.951   6.8516 -7.395370 9.425206 
1 1 1    2   24   11 o   47.499   7.9270   49.770   15.249   54.005   20.432   44.445   22.913   49.876   10.274   45.123   12.074 4.752701 15.85405 
1 1 1    2   24   12 o  126.072   4.0204  329.482   20.883  329.150   28.860  329.848   30.254  126.021   5.5524  126.124   5.8160 -0.1029587 8.040852 
1 1 1    2   24   13 o   67.010   9.3932  110.959   22.318   68.154   42.380  127.385   26.253   55.850   16.930   78.170   8.1429 -22.32004 18.78649 
1 1 1    2   24   14 o  138.197   5.0760  386.998   26.560  372.187   31.517  423.286   49.332  133.974   5.7038  142.420   8.3982 -8.446548 10.15201 
1 1 1    2   24   15 o  231.901   3.1820  1109.62   27.175  1105.46   31.890  1120.65   51.931  231.297   3.3429  232.505   5.4153 -1.207458 6.364028 
1 1 1    2   24   16 o   90.086   2.5312  168.177   9.2202  169.943   11.951  165.580   14.492   90.693   3.1950   89.479   3.9267 1.214844 5.062323 
1 1 1    2   24   17 o  143.193   3.7519  439.687   20.303  464.474   24.653  387.441   35.792  149.848   3.9889  136.539   6.3558 13.30872 7.503826 
1 1 1    2   24   18 f  128.427   2.6194  336.197   13.250  357.543   22.661  325.107   16.333  131.428   4.1804  125.425   3.1574 6.003281 5.238804 
1 1 1    2   24   19 o  147.617   2.8558  449.551   16.760  445.331   21.019  456.919   27.771  146.743   3.4728  148.492   4.5345 -1.748703 5.711578 
1 1 1    2   24   20 o   43.037   4.5091   32.664   7.0369   16.916   8.3827   70.243   12.949   27.932   7.2228   58.142   5.4000 -30.21011 9.018283 
1 1 1    2   24   21 o   91.989   2.9787  175.660   10.639  176.175   13.024  174.628   18.445   92.272   3.4221   91.707   4.8764 0.5651550 5.957397 
1 1 1    2   24   22 o  176.031   3.5062  644.446   25.431  663.076   35.552  624.924   36.394  178.673   4.8244  173.387   5.0891 5.286011 7.012382 
1 1 1    2   24   23 o   62.941   3.8232   79.649   9.1093   75.476   10.778   90.084   17.042   60.282   4.3350   65.600   6.2987 -5.317596 7.646328 
1 1 1    2   24   24 o   24.879   5.8661   13.102   7.2051   16.927   8.3245   1.6775   14.386   27.820   7.1995   21.937   9.2635 5.883059 11.73224 
1 1 1    2   24   25 f   37.285   5.9453   30.636   8.1515   31.245   9.4612   28.880   16.058   38.584   5.9452   35.985   10.298 2.599350 11.89057 
1 1 1    2   24   26 o  122.950   3.3088  313.591   16.699  295.413   22.332  336.646   25.151  118.977   4.5510  126.923   4.8044 -7.946266 6.617671 
1 1 1    2   24   27 o  107.337   3.8485  239.109   16.934  207.893   22.719  278.134   25.402   99.508   5.5356  115.165   5.3479 -15.65742 7.696958 
1 1 1    2   24   28 o   24.017   7.2301   2.4409   12.520   0.8624   18.846   3.6878   16.749   24.153   10.411   23.880   10.035 0.2725391 14.46010 
1 1 1    2   24   29 o   36.796   7.4462   32.269   13.044   12.909   20.434   45.584   16.947   28.906   11.479   44.686   9.4881 -15.78073 14.89244 
1 1 1    2   24   30 o   24.004   8.0422 -21.2382   17.313 -10.2486   35.632 -24.6343   19.808   29.332   13.362   18.676   8.9533 10.65590 16.08445 
1 1 1    2   24   31 o   66.340   6.3486   95.456   16.734   91.224   20.857  103.103   28.036   64.837   7.7993   67.843   10.019 -3.005630 12.69715 
1 1 1    2   24   32 o   36.021   8.0461   30.226   14.048   17.989   20.182   41.726   19.566   30.393   11.591   41.649   11.163 -11.25651 16.09229 
1 1 1    2   24   33 o   25.034   7.5003   2.7836   13.946  -8.4056   20.104   13.163   19.362   21.930   10.008   28.137   11.174 -6.206755 15.00054 
1 1 1    2   24   34 o   46.240   7.6199   51.759   14.428   64.746   20.781   39.672   20.048   52.392   9.9812   40.088   11.516 12.30419 15.23980 
1 1 1    2   24   35 o   31.165   7.9382   18.343   14.179   36.925   20.921   2.5548   19.284   38.259   11.949   24.071   10.453 14.18814 15.87634 
1 1 1    2   24   36 o   49.417   7.8908   59.257   15.730   81.706   24.560   43.646   20.481   57.616   10.730   41.218   11.573 16.39846 15.78166 
1 1 1    2   24   37 o   36.439   8.2079   27.411   17.242   64.866   25.118  -5.9638   23.710   49.329   12.369   23.550   10.793 25.77912 16.41570 
1 1 1    2   24   38 f   27.387   7.8922   10.289   15.981 -16.3483   25.201   28.206   20.668   21.925   10.395   32.848   11.878 -10.92305 15.78431 
1 1 1    2   24   39 o   17.062   5.8810 -26.8854   13.384 -33.4978   18.607 -19.7958   19.267   15.854   7.8290   18.271   8.7780 -2.417486 11.76210 
1 1 1    2   24   40 o   31.454   8.3085   26.950   14.493   27.361   20.471   26.537   20.521   31.626   11.757   31.282   11.743 0.3439999 16.61696 
1 1 1    2   24   41 o   43.983   8.5786   56.831   16.434   44.562   22.979   69.680   23.514   38.231   12.582   49.735   11.665 -11.50394 17.15729 
1 1 1    2   24   42 o   26.740   7.8729   13.186   15.529  -4.7488   21.867   31.434   22.057   21.507   10.033   31.972   12.136 -10.46544 15.74583 
1 1 1    2   24   43 o   26.281   8.6609   3.8230   23.395   25.473   33.639 -16.4587   32.558   29.657   13.295   22.905   11.104 6.751139 17.32174 
1 1 1    2   25    0 o   81.896   1.9066  138.839   9.0854  138.839   9.0854  138.839   9.0854   81.896   2.6964   81.896   2.6964 0.000000 0.000000 
1 1 1    2   25    1 o  219.730   2.4465  997.414   22.171  1007.28   31.479  987.700   31.231  220.808   3.4565  218.651   3.4632 2.157516 4.892990 
1 1 1    2   25    2 o   90.667   4.8265  170.125   18.049   0.0000   0.0000  170.125   18.049  ?   ?    90.667   4.8265      ?      ? 
1 1 1    2   25    3 o   63.359   4.1056   84.405   10.512   90.383   13.864   76.323   16.121   66.073   5.0875   60.645   6.4452 5.428070 8.211120 
1 1 1    2   25    4 o  117.811   4.3879  293.748   19.619  272.647   34.842  303.545   23.741  114.507   7.3775  121.114   4.7526 -6.607056 8.775776 
1 1 1    2   25    5 o  110.447   4.6701  241.110   18.400  229.927   21.019  277.786   38.066  105.401   4.8351  115.493   7.9912 -10.09218 9.340121 
1 1 1    2   25    6 o   74.431   4.4193  114.974   13.469  115.177   18.010  114.715   20.288   74.533   5.8587   74.329   6.6178 0.2044067 8.838574 
1 1 1    2   25    7 o  189.093   3.3586  740.169   26.188  756.786   36.983  723.458   37.088  191.231   4.6890  186.956   4.8098 4.275223 6.717203 
1 1 1    2   25    8 o   69.976   5.0511  100.884   14.506   88.920   19.538  115.577   21.652   65.387   7.2447   74.564   7.0406 -9.176849 10.10228 
1 1 1    2   25    9 o  154.159   3.5924  492.680   22.803  502.646   31.543  481.770   33.003  155.815   4.9082  152.502   5.2471 3.312744 7.184879 
1 1 1    2   25   10 o  140.723   4.3319  408.914   24.733  421.818   38.890  400.149   32.051  142.506   6.6166  138.939   5.5930 3.566147 8.663832 
1 1 1    2   25   11 o  157.647   3.7021  514.019   24.039  499.032   32.979  531.008   35.113  155.211   5.1518  160.083   5.3181 -4.871902 7.404252 
1 1 1    2   25   12 o  190.978   3.6649  755.671   28.862  776.952   41.010  734.786   40.626  193.650   5.1345  188.305   5.2309 5.344681 7.329809 
1 1 1    2   25   13 o   57.907   11.656   73.032   30.242  101.116   43.533   46.836   42.044   67.206   15.946   48.609   17.007 18.59686 23.31286 
1 1 1    2   25   14 o   26.897   8.1734  -2.3572   16.488  -9.6444   22.621   5.9014   24.082   24.314   10.901   29.480   12.182 -5.166086 16.34681 
1 1 1    2   25   15 o   32.841   9.0649   14.440   17.753   11.425   24.420   17.819   25.856   31.420   12.526   34.262   13.107 -2.842300 18.12971 
1 1 1    2   25   16 o  187.695   3.2844  720.009   21.573  711.346   24.606  748.801   44.857  185.517   3.2158  189.874   5.7279 -4.357391 6.568894 
1 1 1    2   25   17 o  191.797   3.3094  759.106   22.254  756.014   25.453  769.138   45.848  191.232   3.2272  192.361   5.7788 -1.129425 6.618880 
1 1 1    2   25   18 o   80.403   2.3902  133.769   7.9051  132.899   11.593  134.526   10.808   80.149   3.5068   80.656   3.2489 -0.5074158 4.780486 
1 1 1    2   25   19 o   50.451   4.6389   52.098   9.4024   57.642   15.432   48.825   11.858   52.488   7.1283   48.414   5.9383 4.074371 9.277707 
1 1 1    2   25   20 o  114.162   2.7881  271.646   12.728  276.878   16.218  263.256   20.537  115.670   3.3995  112.654   4.4201 3.016304 5.576192 
1 1 1    2   25   21 o   47.177   5.4968   50.104   9.8093   25.782   13.752   75.299   13.996   34.270   9.4319   60.084   5.6480 -25.81351 10.99369 
1 1 1    2   25   22 o  100.161   3.7157  206.027   15.210  172.931   20.224  249.117   23.076   91.017   5.3875  109.305   5.1187 -18.28891 7.431418 
1 1 1    2   25   23 o   45.330   7.8347   44.535   8.8950   44.585   9.2555   43.930   32.182   46.241   4.8530   44.419   14.899 1.822487 15.66942 
1 1 1    2   25   24 f  156.663   3.1724  511.443   20.491  519.910   29.445  503.491   28.535  157.907   4.5210  155.419   4.4516 2.487473 6.344798 
1 1 1    2   25   25 o  122.361   3.4190  313.516   17.228  300.888   24.716  325.449   24.026  119.903   4.9979  124.818   4.6670 -4.914894 6.838092 
1 1 1    2   25   26 o   73.758   3.6475  112.123   10.313  108.984   12.394  119.188   18.596   72.315   4.1555   75.201   5.9958 -2.885246 7.295005 
1 1 1    2   25   27 o   93.572   4.0572  185.645   15.562  190.240   21.049  180.104   23.112   94.996   5.3722   92.149   6.0812 2.847252 8.114340 
1 1 1    2   25   28 o   36.666   6.2842   30.949   8.6081   32.235   9.8844   26.909   17.514   38.934   6.1554   34.398   10.958 4.535786 12.56841 
1 1 1    2   25   29 o   29.944   6.4049   21.255   8.2506   24.093   9.3473   11.245   17.555   32.898   7.0972   26.990   10.664 5.908928 12.80985 
1 1 1    2   25   30 o   40.730   7.9164   38.588   13.985   28.119   19.059   50.799   20.584   35.026   11.455   46.434   10.930 -11.40805 15.83288 
1 1 1    2   25   31 o  114.929   5.4879  289.555   25.938  316.200   36.919  263.583   36.450  120.433   7.4326  109.424   8.0763 11.00912 10.97589 
1 1 1    2   25   32 o   21.137   6.7216  -7.9607   12.794 -20.5343   18.509   3.5421   17.703   18.374   8.7665   23.900   10.191 -5.526237 13.44312 
1 1 1    2   25   33 o   32.087   7.6076   19.386   13.422   41.357   19.880   0.9806   18.196   40.969   11.366   23.205   10.115 17.76341 15.21523 
1 1 1    2   25   34 o   28.587   8.0901   13.768   14.915   4.1767   21.765   22.260   20.480   25.650   11.122   31.523   11.751 -5.872339 16.18019 
1 1 1    2   25   35 o   25.418   7.4557   5.0043   13.849 -10.8042   19.804   20.131   19.373   20.725   9.6278   30.111   11.387 -9.386158 14.91144 
1 1 1    2   25   36 o   25.732   7.6814   5.8009   14.625  -6.9681   20.478   19.095   20.895   21.767   9.9961   29.697   11.666 -7.930540 15.36288 
1 1 1    2   25   37 o   39.091   7.5998   39.105   14.432   64.887   20.705   14.744   20.126   50.704   10.253   27.478   11.221 23.22554 15.19960 
1 1 1    2   25   38 o   26.852   7.1874   5.7048   13.589 -22.3905   19.002   35.112   19.440   17.693   8.5541   36.011   11.553 -18.31821 14.37486 
1 1 1    2   25   39 o   36.816   8.9114   39.285   17.668   58.411   24.967   20.097   25.006   44.223   12.894   29.408   12.304 14.81526 17.82278 
1 1 1    2   25   40 o   19.294   6.5430 -17.4697   14.977 -18.7183   20.874 -16.1448   21.502   18.929   9.1051   19.659   9.3990 -0.7297707 13.08602 
1 1 1    2   25   41 o   32.918   7.6868   24.309   15.664   61.317   22.600  -9.9045   21.731   45.333   11.927   20.503   9.7006 24.82982 15.37356 
1 1 1    2   25   42 o   30.070   8.3762   26.465   15.735   16.151   22.092   37.085   22.416   26.403   11.325   33.736   12.344 -7.333075 16.75233 
1 1 1    2   26    0 o   70.978   2.4337  104.722   10.022  104.722   10.022  104.722   10.022   70.978   3.4418   70.978   3.4418 0.000000 0.000000 
1 1 1    2   26    1 o  135.708   3.0217  379.301   14.494  384.085   29.518  377.781   16.638  136.165   5.2561  135.250   2.9827 0.9157257 6.043396 
1 1 1    2   26    2 o  285.303   3.5359  1683.17   41.530  1649.69   56.794  1721.64   60.884  282.286   4.8780  288.319   5.1199 -6.032684 7.071708 
1 1 1    2   26    3 o   98.222   3.3165  199.121   13.383  193.800   18.039  205.635   19.958   96.780   4.5192   99.665   4.8552 -2.885788 6.633005 
1 1 1    2   26    4 o   83.548   5.2298  145.663   16.254  144.252   30.380  146.229   19.239   83.101   8.8636   83.995   5.5534 -0.8933792 10.45962 
1 1 1    2   26    5 o   65.961   6.8319   86.913   14.390   83.460   15.959  101.923   33.275   63.422   6.1011   68.501   12.226 -5.079563 13.66370 
1 1 1    2   26    6 o  144.297   3.3923  429.156   20.130  407.715   27.222  455.026   29.902  140.349   4.7027  148.246   4.8904 -7.897324 6.784621 
1 1 1    2   26    7 o  262.095   3.6346  1422.88   39.278  1416.86   54.832  1429.22   56.292  261.539   5.0831  262.651   5.1964 -1.112518 7.269160 
1 1 1    2   26    8 o  112.528   3.8575  260.965   17.825  247.041   23.892  278.441   26.768  109.179   5.3059  115.877   5.6007 -6.698364 7.714950 
1 1 1    2   26    9 o   78.175   5.7978  133.094   17.431  145.525   21.738  110.703   29.175   83.704   6.2965   72.646   9.7370 11.05761 11.59554 
1 1 1    2   26   10 o   35.730   8.6001   23.272   16.181   7.5217   23.354   37.811   22.439   29.632   12.092   41.828   12.232 -12.19617 17.20020 
1 1 1    2   26   11 o  162.924   3.7230  550.712   24.987  561.334   34.696  539.269   36.014  164.582   5.1113  161.267   5.4145 3.315079 7.445930 
1 1 1    2   26   12 o   48.378   8.2759   49.211   16.686   31.398   21.976   73.461   25.640   38.682   12.270   58.074   11.109 -19.39142 16.55173 
1 1 1    2   26   13 o  114.120   7.3829  274.787   34.730  287.182   49.390  262.663   48.846  116.710   10.260  111.530   10.619 5.180046 14.76587 
1 1 1    2   26   14 o   88.657   5.4343  165.197   19.749  182.415   27.581  147.083   28.290   93.504   7.1519   83.811   8.1840 9.692520 10.86862 
1 1 1    2   26   15 o  141.096   4.2692  414.810   24.774  422.806   33.977  405.733   36.199  142.603   5.7768  139.589   6.2875 3.013733 8.538381 
1 1 1    2   26   16 o   78.762   6.3021  131.179   20.383  138.869   28.137  122.687   29.569   81.295   8.3918   76.230   9.4045 5.064156 12.60428 
1 1 1    2   26   17 o   59.750   7.1771   91.847   11.027   97.264   11.889   58.499   29.501   68.501   4.2081   50.998   13.724 17.50279 14.35418 
1 1 1    2   26   18 o  163.074   4.5252  555.317   25.955  555.422   29.775  554.984   52.968  163.631   4.4118  162.517   7.9023 1.113922 9.050391 
1 1 1    2   26   19 o   47.437   2.8017   46.953   5.3933   44.958   8.3140   48.402   7.0868   46.536   4.3317   48.338   3.5546 -1.802158 5.603445 
1 1 1    2   26   20 o  179.204   2.8910  661.041   21.261  580.452   28.684  759.291   31.672  167.167   4.1603  191.240   4.0154 -24.07278 5.782039 
1 1 1    2   26   21 o   48.255   4.1168   52.131   7.5495   60.333   9.5355   38.354   12.359   53.862   4.2923   42.647   7.0262 11.21568 8.233561 
1 1 1    2   26   22 o   30.069   5.4972   19.504   6.4749   18.983   7.7516   20.705   11.777   29.456   6.5499   30.682   8.8303 -1.225893 10.99434 
1 1 1    2   26   23 o   55.370   3.9956   65.048   8.6928   66.641   10.847   62.189   14.532   56.490   4.6557   54.250   6.4948 2.239288 7.991164 
1 1 1    2   26   24 o   45.197   7.7513   45.796   8.5662   46.022   8.8953   42.906   31.789   46.949   4.5938   43.446   14.806 3.502441 15.50266 
1 1 1    2   26   25 o   47.445   4.2549   39.797   7.5309   30.270   8.6769   68.886   15.162   37.910   5.5495   56.980   6.4514 -19.07027 8.509851 
1 1 1    2   26   26 o   54.502   4.4206   62.808   8.8730   62.341   10.421   64.039   16.921   54.511   4.6349   54.493   7.5288 0.1858521E-01 8.841152 
1 1 1    2   26   27 o   81.589   4.0015  140.373   13.410  123.664   18.380  159.389   19.608   76.351   5.8367   86.827   5.4754 -10.47522 8.002945 
1 1 1    2   26   28 o   86.131   3.9515  156.954   14.032  153.374   19.515  160.786   20.191   85.127   5.5583   87.136   5.6182 -2.008705 7.903083 
1 1 1    2   26   29 o   37.937   6.6009   33.728   9.3287   35.145   10.634   28.999   19.431   40.517   6.3637   35.358   11.567 5.158703 13.20171 
1 1 1    2   26   30 o   89.790   4.0611  171.021   14.999  156.669   20.401  187.902   22.127   85.697   5.7720   93.882   5.7143 -8.185249 8.122184 
1 1 1    2   26   31 o   43.765   6.1656   48.705   9.3658   54.033   10.861   33.251   18.497   50.420   5.2227   37.109   11.171 13.31099 12.33118 
1 1 1    2   26   32 o   56.727   7.8399   74.892   16.309   71.738   19.246   82.924   30.715   56.705   8.2291   56.749   13.347 -0.4341125E-01 15.67977 
1 1 1    2   26   33 o   30.650   7.1354   16.989   8.8379   12.580   9.8699   34.826   19.853   24.116   8.2501   37.185   11.644 -13.06964 14.27086 
1 1 1    2   26   34 o   36.324   8.0053   31.160   14.635   52.550   21.443   12.507   20.024   45.328   11.462   27.320   11.178 18.00817 16.01055 
1 1 1    2   26   35 o   50.772   6.9223   62.916   13.958   65.360   20.282   60.718   19.237   51.658   9.8795   49.887   9.6988 1.771347 13.84454 
1 1 1    2   26   36 o   28.810   8.1410   15.907   15.578   0.9596   22.649   29.325   21.460   24.298   10.900   33.322   12.096 -9.024265 16.28202 
1 1 1    2   26   37 o   22.690   7.1611  -1.7372   13.767   9.8446   20.757 -10.8318   18.394   25.906   11.041   19.474   9.1227 6.431616 14.32218 
1 1 1    2   26   38 o   49.599   7.2489   64.167   14.341   69.118   20.309   59.242   20.254   51.995   9.8302   47.203   10.656 4.792156 14.49781 
1 1 1    2   26   39 o   28.553   8.2541   19.764   15.609   13.411   24.485   24.114   20.259   27.104   11.775   30.002   11.570 -2.897768 16.50817 
1 1 1    2   26   40 o   24.117   7.4886   6.0591   14.840  -6.0687   20.929   18.325   21.047   20.912   9.7755   27.322   11.347 -6.409813 14.97721 
1 1 1    2   26   41 o   17.124   5.9611 -30.7778   14.960 -44.7988   21.454 -17.5063   20.872   15.594   7.8126   18.654   9.0057 -3.060131 11.92225 
1 1 1    2   27    0 o   86.764   2.0178  155.861   10.187  155.861   10.187  155.861   10.187   86.764   2.8536   86.764   2.8536 0.000000 0.000000 
1 1 1    2   27    1 o  137.058   2.4882  392.864   13.587  369.682   21.947  407.271   17.301  133.697   3.9800  140.418   2.9874 -6.720490 4.976419 
1 1 1    2   27    2 o  169.731   2.9407  595.310   20.476  589.735   27.503  602.243   30.669  168.867   3.9488  170.596   4.3588 -1.728668 5.881493 
1 1 1    2   27    3 o   53.477   5.0289   59.248   11.092   0.0000   0.0000   59.248   11.092  ?   ?    53.477   5.0289      ?      ? 
1 1 1    2   27    4 o   83.631   7.1036  143.872   24.164  115.137   31.910  182.499   36.997   73.980   10.458   93.282   9.6162 -19.30232 14.20713 
1 1 1    2   27    5 o   84.609   6.3557  148.730   22.179  148.730   22.179   0.0000   0.0000   84.609   6.3557  ?   ?       ?      ? 
1 1 1    2   27    6 o  125.604   4.0317  324.797   20.727  346.939   31.703  308.269   27.391  129.280   5.9457  121.927   5.4469 7.353386 8.063445 
1 1 1    2   27    7 o  124.848   3.6861  322.745   18.948  317.297   25.956  328.960   27.725  123.737   5.0860  125.959   5.3367 -2.222458 7.372111 
1 1 1    2   27    8 o  152.759   3.5692  479.832   22.396  439.735   30.089  529.648   33.538  145.665   5.0082  159.852   5.0868 -14.18745 7.138475 
1 1 1    2   27    9 o  206.885   4.2346  886.573   34.304  880.750   42.266  897.812   58.719  206.131   4.9715  207.638   6.8566 -1.507584 8.469282 
1 1 1    2   27   10 o   71.247   5.8373  104.986   17.038   90.480   22.812  123.285   25.622   65.727   8.4150   76.766   8.0922 -11.03976 11.67461 
1 1 1    2   27   11 o   43.808   8.7082   41.840   16.345   38.331   22.060   46.110   24.338   41.904   12.093   45.713   12.534 -3.809776 17.41636 
1 1 1    2   27   12 o  202.540   3.7675  852.085   31.464  863.852   44.203  840.001   44.796  203.977   5.2542  201.103   5.4008 2.874054 7.534904 
1 1 1    2   27   13 o   65.765   9.7400   92.629   22.250   90.330   25.275  100.543   46.901   65.429   9.3661   66.101   17.081 -0.6714706 19.48002 
1 1 1    2   27   14 o   35.426   8.9806   22.076   17.641   35.243   23.697   5.7080   26.421   40.482   12.729   30.369   12.671 10.11205 17.96112 
1 1 1    2   27   15 o  141.424   4.2251  417.544   24.598  435.104   34.266  398.872   35.334  144.552   5.7473  138.295   6.1947 6.257217 8.450235 
1 1 1    2   27   16 o  135.966   4.4937  386.662   25.155  398.290   34.904  374.095   36.286  138.157   6.1254  133.775   6.5765 4.381790 8.987330 
1 1 1    2   27   17 o   96.264   5.4199  194.101   21.451  180.005   28.980  211.184   31.903   92.439   7.6011  100.090   7.7283 -7.650749 10.83988 
1 1 1    2   27   18 o   43.240   10.543   38.700   22.940   28.674   30.773   51.241   34.416   38.891   14.423   47.589   15.382 -8.697147 21.08663 
1 1 1    2   27   19 o  123.990   3.7863  320.813   14.574  320.609   16.014  321.796   35.165  124.408   3.1209  123.572   6.8995 0.8360977 7.572564 
1 1 1    2   27   20 o  102.172   2.6863  217.337   11.010  218.869   14.056  214.906   17.712  102.728   3.3174  101.615   4.2261 1.113487 5.372604 
1 1 1    2   27   21 o   64.247   3.5059   83.160   8.0152   92.716   16.505   80.211   9.1690   66.358   6.0304   62.136   3.5777 4.221134 7.011875 
1 1 1    2   27   22 o  123.558   2.7022  317.050   13.372  315.440   16.976  319.682   21.706  123.271   3.3390  123.846   4.2495 -0.5745544 5.404328 
1 1 1    2   27   23 o   40.929   3.3650   35.562   5.5861   31.323   8.3688   38.969   7.5020   38.632   5.2522   43.225   4.2080 -4.592831 6.730008 
1 1 1    2   27   24 o   48.525   4.3168   47.113   8.3747   38.387   10.409   63.132   14.102   42.559   5.9300   54.491   6.2748 -11.93202 8.633537 
1 1 1    2   27   25 o   47.393   7.1933   38.397   8.5917   35.400   8.9797   70.841   29.545   40.958   5.3157   53.829   13.369 -12.87064 14.38665 
1 1 1    2   27   26 o   66.382   4.5815   94.113   12.529   93.617   17.287   94.663   18.184   66.252   6.3263   66.513   6.6287 -0.2613754 9.163009 
1 1 1    2   27   27 o   30.213   5.7202   22.505   7.2633   26.357   8.2700   9.5091   15.190   35.262   5.6864   25.164   9.9270 10.09760 11.44036 
1 1 1    2   27   28 o   24.770   6.1898   11.728   7.0120   11.043   8.0121   13.969   14.493   22.763   7.4264   26.778   9.9047 -4.014294 12.37962 
1 1 1    2   27   29 o   51.110   5.5824   61.979   9.7153   66.580   11.415   49.890   18.503   56.112   4.9325   46.108   10.016 10.00357 11.16487 
1 1 1    2   27   30 o   21.837   6.3162   3.9389   7.6220   1.6417   8.5929   12.416   16.507   17.079   7.1828   26.595   10.392 -9.515709 12.63246 
1 1 1    2   27   31 o   28.775   5.7638   21.685   8.1846   29.125   9.3658  -2.3591   16.836   36.167   6.5184   21.383   9.5077 14.78461 11.52758 
1 1 1    2   27   32 o   26.394   6.6631   9.3808   8.3682   3.4528   9.5605   28.799   17.303   18.592   7.6784   34.196   10.892 -15.60421 13.32621 
1 1 1    2   27   33 o   21.123   6.7350   3.1210   8.4859   6.0792   8.7578 -42.3139   34.322   19.425   7.5749   22.821   11.138 -3.396465 13.47009 
1 1 1    2   27   34 o   57.439   5.5441   84.186   10.601   95.848   12.680   57.109   19.321   66.948   4.5921   47.929   10.093 19.01896 11.08814 
1 1 1    2   27   35 o   44.106   6.2352   37.892   9.4577   29.904   10.609   68.808   20.872   35.720   7.4428   52.493   10.006 -16.77265 12.47049 
1 1 1    2   27   36 o   19.583   6.2510   0.8699   8.7676   4.0592   9.4122 -20.0521   24.107   18.473   7.6232   20.693   9.9090 -2.219749 12.50204 
1 1 1    2   27   37 o   33.359   7.7342   25.172   14.381   1.9311   19.205   54.833   21.696   22.592   10.092   44.126   11.723 -21.53381 15.46844 
1 1 1    2   27   38 f   19.643   6.5519 -12.3169   14.069  -3.5143   19.199 -22.5275   20.677   21.061   9.6745   18.225   8.8382 2.835751 13.10376 
1 1 1    2   27   39 f   32.318   8.0203   30.417   13.585   21.983   19.030   39.183   19.400   28.462   11.148   36.175   11.534 -7.712767 16.04056 
1 1 1    2   27   40 o   30.359   8.9540   24.783   19.984   2.4363   27.827   48.583   28.718   24.464   11.381   36.254   13.827 -11.79013 17.90802 
1 1 1    2   28    0 o   45.420   2.1568   43.156   5.6549   43.156   5.6549   43.156   5.6549   45.420   3.0502   45.420   3.0502 0.000000 0.000000 
1 1 1    2   28    1 o   92.124   2.3898  171.789   8.6039  186.721   15.033  164.515   10.492   95.007   3.8363   89.241   2.8507 5.766167 4.779499 
1 1 1    2   28    2 o  108.488   3.4759  242.699   15.323  251.211   23.991  236.833   19.914  110.043   5.2859  106.933   4.5152 3.109932 6.951834 
1 1 1    2   28    3 o  134.998   3.5648  371.198   19.381  408.163   31.564  348.829   24.554  140.234   5.4573  129.763   4.5878 10.47079 7.129544 
1 1 1    2   28    4 o  256.659   4.2559  1397.81   42.504  1279.55   71.697  1461.89   52.778  247.748   7.0165  265.570   4.8185 -17.82129 8.511722 
1 1 1    2   28    5 o   73.717   6.1139  107.630   15.084  103.395   16.809  125.136   34.178   70.542   5.7774   76.892   10.777 -6.350533 12.22783 
1 1 1    2   28    6 o  253.205   3.5573  1329.53   37.135  1316.18   51.684  1343.78   53.391  251.908   4.9745  254.502   5.0864 -2.594574 7.114631 
1 1 1    2   28    7 o   84.967   4.4662  151.233   15.523  159.287   21.022  141.574   23.021   87.531   5.8230   82.404   6.7734 5.127434 8.932308 
1 1 1    2   28    8 o  159.707   3.5659  530.051   23.455  548.483   32.697  510.513   33.664  162.604   4.8754  156.810   5.2051 5.793869 7.131805 
1 1 1    2   28    9 o  137.315   4.8663  392.126   27.498  371.164   37.388  416.826   40.585  133.353   6.7977  141.276   6.9651 -7.922760 9.732557 
1 1 1    2   28   10 o   93.087   6.6026  165.212   23.215  229.482   45.086  142.023   27.081  103.909   10.520   82.265   7.9816 21.64419 13.20519 
1 1 1    2   28   11 o   56.301   12.547   69.865   32.569   56.012   43.275   87.961   49.461   50.978   17.276   61.624   18.201 -10.64610 25.09462 
1 1 1    2   28   12 o   57.270   17.968   74.761   47.245   74.761   47.245   0.0000   0.0000   57.270   17.968  ?   ?       ?      ? 
1 1 1    2   28   13 f  101.541   8.2393  217.149   34.506  217.149   34.506   0.0000   0.0000  101.541   8.2393  ?   ?       ?      ? 
1 1 1    2   28   14 o   81.321   6.6175  139.562   21.721  182.499   32.284  104.051   29.360   92.899   8.4257   69.743   10.207 23.15574 13.23504 
1 1 1    2   28   15 o   60.586   7.9018   81.653   19.117   89.398   25.986   72.518   28.223   64.603   9.7526   56.568   12.435 8.035366 15.80361 
1 1 1    2   28   16 o   35.538   9.2139   23.167   17.893   15.583   24.897   31.268   25.732   32.444   12.738   38.632   13.317 -6.188370 18.42780 
1 1 1    2   28   17 o  151.032   4.9749  478.449   29.830  470.230   37.305  493.026   49.677  149.703   6.0418  152.361   7.9053 -2.658340 9.949704 
1 1 1    2   28   18 o   78.981   6.9697  132.306   22.419  165.174   34.508  108.302   29.489   87.393   9.5737   70.570   10.132 16.82333 13.93942 
1 1 1    2   28   19 o   50.099   9.2400   59.524   19.842   75.854   27.535   41.882   28.619   57.394   12.017   42.804   14.039 14.59034 18.48006 
1 1 1    2   28   20 o   48.164   7.2207   66.682   7.8738   69.581   8.1828   30.457   28.924   57.886   3.4274   38.442   14.029 19.44402 14.44146 
1 1 1    2   28   21 o   29.350   3.7131   20.302   4.0568   12.672   6.5951   24.946   5.1454   24.063   6.4944   34.638   3.6016 -10.57561 7.426204 
1 1 1    2   28   22 o   32.931   4.9312   22.854   5.2682   24.835   12.359   22.414   5.8238   33.127   8.8690   32.734   4.3136 0.3930702 9.862395 
1 1 1    2   28   23 o   19.130   5.0128   3.8868   5.2166   0.0143   6.3216   12.152   9.2354   14.184   6.0703   24.075   7.9790 -9.890914 10.02561 
1 1 1    2   28   24 f   77.366   2.5571  125.140   8.1334  119.544   11.814  130.181   11.214   75.677   3.7851   79.055   3.4392 -3.378021 5.114207 
1 1 1    2   28   25 o  123.247   2.6787  319.208   13.315  306.313   20.922  327.987   17.263  120.974   4.1933  125.521   3.3344 -4.547279 5.357424 
1 1 1    2   28   26 o   41.585   3.7931   36.630   6.5052   36.401   9.1301   36.866   9.2710   41.459   5.3394   41.712   5.3889 -0.2535706 7.586159 
1 1 1    2   28   27 o   24.225   6.0004   11.912   6.7228   12.490   7.6477   9.9433   14.102   23.809   7.1862   24.642   9.6113 -0.8330212 12.00082 
1 1 1    2   28   28 o   48.207   6.3359   54.709   12.019   38.701   17.598   68.702   16.453   40.224   10.497   56.191   7.0992 -15.96775 12.67187 
1 1 1    2   28   29 o   43.071   6.6562   43.654   11.489   41.818   16.564   45.356   15.950   41.997   9.7500   44.144   9.0641 -2.146324 13.31242 
1 1 1    2   28   30 o   22.019   5.9344   8.9878   7.1682   11.669   8.0758  -0.9690   15.563   23.077   7.4505   20.961   9.2390 2.116459 11.86880 
1 1 1    2   28   31 o   49.604   5.2233   53.831   9.3025   51.883   10.907   59.027   17.817   49.114   5.3845   50.093   8.9520 -0.9793167 10.44662 
1 1 1    2   28   32 o   23.191   6.4745   7.4486   7.9676   4.9398   9.1008   15.682   16.488   18.974   7.6181   27.409   10.471 -8.435024 12.94891 
1 1 1    2   28   33 f   19.080   6.0610  -0.3704   8.5368   1.2156   9.5857  -6.4512   18.769   17.352   7.4519   20.808   9.5610 -3.455679 12.12204 
1 1 1    2   28   34 o   48.247   6.1388   64.814   9.8958   75.131   11.604   37.296   18.950   59.094   4.7609   37.401   11.317 21.69252 12.27767 
1 1 1    2   28   35 o   37.263   6.3766   40.398   10.016   48.368   11.568   16.538   20.016   46.714   6.0041   27.811   11.251 18.90319 12.75311 
1 1 1    2   28   36 o   21.585   6.3433   7.4794   8.7212   10.148   9.8140  -2.5413   19.017   21.842   8.1363   21.329   9.7341 0.5126438 12.68666 
1 1 1    2   28   37 o   35.620   8.3074   36.819   14.114   34.058   19.053   40.176   21.012   34.436   11.463   36.803   12.027 -2.367458 16.61479 
1 1 1    2   28   38 o   22.816   7.2561   4.9375   10.797   3.9786   11.708   10.391   27.922   19.288   8.2581   26.343   11.933 -7.054754 14.51211 
1 1 1    2   28   39 o   37.399   10.807   59.988   26.209   52.195   34.739   70.283   39.930   35.773   14.690   39.025   15.855 -3.251820 21.61439 
1 1 1    2   29    0 f   90.124   1.9528  168.141   10.244  168.141   10.244  168.141   10.244   90.124   2.7616   90.124   2.7616 0.000000 0.000000 
1 1 1    2   29    1 o   78.423   2.6500  126.482   8.5223  134.712   12.903  120.113   11.350   80.661   3.8785   76.185   3.6122 4.475868 5.300089 
1 1 1    2   29    2 o   83.092   3.1584  141.319   9.8421  147.555   18.395  138.818   11.650   84.270   5.2927   81.914   3.4482 2.355530 6.316833 
1 1 1    2   29    3 f   90.547   3.2190  167.495   10.884  176.039   20.522  164.152   12.838   92.024   5.4069   89.070   3.4946 2.954735 6.437918 
1 1 1    2   29    4 o  233.237   3.7768  1126.31   36.332   0.0000   0.0000  1126.31   36.332  ?   ?   233.237   3.7768      ?      ? 
1 1 1    2   29    5 f  129.013   4.5234  343.911   21.885  355.308   40.768  339.297   25.939  130.197   7.5921  127.829   4.9199 2.367035 9.046783 
1 1 1    2   29    6 o  107.865   3.6223  242.249   16.059  248.485   21.993  235.126   23.505  109.394   4.8745  106.336   5.3594 3.057121 7.244548 
1 1 1    2   29    7 o  114.421   3.7169  272.456   17.479  275.632   23.817  268.750   25.730  115.186   5.0134  113.656   5.4889 1.529800 7.433839 
1 1 1    2   29    8 o  102.037   4.0999  218.482   17.121  241.684   23.747  193.366   24.706  107.798   5.3410   96.277   6.2219 11.52116 8.199877 
1 1 1    2   29    9 f  100.260   5.2133  212.446   21.379  235.942   29.664  187.050   30.840  106.204   6.7721   94.316   7.9279 11.88857 10.42659 
1 1 1    2   29   10 o   36.915   8.4615   29.012   14.858   33.574   19.866   23.223   22.382   39.084   11.533   34.746   12.385 4.338120 16.92301 
1 1 1    2   29   11 o   27.471   8.0943   4.6717   15.364   10.161   20.498  -2.3652   23.208   28.726   11.468   26.215   11.426 2.510931 16.18853 
1 1 1    2   29   12 o  177.511   5.0883  667.422   34.533  653.648   61.275  673.833   41.804  175.443   8.4680  179.579   5.6441 -4.136078 10.17654 
1 1 1    2   29   13 f   53.255   8.3141   65.257   17.785   75.287   24.092   53.245   26.365   58.296   10.402   48.214   12.973 10.08147 16.62820 
1 1 1    2   29   14 o  127.764   4.3022  342.215   22.645  336.942   31.188  348.095   32.932  126.767   5.9650  128.762   6.2011 -1.995331 8.604395 
1 1 1    2   29   15 o   79.642   5.7595  134.709   18.870  127.886   25.590  142.840   27.937   77.484   8.0074   81.799   8.2808 -4.314438 11.51906 
1 1 1    2   29   16 o   35.249   8.9596   21.504   17.810   3.7563   24.743   40.583   25.654   28.362   12.070   42.135   13.244 -13.77294 17.91921 
1 1 1    2   29   17 o   85.179   7.1813  158.770   25.201  158.420   34.835  159.154   36.503   85.196   9.9135   85.161   10.392 0.3490448E-01 14.36250 
1 1 1    2   29   18 o   40.276   9.6302   34.365   19.473   21.748   26.411   49.393   28.824   34.694   13.253   45.857   13.976 -11.16277 19.26040 
1 1 1    2   29   19 o   45.006   11.142   24.871   24.680   96.036   49.654   1.5202   28.442   60.729   18.307   29.282   12.706 31.44684 22.28379 
1 1 1    2   29   20 o   33.133   10.825 -19.2468   34.972  -5.8729   47.027 -35.7950   52.311   34.344   15.529   31.922   15.087 2.422258 21.65075 
1 1 1    2   29   21 o   76.405   4.6107  122.474   14.529  122.474   14.529   0.0000   0.0000   76.405   4.6107  ?   ?       ?      ? 
1 1 1    2   29   22 o   66.463   3.6276   92.111   9.9441   92.111   9.9441   0.0000   0.0000   66.463   3.6276  ?   ?       ?      ? 
1 1 1    2   29   23 o   48.777   4.0423   53.766   6.7632   44.154   13.495   56.990   7.8157   45.276   7.2265   52.277   3.6248 -7.001793 8.084639 
1 1 1    2   29   24 o   83.616   3.0697  145.266   10.153  141.881   12.614  151.492   17.108   82.435   3.7100   84.797   4.8917 -2.362427 6.139414 
1 1 1    2   29   25 o   49.683   3.1365   52.415   6.3518   48.015   9.4816   55.997   8.5552   47.685   4.8210   51.682   4.0135 -3.997181 6.273029 
1 1 1    2   29   26 o   88.108   3.5008  165.757   12.582  178.829   17.061  150.169   18.631   92.150   4.4889   84.066   5.3733 8.083344 7.001636 
1 1 1    2   29   27 o   40.249   3.9362   34.800   6.4948   37.226   8.9404   32.089   9.4508   41.836   5.1813   38.661   5.9269 3.174545 7.872353 
1 1 1    2   29   28 o   14.105   4.2338  -0.4284   4.5638  -6.0062   7.0739   3.5487   5.9733   12.272   5.7188   15.938   6.2446 -3.666016 8.467610 
1 1 1    2   29   29 o   22.409   5.6691   10.419   7.0292   14.779   8.0815  -3.1309   14.246   25.461   7.3110   19.357   8.6663 6.104485 11.33827 
1 1 1    2   29   30 o   32.169   6.8455   23.397   11.893   0.3714   17.620   42.666   16.119   22.327   9.8365   42.011   9.5228 -19.68370 13.69093 
1 1 1    2   29   31 o   45.157   5.6785   48.591   8.7159   50.110   10.062   44.027   17.442   48.281   5.0531   42.033   10.171 6.248096 11.35698 
1 1 1    2   29   32 o   24.230   6.6417   9.8495   7.8090   8.0446   8.6755   17.555   17.925   20.391   7.6391   28.068   10.867 -7.677618 13.28340 
1 1 1    2   29   33 o   30.972   6.1616   25.671   8.1935   29.393   9.3614   13.482   16.940   35.847   6.5741   26.097   10.423 9.749649 12.32329 
1 1 1    2   29   34 o   37.625   7.2285   41.362   10.076   43.908   10.675   20.578   30.500   44.554   5.8092   30.697   13.239 13.85614 14.45702 
1 1 1    2   29   35 o   40.306   8.2491   48.976   11.544   50.088   11.892   30.788   48.103   47.227   6.1051   33.384   15.327 13.84335 16.49829 
1 1 1    2   29   36 o   34.462   9.6924   38.769   20.630   37.252   28.818   40.364   29.545   34.014   13.592   34.910   13.821 -0.8952675 19.38487 
1 1 1    2   29   37 o   23.456   7.8080  -5.2770   19.350 -14.2568   26.097   5.6865   28.836   21.393   10.262   25.518   11.771 -4.125111 15.61597 
1 1 1    2   29   38 o   30.756   9.1668   28.262   20.599   11.524   28.678   46.103   29.608   26.346   11.996   35.167   13.864 -8.820787 18.33359 
1 1 1    2   30    0 o  164.827   2.8294  562.710   27.166  562.710   27.166  562.710   27.166  164.827   4.0014  164.827   4.0014 0.000000 0.000000 
1 1 1    2   30    1 o   26.578   4.5010   17.080   4.8001   8.3189   9.0848   20.473   5.6538   21.746   7.8735   31.410   4.3641 -9.664654 9.002093 
1 1 1    2   30    2 o   37.655   4.7705   34.263   6.2511   21.994   11.531   39.370   7.4392   31.741   8.5960   43.570   4.1397 -11.82920 9.540901 
1 1 1    2   30    3 o  175.556   3.6387  628.398   25.243  685.802   43.074  598.371   31.153  181.342   5.7591  169.770   4.4491 11.57158 7.277441 
1 1 1    2   30    4 o  106.103   3.5257  233.186   15.429   0.0000   0.0000  233.186   15.429  ?   ?   106.103   3.5257      ?      ? 
1 1 1    2   30    5 o  103.967   3.2205  224.842   13.773  221.362   20.140  227.899   18.877  103.178   4.7327  104.755   4.3690 -1.576180 6.441050 
1 1 1    2   30    6 f   56.174   5.1550   65.738   11.861   60.866   15.692   72.232   18.116   53.805   7.0713   58.543   7.5029 -4.738125 10.31003 
1 1 1    2   30    7 o   48.032   6.4566   50.638   12.248   53.103   15.920   47.063   19.172   50.139   7.6985   45.925   10.367 4.213955 12.91318 
1 1 1    2   30    8 o   31.319   7.7465   19.286   12.161   19.038   15.672   19.662   19.281   30.606   10.396   32.033   11.487 -1.426865 15.49293 
1 1 1    2   30    9 o   76.702   5.4505  124.044   17.126  145.118   25.001  105.410   23.509   82.917   7.3104   70.488   8.0863 12.42965 10.90094 
1 1 1    2   30   10 o   80.325   5.0290  136.247   16.627  137.449   22.863  134.897   24.225   80.764   6.8635   79.885   7.3524 0.8792114 10.05809 
1 1 1    2   30   11 o  102.632   4.4201  221.401   18.696  221.278   25.938  221.534   26.972  102.641   6.1271  102.624   6.3724 0.1670837E-01 8.840176 
1 1 1    2   30   12 o   69.993   10.421  115.221   29.825   81.735   41.558  150.786   42.828   57.881   16.567   82.105   12.647 -24.22489 20.84269 
1 1 1    2   30   13 o  131.517   4.1446  363.168   22.453  354.611   30.852  372.805   32.739  129.916   5.7578  133.118   5.9631 -3.201950 8.289165 
1 1 1    2   30   14 o   74.581   5.8110  118.781   17.835  111.105   24.273  127.787   26.293   71.988   8.1753   77.173   8.2606 -5.184540 11.62206 
1 1 1    2   30   15 o  124.538   4.3644  326.893   22.407  322.303   31.128  331.830   32.280  123.662   6.1031  125.415   6.2404 -1.752884 8.728705 
1 1 1    2   30   16 o   54.615   7.9630   68.173   17.634   81.667   24.726   54.206   25.155   61.136   9.8058   48.093   12.549 13.04347 15.92593 
1 1 1    2   30   17 o   38.463   10.005   31.111   20.908   25.664   28.694   37.278   30.530   36.251   13.822   40.675   14.468 -4.424019 20.00914 
1 1 1    2   30   18 o   46.365   8.9728   51.031   18.271   34.171   25.172   69.806   26.563   38.559   13.175   54.171   12.184 -15.61242 17.94568 
1 1 1    2   30   19 o   34.514   9.0994   24.038   17.677   31.191   24.156   15.791   25.937   37.142   12.897   31.885   12.840 5.257078 18.19872 
1 1 1    2   30   20 o   31.050   10.182 -29.7838   32.446 -67.3910   46.016   7.3998   45.756   26.167   12.798   35.932   15.840 -9.764881 20.36402 
1 1 1    2   30   21 f   51.511   9.2334   64.709   19.637   61.620   27.231   68.056   28.344   50.228   13.033   52.795   13.083 -2.567867 18.46672 
1 1 1    2   30   22 o   45.094   9.7538   50.523   19.837   51.365   27.965   49.671   28.145   45.459   13.746   44.729   13.841 0.7298813 19.50760 
1 1 1    2   30   23 o   39.574   7.2820   35.691   6.7380   35.842   6.9290   33.080   28.897   41.341   4.0637   37.806   13.986 3.535088 14.56393 
1 1 1    2   30   24 o   39.935   2.9705   33.859   4.7614   31.772   7.5279   35.250   6.1471   38.807   4.7033   41.063   3.6296 -2.256279 5.940968 
1 1 1    2   30   25 o   39.335   3.2368   32.155   5.2009   36.475   8.0661   29.081   6.8041   41.533   4.7087   37.136   4.4424 4.397282 6.473540 
1 1 1    2   30   26 o   44.646   3.2397   41.674   5.9309   46.888   8.9904   37.656   7.8918   47.079   4.6300   42.213   4.5328 4.866665 6.479493 
1 1 1    2   30   27 o   55.553   3.4209   66.957   7.5356   60.224   12.099   71.224   9.6318   52.962   5.5389   58.143   4.0164 -5.181030 6.841862 
1 1 1    2   30   28 o   15.687   4.5867   0.7721   5.1044   5.7126   7.2936  -3.9708   7.1462   18.319   6.9724   13.054   5.9612 5.265455 9.173375 
1 1 1    2   30   29 o   34.314   4.3584   25.846   6.0087   30.355   8.9502   22.147   8.1074   37.383   5.8048   31.245   6.5028 6.138390 8.716802 
1 1 1    2   30   30 o   20.759   5.1176   9.1516   5.3829   8.0546   8.1912   9.9854   7.1414   20.238   7.4535   21.281   7.0146 -1.042940 10.23515 
1 1 1    2   30   31 o   22.756   6.3321   6.1802   6.7009   19.247   16.920   3.7494   7.2976   28.621   10.679   16.890   6.8076 11.73039 12.66420 
1 1 1    2   30   32 o   36.111   6.5731   32.727   9.0503   33.195   10.448   31.320   18.116   37.898   6.9398   34.325   11.165 3.572838 13.14629 
1 1 1    2   30   33 o   33.832   9.3168   30.673   20.308   52.017   28.446   8.4901   29.001   40.290   13.995   27.374   12.302 12.91636 18.63359 
1 1 1    2   30   34 o   21.525   7.3955 -29.0043   21.073 -47.7326   30.998 -12.9114   28.734   19.881   9.8688   23.168   11.017 -3.286705 14.79100 
1 1 1    2   30   35 o   20.935   7.2190 -26.9121   20.307 -21.5562   28.194 -32.6854   29.272   21.405   10.366   20.466   10.050 0.9387016 14.43809 
1 1 1    2   30   36 o   20.980   7.2281 -24.0259   20.222 -33.4542   28.533 -14.5113   28.664   19.812   9.7672   22.149   10.658 -2.336067 14.45619 
1 1 1    2   31    0 o   77.734   2.3281  125.585   10.513  125.585   10.513  125.585   10.513   77.734   3.2924   77.734   3.2924 0.000000 0.000000 
1 1 1    2   31    1 o   40.097   3.4454   31.834   5.2267   37.762   9.8819   29.532   6.1586   42.485   5.6394   37.708   3.9599 4.777302 6.890856 
1 1 1    2   31    2 o   59.083   3.4916   75.916   7.6210   65.497   13.860   80.431   9.1241   55.894   6.0121   62.271   3.5525 -6.377110 6.983268 
1 1 1    2   31    3 o   32.967   5.9004   24.157   8.3084   32.550   11.632   15.414   11.871   38.589   7.5788   27.345   9.0455 11.24361 11.80082 
1 1 1    2   31    4 o   66.922   3.9602   93.049   10.931   0.0000   0.0000   93.049   10.931  ?   ?    66.922   3.9602      ?      ? 
1 1 1    2   31    5 o   79.663   3.7620  133.576   11.890  129.305   19.534  136.089   14.985   78.489   6.0341   80.837   4.4946 -2.347954 7.524050 
1 1 1    2   31    6 o   32.987   6.9226   24.363   10.293   29.152   13.412   17.502   16.054   36.172   9.0206   29.801   10.503 6.371239 13.84521 
1 1 1    2   31    7 o  108.276   3.7209  246.216   16.538  257.358   22.655  233.507   24.196  110.998   4.9487  105.554   5.5578 5.444138 7.441707 
1 1 1    2   31    8 o   60.020   5.4529   75.355   13.370   63.652   17.678   90.992   20.436   54.639   7.8446   65.400   7.5762 -10.76096 10.90582 
1 1 1    2   31    9 o   25.354   7.4201   1.2238   13.293 -10.6915   17.965   15.641   19.761   20.538   9.4064   30.170   11.478 -9.631611 14.84012 
1 1 1    2   31   10 o   66.396   5.8123   96.305   15.578  112.375   21.372   78.091   22.753   72.735   7.1243   60.056   9.1857 12.67904 11.62463 
1 1 1    2   31   11 o   32.985   7.8685   20.884   14.308   37.065   19.156   0.4653   21.519   40.264   11.152   25.706   11.103 14.55807 15.73691 
1 1 1    2   31   12 o   29.202   9.5553 -22.6849   27.267 -15.9154   38.064 -29.8194   39.077   30.076   13.744   28.327   13.279 1.749191 19.11050 
1 1 1    2   31   13 f   68.817   5.9634  101.516   16.881   93.972   22.906  110.484   24.973   66.042   8.4094   71.592   8.4574 -5.549881 11.92671 
1 1 1    2   31   14 o   31.258   8.4432   14.846   15.761   2.8189   21.429   29.020   23.263   26.138   11.181   36.378   12.655 -10.24084 16.88636 
1 1 1    2   31   15 f   64.534   6.6987   91.858   17.772   89.867   24.085   94.238   26.331   63.919   9.1360   65.149   9.7991 -1.230511 13.39736 
1 1 1    2   31   16 o   36.348   9.1119   28.974   17.092   25.807   23.305   32.660   25.142   34.802   12.609   37.895   13.157 -3.092701 18.22374 
1 1 1    2   31   17 o   33.803   9.3613   19.411   19.159   30.407   28.550   10.403   25.843   37.462   13.893   30.145   12.551 7.317186 18.72254 
1 1 1    2   31   18 o   24.718   7.9388  -9.7353   17.764  -3.0146   24.619 -17.0342   25.656   25.949   11.519   23.488   10.927 2.461029 15.87752 
1 1 1    2   31   19 o   32.037   8.9923   15.760   18.188   4.8742   25.579   26.892   25.866   28.436   12.191   35.638   13.222 -7.201889 17.98462 
1 1 1    2   31   20 o   44.803   11.020   49.777   23.566   49.452   27.720   50.624   44.754   44.546   13.729   45.059   17.242 -0.5128212 22.04012 
1 1 1    2   31   21 o   60.422   8.0906   87.872   19.436  117.969   27.780   59.014   27.202   72.474   9.2938   48.370   13.246 24.10381 16.18126 
1 1 1    2   31   22 o   75.396   6.5991  128.194   20.410  142.295   28.868  114.101   28.860   79.928   8.7571   70.863   9.8745 9.064644 13.19816 
1 1 1    2   31   23 o   25.181   8.0696  -6.1610   18.071  -6.1577   25.119  -6.1646   26.017   24.972   11.315   25.390   11.509 -0.4182167 16.13919 
1 1 1    2   31   24 o   44.038   9.6237   52.153   21.293   71.410   27.561   23.638   33.538   53.046   12.754   35.031   14.415 18.01525 19.24734 
1 1 1    2   31   25 o   91.329   5.1945  215.030   13.211  231.200   14.558  139.600   31.443  105.115   3.3580   77.543   9.8314 27.57104 10.38905 
1 1 1    2   31   26 o   39.406   4.8726   37.539   6.2247   29.731   12.975   39.873   7.0945   35.334   8.9059   43.478   3.9563 -8.143719 9.745143 
1 1 1    2   31   27 o   71.906   3.3203  107.598   9.4738  100.932   11.733  120.085   16.059   69.058   4.1193   74.755   5.2086 -5.696770 6.640684 
1 1 1    2   31   28 o   39.909   3.8512   36.032   5.9203   27.149   8.8031   43.366   7.9995   34.658   6.3939   45.159   4.2949 -10.50105 7.702475 
1 1 1    2   31   29 o   54.760   7.9814   79.119   15.151   80.650   17.370   74.247   30.981   59.778   7.0454   49.743   14.324 10.03445 15.96278 
1 1 1    2   31   30 o   29.486   8.8961   12.413   19.913  -4.9634   27.754   30.851   28.588   24.957   11.525   34.016   13.555 -9.059952 17.79226 
1 1 1    2   31   31 o   27.141   8.4662   6.6881   19.225   20.985   26.488  -9.2253   27.946   30.329   12.674   23.953   11.228 6.375317 16.93236 
1 1 1    2   31   32 o   20.873   7.1459 -26.3305   18.935 -11.2882   27.347 -40.1851   26.245   23.008   10.885   18.738   9.2618 4.270161 14.29183 
1 1 1    2   31   33 o   28.422   8.8706   15.395   20.372   11.434   28.383   19.605   29.259   27.409   12.255   29.435   12.829 -2.026281 17.74122 
1 1 1    2   31   34 o   25.029   8.7526 -36.9460   33.241 -66.0109   46.819  -7.4027   47.203   22.695   11.395   27.364   13.289 -4.668219 17.50524 
1 1 1    2   31   35 o   33.486   8.5448   18.698   19.890 -29.8147   26.694   79.250   29.823   19.476   9.5709   47.497   14.158 -28.02107 17.08965 
1 1 1    2   32    1 o   40.836   6.7259   33.621   8.4522   32.315   9.1178   41.594   22.535   39.220   5.6367   42.453   12.214 -3.233307 13.45186 
1 1 1    2   32    2 o   39.587   4.7751   36.965   7.2546   11.885   10.203   62.609   10.317   24.411   8.3870   54.763   4.5678 -30.35192 9.550212 
1 1 1    2   32    3 o   90.419   3.5518  172.212   13.092  163.118   19.775  179.308   17.469   88.166   5.4382   92.673   4.5704 -4.507126 7.103669 
1 1 1    2   32    4 o   45.827   4.4927   43.829   8.4916   0.0000   0.0000   43.829   8.4916  ?   ?    45.827   4.4927      ?      ? 
1 1 1    2   32    5 o  151.767   5.7136  484.217   35.764  484.217   35.764   0.0000   0.0000  151.767   5.7136  ?   ?       ?      ? 
1 1 1    2   32    6 o   56.533   4.1809   72.487   8.6821   54.561   15.216   81.140   10.572   50.649   7.2838   62.416   4.1067 -11.76685 8.361739 
1 1 1    2   32    7 o  106.467   3.6485  236.451   15.980  223.691   21.673  251.655   23.657  103.357   5.0840  109.577   5.2344 -6.220482 7.296958 
1 1 1    2   32    8 o   34.470   7.5062   26.742   11.863   31.005   15.614   20.921   18.246   37.009   9.9946   31.931   11.202 5.077787 15.01235 
1 1 1    2   32    9 o   80.868   5.0416  139.401   16.786  138.966   24.437  139.790   23.099   80.669   7.3448   81.068   6.9083 -0.3992691 10.08315 
1 1 1    2   32   10 o   56.780   6.6699   72.322   15.085   79.861   20.738   63.850   21.984   60.733   8.2789   52.827   10.460 7.905861 13.33971 
1 1 1    2   32   11 o   66.567   5.8432   96.308   15.956   96.597   21.523   95.956   23.775   66.860   7.8050   66.273   8.6979 0.5870132 11.68639 
1 1 1    2   32   12 o   41.308   9.9513   38.363   17.849   37.801   19.981   40.581   39.717   40.091   11.491   42.525   16.250 -2.434170 19.90251 
1 1 1    2   32   13 o   33.394   8.2646   22.662   15.037   35.796   20.635   7.7892   21.957   39.025   11.810   27.762   11.565 11.26336 16.52916 
1 1 1    2   32   14 o   43.066   8.4727   43.451   15.877   32.055   21.542   57.003   23.492   37.203   12.179   48.929   11.782 -11.72667 16.94530 
1 1 1    2   32   15 o   64.371   6.7553   92.366   16.962   65.927   22.931  124.317   25.208   53.186   10.821   75.555   8.0892 -22.36848 13.51065 
1 1 1    2   32   16 o   35.662   9.2798   22.564   17.902   10.450   22.424   43.856   29.728   28.774   11.807   42.550   14.319 -13.77595 18.55965 
1 1 1    2   32   17 o   29.229   8.5494   8.1311   17.427   20.532   24.385  -4.8160   24.916   32.848   12.687   25.609   11.464 7.239374 17.09880 
1 1 1    2   32   18 o   38.800   8.6801   31.290   18.164   2.3161   25.223   62.503   26.179   27.302   11.905   50.299   12.635 -22.99668 17.36026 
1 1 1    2   32   19 o   39.991   10.839   27.862   22.495   66.730   45.026   14.935   25.967   48.902   17.552   31.079   12.724 17.82285 21.67872 
1 1 1    2   32   20 o   99.311   5.4534  217.677   22.145  242.301   30.824  191.408   31.837  105.623   7.0756   92.999   8.3002 12.62448 10.90675 
1 1 1    2   32   21 o  108.894   5.1603  260.182   23.113  275.752   32.302  243.848   33.084  112.525   6.9601  105.262   7.6205 7.263214 10.32063 
1 1 1    2   32   22 o   38.116   9.4404   34.982   19.153   49.568   26.966   20.132   27.208   43.635   13.556   32.597   13.142 11.03799 18.88090 
1 1 1    2   32   23 o   35.873   9.4168   29.741   18.950   18.658   26.016   42.269   27.658   31.564   12.807   40.182   13.809 -8.618372 18.83356 
1 1 1    2   32   24 o   52.901   10.228   80.037   24.460  106.695   33.915   51.138   35.311   63.547   13.364   42.254   15.488 21.29287 20.45676 
1 1 1    2   32   25 o   30.198   8.9450   14.700   18.814   7.3467   25.631   23.291   27.704   27.666   12.033   32.731   13.239 -5.065903 17.89004 
1 1 1    2   32   26 o   91.490   4.7625  193.980   11.977  197.549   12.932  172.448   31.759   97.043   3.2309   85.936   8.9604 11.10746 9.525047 
1 1 1    2   32   27 o   31.962   10.402   9.2894   31.915   21.436   43.783  -4.4810   46.618   33.634   15.116   30.290   14.293 3.344715 20.80352 
1 1 1    2   32   28 o   57.379   8.3304   87.746   19.786   49.611   27.055  131.596   29.011   41.021   13.660   73.736   9.5394 -32.71529 16.66080 
1 1 1    2   32   29 o   24.981   8.0247  -4.5885   18.855   14.177   26.244 -24.6093   27.108   28.594   12.306   21.368   10.303 7.226385 16.04935 
1 1 1    2   32   30 o   37.865   9.7385   45.155   19.685   42.137   27.313   48.418   28.396   36.814   13.601   38.915   13.942 -2.100883 19.47709 
1 1 1    2   32   31 o   35.178   9.9764   34.853   24.708   67.699   34.622   0.7610   35.273   43.237   15.404   27.120   12.682 16.11706 19.95286 
1 1 1    2   32   32 o   25.353   8.2102   0.8280   19.830   17.877   28.327 -15.5564   27.769   28.564   12.531   22.142   10.611 6.421761 16.42040 
1 1 1    2   32   33 o   43.002   9.5887   63.182   19.775   46.579   27.526   80.890   28.427   36.317   13.607   49.687   13.514 -13.36957 19.17737 
1 1 1    2   32   34 o   23.468   7.8259  -4.8876   20.053   6.8232   27.374 -18.4495   29.458   25.171   11.559   21.765   10.553 3.406773 15.65179 
1 1 1    2   33    1 o  113.206   3.6209  239.251   13.288  222.706   14.572  320.951   32.381  103.479   3.4143  122.933   6.3864 -19.45390 7.241807 
1 1 1    2   33    2 o   38.177   3.6104   29.743   5.2932   33.108   9.6078   28.276   6.3426   39.563   5.8880   36.792   4.1798 2.771450 7.220780 
1 1 1    2   33    3 o  111.080   3.4198  259.446   15.436  255.910   23.874  261.986   20.234  110.257   5.2499  111.904   4.3839 -1.647011 6.839572 
1 1 1    2   33    4 o  145.729   3.3747  447.583   19.047  439.877   33.037  451.420   23.310  144.341   5.5494  147.116   3.8417 -2.774750 6.749439 
1 1 1    2   33    5 o   27.076   5.8564   15.475   6.7795   17.971   12.097   14.332   8.1860   28.646   9.1049   25.506   7.3682 3.139914 11.71280 
1 1 1    2   33    6 o   50.820   4.9878   60.307   8.5492   47.541   16.372   65.093   10.024   45.882   8.9728   55.757   4.3591 -9.875332 9.975625 
1 1 1    2   33    7 o   20.082   5.4718   6.5740   5.9939  -0.4600   12.832   8.5370   6.7788   19.715   8.5443   20.450   6.8380 -0.7352982 10.94368 
1 1 1    2   33    8 o   68.791   5.1749   95.818   14.231   76.717   17.710  130.627   23.908   59.742   7.1876   77.840   7.4469 -18.09831 10.34974 
1 1 1    2   33    9 o   82.884   4.7509  147.354   16.176  141.903   23.672  152.129   22.156   81.286   7.0607   84.482   6.3586 -3.196068 9.501858 
1 1 1    2   33   10 o   46.007   7.3016   48.492   13.518   40.231   18.169   58.734   20.231   41.480   10.585   50.534   10.060 -9.054573 14.60326 
1 1 1    2   33   11 o   60.556   6.1729   80.669   15.332   81.822   20.742   79.280   22.763   61.247   8.2112   59.865   9.2192 1.382698 12.34573 
1 1 1    2   33   12 o   42.102   9.8932   41.562   18.082   41.828   20.384   40.581   39.164   41.993   11.453   42.211   16.135 -0.2171898 19.78641 
1 1 1    2   33   13 o   54.424   7.3654   67.992   15.837   64.670   21.094   72.284   23.977   53.093   9.9998   55.756   10.817 -2.662937 14.73083 
1 1 1    2   33   14 o   64.579   6.2526   92.424   16.579   97.368   22.865   86.944   24.073   66.653   8.3175   62.505   9.3380 4.148098 12.50516 
1 1 1    2   33   15 o   91.228   4.9282  179.428   18.498  163.051   25.485  197.661   26.891   86.747   7.1231   95.709   6.8123 -8.961479 9.856324 
1 1 1    2   33   16 o   63.734   8.4826   95.072   21.500   56.056   28.371  147.702   32.951   46.843   13.771   80.626   9.9090 -33.78292 16.96514 
1 1 1    2   33   17 o   30.526   8.5445   10.305   17.251  -8.7607   23.391   33.043   25.545   23.686   10.804   37.367   13.240 -13.68116 17.08908 
1 1 1    2   33   18 o   38.099   9.0417   32.866   17.989   14.182   24.735   53.844   26.209   30.245   12.405   45.952   13.158 -15.70691 18.08334 
1 1 1    2   33   19 o   53.962   11.845   79.329   32.029  132.345   48.055   36.955   42.962   68.019   17.137   39.906   16.356 28.11227 23.68958 
1 1 1    2   33   20 o   30.103   8.6951   14.367   17.239   7.8884   23.966   21.314   24.817   27.846   11.866   32.361   12.713 -4.514570 17.39027 
1 1 1    2   33   21 o   45.372   9.0622   52.746   18.577   33.232   25.350   75.380   27.301   36.480   13.161   54.264   12.461 -17.78328 18.12432 
1 1 1    2   33   22 o   39.036   9.5456   40.805   18.923   46.212   25.594   34.286   28.104   41.451   13.251   36.621   13.743 4.830147 19.09125 
1 1 1    2   33   23 o   64.572   8.2192  105.205   21.238  113.587   29.251   95.862   30.884   68.784   10.311   60.360   12.803 8.424446 16.43835 
1 1 1    2   33   24 o   71.687   8.2684  130.983   23.493  124.093   35.436  136.385   31.379   68.143   13.084   75.230   10.113 -7.086655 16.53684 
1 1 1    2   33   25 o   78.816   6.4645  147.909   20.960  147.130   28.657  148.804   30.735   78.985   8.7966   78.646   9.4752 0.3390503 12.92904 
1 1 1    2   33   26 o   34.442   9.3017   29.994   19.613   11.411   27.885   48.188   27.591   28.555   12.482   40.328   13.794 -11.77263 18.60341 
1 1 1    2   33   27 o   31.482   9.1613   23.513   19.153   23.568   26.544   23.454   27.663   31.429   12.866   31.536   13.046 -0.1071453 18.32268 
1 1 1    2   33   28 o   27.869   8.5294   3.7480   19.486 -22.4805   26.354   35.381   28.942   21.137   10.183   34.601   13.686 -13.46388 17.05877 
1 1 1    2   33   29 o   29.290   8.8135   15.985   19.846   35.508   27.720  -4.5481   28.427   34.111   13.425   24.468   11.423 9.642704 17.62695 
1 1 1    2   33   30 o   31.217   9.1670   25.116   19.885   11.283   27.192   41.017   29.154   27.065   12.056   35.369   13.813 -8.304501 18.33394 
1 1 1    2   33   31 o   25.711   8.4351   3.9744   21.375  -1.1950   32.967   7.7235   28.075   25.484   12.024   25.938   11.834 -0.4537659 16.87013 
1 1 1    2   33   32 o   28.234   8.7702   18.724   19.785   8.1831   26.833   31.285   29.290   25.405   11.582   31.062   13.173 -5.657255 17.54046 
1 1 1    2   34    2 o   70.131   3.3672  102.405   9.7398   0.0000   0.0000  102.405   9.7398  ?   ?    70.131   3.3672      ?      ? 
1 1 1    2   34    3 o   42.959   3.6671   36.403   6.0486   45.999   11.237   32.488   7.1771   46.554   5.8523   39.364   4.4206 7.189392 7.334197 
1 1 1    2   34    4 o   89.007   3.2403  162.907   10.680  174.130   20.464  158.706   12.520   90.737   5.4681   87.276   3.4782 3.461609 6.480607 
1 1 1    2   34    5 f   17.849   5.1816   3.0127   5.9996  -5.3384   11.764   5.9487   6.9750   17.151   7.7597   18.547   6.8691 -1.396099 10.36324 
1 1 1    2   34    6 o   45.826   5.0919   48.988   7.8364   39.803   15.360   52.220   9.1114   41.748   9.1714   49.905   4.4267 -8.156963 10.18380 
1 1 1    2   34    7 f   20.670   5.7291   6.4709   6.2376   3.3549   13.773   7.2749   6.9962   21.795   9.1259   19.545   6.9288 2.249355 11.45817 
1 1 1    2   34    8 f   22.157   6.7129  -0.5391   10.652  -5.5578   13.300   8.4378   17.788   18.320   8.2730   25.994   10.574 -7.673973 13.42581 
1 1 1    2   34    9 o   55.399   6.1202   67.449   13.983   67.641   19.919   67.263   19.634   55.455   8.7087   55.343   8.6016 0.1125832 12.24046 
1 1 1    2   34   10 o   78.288   4.8404  131.921   15.561  132.063   21.075  131.751   23.075   78.490   6.5101   78.085   7.1649 0.4052658 9.680788 
1 1 1    2   34   11 o   28.479   8.9468  -1.7782   17.470   15.842   37.277  -6.7376   19.776   34.739   14.800   22.219   10.056 12.51967 17.89356 
1 1 1    2   34   12 o   39.739   9.9387   36.072   17.809   34.751   19.948   41.257   39.531   37.999   11.635   41.479   16.116 -3.480171 19.87739 
1 1 1    2   34   13 o   49.923   8.0212   61.036   16.115   67.972   21.453   52.055   24.413   54.060   9.9894   45.786   12.553 8.273743 16.04248 
1 1 1    2   34   14 o   66.535   6.3444   98.156   17.324   89.588   23.143  109.076   26.126   63.328   8.8606   69.741   9.0829 -6.413483 12.68890 
1 1 1    2   34   15 o   42.188   8.7755   43.693   16.414   34.690   22.103   54.761   24.508   37.672   12.337   46.703   12.484 -9.030441 17.55102 
1 1 1    2   34   16 o   64.258   8.6345  102.294   22.144  111.907   29.979   90.750   32.850   69.289   10.490   59.227   13.718 10.06192 17.26893 
1 1 1    2   34   17 o   47.497   8.7240   56.556   17.200   51.389   23.187   62.879   25.648   45.169   12.171   49.826   12.501 -4.657051 17.44790 
1 1 1    2   34   18 o   40.115   9.0714   41.593   17.221   48.072   23.460   34.024   25.358   43.268   12.466   36.962   13.182 6.305218 18.14283 
1 1 1    2   34   19 o   56.618   10.436   88.609   30.784  165.614   44.448   17.619   42.677   78.642   14.227   34.595   15.271 44.04693 20.87178 
1 1 1    2   34   20 o   82.988   5.8257  155.812   19.848  136.923   27.233  177.216   28.989   77.365   8.5347   88.612   7.9318 -11.24741 11.65133 
1 1 1    2   34   21 o   35.492   9.2042   31.152   17.699   22.736   23.535   42.107   26.851   31.750   12.408   39.235   13.599 -7.484999 18.40834 
1 1 1    2   34   22 o   57.081   7.9427   87.811   18.559  131.161   25.852   41.708   26.660   75.477   8.3044   38.686   13.542 36.79131 15.88549 
1 1 1    2   34   23 o   22.406   7.5845 -19.6848   18.988 -19.0225   23.576 -20.9074   32.032   20.772   9.9062   24.041   11.488 -3.268452 15.16892 
1 1 1    2   34   24 o   35.420   8.3070   21.619   18.442 -19.2896   25.162   69.100   27.108   21.439   10.227   49.401   13.093 -27.96175 16.61410 
1 1 1    2   34   25 o   22.609   7.5339 -13.1934   18.194 -11.6500   26.090 -14.6545   25.385   23.016   10.808   22.203   10.499 0.8130112 15.06776 
1 1 1    2   34   26 o   26.760   9.0159 -24.6891   28.210 -65.3502   38.795   20.937   41.095   21.440   10.706   32.079   14.509 -10.63924 18.03188 
1 1 1    2   34   27 o   28.713   8.7279   17.288   18.692   20.845   26.214   13.609   26.660   29.631   12.508   27.794   12.176 1.837219 17.45588 
1 1 1    2   34   28 o   25.672   8.2248   4.2363   18.891   13.490   27.251  -4.3246   26.211   27.684   12.213   23.660   11.020 4.023928 16.44957 
1 1 1    2   34   29 o   30.287   8.6000   17.735   19.234   51.356   27.162 -16.0758   27.239   38.822   13.664   21.752   10.447 17.07071 17.20007 
1 1 1    2   34   30 o   33.484   9.7448   30.505   22.193   4.9857   27.949   74.057   36.511   25.105   11.583   41.863   15.674 -16.75801 19.48956 
1 1 1    2   34   31 o   25.017   8.1133   6.2262   19.059   0.3902   26.822   12.178   27.087   23.823   11.113   26.210   11.824 -2.386829 16.22668 
1 1 1    2   35    2 o   45.399   3.5888   43.032   6.7199   43.032   6.7199   0.0000   0.0000   45.399   3.5888  ?   ?       ?      ? 
1 1 1    2   35    3 o   54.245   3.3605   61.248   6.8192   63.897   12.768   60.192   8.0659   54.813   5.6479   53.678   3.6433 1.135632 6.721032 
1 1 1    2   35    4 o   78.172   3.7454  128.289   11.990  140.053   18.324  119.480   15.857   81.204   5.4710   75.140   5.1165 6.063881 7.490733 
1 1 1    2   35    5 o   69.652   3.8078  101.524   10.939   0.0000   0.0000  101.524   10.939  ?   ?    69.652   3.8078      ?      ? 
1 1 1    2   35    6 o   70.721   3.6009  102.196   9.4927  114.741   18.176   97.491   11.132   73.235   6.0174   68.207   3.9569 5.028061 7.201811 
1 1 1    2   35    7 o  117.630   3.9178  290.186   18.716  318.309   29.646  271.550   24.133  122.065   5.8886  113.195   5.1692 8.870117 7.835605 
1 1 1    2   35    8 o   61.793   4.5133   84.488   10.134   76.538   19.072   87.615   11.962   59.077   7.8274   64.510   4.4959 -5.432861 9.026679 
1 1 1    2   35    9 o   94.816   4.3949  192.210   17.126  200.852   25.507  185.116   23.111   96.639   6.3993   92.993   6.0257 3.645889 8.789756 
1 1 1    2   35   10 o   27.708   7.4450   13.206   11.787   7.2707   15.430   21.522   18.265   24.080   9.8279   31.336   11.186 -7.255463 14.89010 
1 1 1    2   35   11 o   32.397   8.6804   21.301   17.652 -15.8273   34.612   34.353   20.522   27.262   12.686   37.531   11.852 -10.26879 17.36080 
1 1 1    2   35   12 o   32.823   9.5396   17.208   16.665   15.087   18.313   27.426   40.193   28.342   10.981   37.304   15.602 -8.962372 19.07912 
1 1 1    2   35   13 o   37.397   8.2657   34.598   14.845   44.843   19.919   21.798   22.264   42.754   11.172   32.040   12.185 10.71368 16.53145 
1 1 1    2   35   14 o   64.082   6.2943   93.559   16.436   98.171   22.054   87.797   24.650   66.388   8.0545   61.776   9.6745 4.611626 12.58856 
1 1 1    2   35   15 o   44.462   8.5913   49.672   16.188   42.095   21.581   59.421   24.479   40.699   12.023   48.226   12.275 -7.526939 17.18250 
1 1 1    2   35   16 o   79.475   6.4360  145.528   20.923  146.601   31.620  144.692   27.907   79.183   9.6819   79.767   8.4824 -0.5842667 12.87206 
1 1 1    2   35   17 o   81.758   5.6649  147.975   18.775  115.349   24.887  191.071   28.603   71.063   8.4910   92.452   7.5010 -21.38932 11.32973 
1 1 1    2   35   18 o   54.810   8.0579   77.352   17.899   95.696   24.607   56.741   26.084   63.941   9.3308   45.679   13.140 18.26205 16.11582 
1 1 1    2   35   19 o   44.522   9.4514   62.829   21.859   78.434   25.139   14.457   44.261   55.551   11.355   33.494   15.112 22.05697 18.90274 
1 1 1    2   35   20 o   57.643   8.0825   87.946   18.657  113.294   25.829   60.289   26.980   69.236   9.0449   46.051   13.398 23.18507 16.16503 
1 1 1    2   35   21 o   31.556   8.4605   17.430   17.344  -8.4120   23.702   47.220   25.448   22.696   10.540   40.416   13.238 -17.72021 16.92108 
1 1 1    2   35   22 o   55.501   8.3400   82.311   18.526   92.776   25.982   71.488   26.424   60.223   10.860   50.780   12.660 9.443687 16.68010 
1 1 1    2   35   23 f   31.763   9.5422   22.491   22.149   12.608   32.378   31.185   30.366   29.600   13.172   33.927   13.810 -4.327051 19.08444 
1 1 1    2   35   24 o   42.072   9.5240   54.357   19.072   64.539   26.840   43.973   27.106   46.382   13.325   37.762   13.611 8.620228 19.04808 
1 1 1    2   35   25 o   34.431   9.2774   35.221   18.751   46.578   26.628   24.049   26.409   38.296   13.524   30.567   12.704 7.729065 18.55478 
1 1 1    2   35   26 o   64.955   10.360  123.419   24.850  107.500   29.150  165.761   47.541   62.111   11.811   67.798   17.025 -5.687561 20.72071 
1 1 1    2   35   27 o   23.583   7.7132  -1.2768   17.776   4.0934   24.743  -7.0049   25.555   24.533   11.160   22.633   10.650 1.900032 15.42645 
1 1 1    2   35   28 o   21.583   7.2916 -12.7206   18.264 -19.5336   25.548  -5.5991   26.120   20.415   9.8819   22.752   10.725 -2.336864 14.58327 
1 1 1    2   35   29 o   24.108   7.8805   0.7680   18.792   14.304   26.480 -12.9667   26.673   26.599   11.869   21.617   10.370 4.981735 15.76099 
1 1 1    2   36    3 o   85.136   2.4406  151.426   8.5683  154.199   12.271  148.787   11.970   85.892   3.4638   84.379   3.4394 1.512886 4.881296 
1 1 1    2   36    4 o  103.061   3.4480  226.117   14.421  218.176   22.245  231.875   18.941  101.227   5.3280  104.894   4.3781 -3.666435 6.896077 
1 1 1    2   36    5 o   90.456   4.8690  173.379   18.165   0.0000   0.0000  173.379   18.165  ?   ?    90.456   4.8690      ?      ? 
1 1 1    2   36    6 o  140.607   5.7484  423.579   33.337  423.579   33.337   0.0000   0.0000  140.607   5.7484  ?   ?       ?      ? 
1 1 1    2   36    7 o   63.796   4.0626   86.093   9.3493   89.620   18.482   84.881   10.838   64.081   6.9929   63.511   4.1376 0.5699501 8.125287 
1 1 1    2   36    8 o   61.603   4.2340   77.759   9.5426   90.324   18.934   73.481   11.048   64.240   7.1462   58.966   4.5429 5.273911 8.467945 
1 1 1    2   36    9 o   58.520   4.4913   69.430   9.4816   84.231   19.392   64.779   10.869   61.757   7.6132   55.283   4.7670 6.474030 8.982514 
1 1 1    2   36   10 o   60.611   5.4456   82.994   13.286   93.222   17.832   70.232   19.918   65.451   6.6056   55.771   8.6592 9.680309 10.89110 
1 1 1    2   36   11 o   68.570   6.9499   94.353   17.888  151.813   35.537   74.854   20.701   79.772   10.801   57.368   8.7491 22.40409 13.89979 
1 1 1    2   36   12 o   39.282   9.3079   22.675   15.625   8.8590   17.341   82.323   36.030   25.156   10.360   53.408   15.467 -28.25204 18.61576 
1 1 1    2   36   13 o   46.521   7.8979   53.895   14.838   50.289   19.542   58.802   22.799   45.005   10.687   48.038   11.631 -3.033218 15.79578 
1 1 1    2   36   14 o   42.826   8.3303   45.883   15.296   34.402   20.072   61.788   23.623   36.653   11.737   48.998   11.825 -12.34543 16.66064 
1 1 1    2   36   15 o   45.314   8.3118   51.923   15.891   38.164   21.097   69.970   24.162   38.219   12.010   52.409   11.494 -14.18988 16.62365 
1 1 1    2   36   16 o   51.036   8.5156   68.742   17.713   60.226   25.550   76.623   24.579   47.104   12.812   54.969   11.221 -7.864830 17.03123 
1 1 1    2   36   17 o   26.251   7.7726   5.4479   15.680   23.901   21.174 -16.9556   23.331   31.389   11.896   21.112   10.007 10.27688 15.54524 
1 1 1    2   36   18 o   32.565   9.5494   25.518   20.721   10.919   40.581   30.666   24.100   31.237   14.242   33.893   12.725 -2.656433 19.09872 
1 1 1    2   36   19 o   23.012   7.5240  -7.1016   16.771  -9.2948   23.014  -4.6180   24.491   22.220   10.341   23.805   10.932 -1.585096 15.04808 
1 1 1    2   36   20 o   34.800   8.9962   33.143   16.878   28.683   23.387   37.990   24.382   32.985   12.502   36.614   12.940 -3.628700 17.99246 
1 1 1    2   36   21 o   53.003   8.4200   76.545   17.962   72.733   25.133   80.524   25.680   51.422   12.059   54.584   11.754 -3.162285 16.84010 
1 1 1    2   36   22 o   38.567   8.7516   42.345   18.046   15.716   25.503   69.047   25.538   28.296   12.153   48.837   12.596 -20.54112 17.50328 
1 1 1    2   36   23 o   47.621   9.9858   77.390   22.493   56.130   35.666   91.430   28.983   39.319   15.299   55.923   12.837 -16.60448 19.97158 
1 1 1    2   36   24 o   31.561   9.0845   28.090   18.631   23.600   25.955   32.862   26.761   30.118   12.562   33.003   13.126 -2.884487 18.16907 
1 1 1    2   36   25 o   28.487   9.2182   13.015   22.257   28.395   41.174   6.6655   26.456   31.484   14.351   25.489   11.574 5.995106 18.43647 
1 1 1    2   36   26 o   18.820   6.5362 -29.5987   17.532 -27.7876   24.683 -31.4426   24.906   18.991   9.3063   18.649   9.1805 0.3412743 13.07244 
1 1 1    2   36   27 o   22.288   7.4392  -7.0117   18.045   2.5306   25.372 -16.7793   25.669   23.856   11.017   20.720   9.9993 3.136299 14.87847 
1 1 1    2   37    3 o   69.479   3.4216  101.117   9.8048  101.117   9.8048   0.0000   0.0000   69.479   3.4216  ?   ?       ?      ? 
1 1 1    2   37    4 f   55.119   3.5954   68.165   7.1579   57.539   13.330   72.471   8.4850   51.448   6.2819   58.789   3.4993 -7.340820 7.190794 
1 1 1    2   37    5 o   67.870   3.4867   99.553   8.7611   94.993   16.274  101.414   10.396   66.249   5.9558   69.491   3.6273 -3.241989 6.973442 
1 1 1    2   37    6 o   44.368   5.0085   44.647   8.3811   41.932   14.203   46.097   10.381   42.425   8.4143   46.310   5.4350 -3.885124 10.01695 
1 1 1    2   37    7 o   89.067   4.0962  168.420   14.859  192.042   23.371  152.391   19.252   94.041   6.0255   84.093   5.5506 9.947914 8.192435 
1 1 1    2   37    8 o   41.702   5.6571   39.775   7.9979   39.950   16.739   39.723   9.1043   40.349   10.086   43.055   5.1270 -2.706200 11.31428 
1 1 1    2   37    9 o   34.374   6.0769   23.038   7.4982   40.038   16.123   18.347   8.4699   40.543   9.7595   28.205   7.2432 12.33771 12.15371 
1 1 1    2   37   10 o   63.445   5.1043   90.308   13.239   99.594   18.335   80.193   19.134   67.259   6.6095   59.631   7.7800 7.628735 10.20855 
1 1 1    2   37   11 o   28.529   8.6887   9.2693   15.590   20.658   33.713   6.1717   17.583   32.968   14.061   24.090   10.211 8.877344 17.37744 
1 1 1    2   37   12 o   25.336   7.8057   5.1013   15.185   12.115   17.821 -13.4841   29.010   26.257   10.619   24.416   11.444 1.840916 15.61135 
1 1 1    2   37   13 o   58.287   6.5837   81.135   15.385   91.532   22.095   71.350   21.434   62.762   8.5354   53.813   10.026 8.949554 13.16742 
1 1 1    2   37   14 o   24.577   7.6304   4.2137   14.796   3.4533   19.833   5.1680   22.218   23.866   10.477   25.289   11.096 -1.422333 15.26090 
1 1 1    2   37   15 o   28.985   8.1218   16.607   16.199   30.687   20.068  -9.7254   27.443   33.977   11.757   23.992   11.208 9.985151 16.24367 
1 1 1    2   37   16 o   36.612   8.8392   36.541   17.412   17.765   25.436   53.097   23.885   29.679   12.412   43.545   12.588 -13.86518 17.67834 
1 1 1    2   37   17 o   27.556   8.1526   12.832   15.663   5.8944   21.469   20.726   22.901   25.060   10.954   30.052   12.078 -4.992445 16.30526 
1 1 1    2   37   18 o   24.813   8.0765  -5.4324   19.942 -42.6075   36.665   10.186   23.765   22.834   11.220   26.793   11.620 -3.958506 16.15297 
1 1 1    2   37   19 o   33.494   8.8511   31.617   16.894   39.766   23.182   22.387   24.672   36.764   12.642   30.224   12.392 6.540365 17.70217 
1 1 1    2   37   20 o   24.975   7.9107   5.0814   16.802   5.9343   23.216   4.1432   24.348   25.011   11.140   24.939   11.234 0.7201004E-01 15.82137 
1 1 1    2   37   21 o   49.084   9.1369   71.930   18.782   65.225   25.926   79.336   27.246   46.358   13.022   51.810   12.820 -5.452728 18.27373 
1 1 1    2   37   22 o   25.375   8.2507   1.4145   18.962  -6.3128   23.790   14.873   31.397   22.273   10.415   28.477   12.799 -6.204012 16.50137 
1 1 1    2   37   23 o   28.836   8.6694   20.823   18.351   11.271   26.118   30.135   25.789   26.298   11.757   31.373   12.744 -5.075239 17.33874 
1 1 1    2   37   24 o   22.972   7.5619  -2.0601   17.514  -8.7194   24.875   4.4868   24.664   21.765   10.321   24.180   11.055 -2.415462 15.12379 
1 1 1    2   37   25 o   32.706   10.522   42.760   31.094   42.387   42.378   43.195   45.766   32.722   14.773   32.690   14.987 0.3201294E-01 21.04428 
1 1 1    2   38    4 o   22.346   3.8782   11.215   3.5478   10.723   5.1282   11.667   4.9135   21.846   5.6494   22.845   5.3147 -0.9992142 7.756471 
1 1 1    2   38    5 o   36.462   4.6551   32.044   6.0494   35.294   7.2419   24.540   11.004   40.758   4.3080   32.166   8.2536 8.592567 9.310254 
1 1 1    2   38    6 f   21.105   5.3573   5.9482   5.4312   16.899   11.020   2.4346   6.2420   26.914   8.7046   15.295   6.2475 11.61938 10.71459 
1 1 1    2   38    7 o   42.234   6.2456   42.308   10.761   54.867   15.667   31.093   14.805   49.117   7.7338   35.351   9.8090 13.76602 12.49112 
1 1 1    2   38    8 o   23.315   6.0271   6.7555   6.5295   22.493   14.509   2.7592   7.3117   30.267   9.9996   16.362   6.7315 13.90489 12.05428 
1 1 1    2   38    9 o   65.552   4.8903  104.290   10.779   80.737   21.331  112.368   12.492   58.454   8.8475   72.650   4.1690 -14.19556 9.780533 
1 1 1    2   38   10 o   37.694   7.6645   36.724   13.041   49.978   18.965   24.835   17.962   44.070   10.570   31.318   11.102 12.75210 15.32910 
1 1 1    2   38   11 o   37.796   7.1742   41.039   9.5338   18.925   30.355   43.460   10.042   30.935   13.272   44.656   5.4521 -13.72114 14.34835 
1 1 1    2   38   12 o   27.604   8.4337   10.461   14.615   8.5057   16.322   18.367   32.818   23.978   9.9783   31.230   13.599 -7.251818 16.86746 
1 1 1    2   38   13 o   30.377   7.8936   22.940   13.073   25.793   17.650   19.470   19.460   31.703   11.023   29.050   11.302 2.653055 15.78718 
1 1 1    2   38   14 f   29.675   7.6302   15.547   13.933  -5.4167   18.833   40.895   20.709   20.896   9.5924   38.455   11.869 -17.55902 15.26045 
1 1 1    2   38   15 o   38.673   9.1005   38.582   16.693   24.532   20.451   66.628   28.894   30.824   11.689   46.523   13.952 -15.69931 18.20098 
1 1 1    2   38   16 o   31.982   8.1852   22.682   15.252   3.5144   20.109   48.645   23.404   23.441   10.408   40.523   12.635 -17.08187 16.37040 
1 1 1    2   38   17 o   28.387   8.2820   18.591   15.577   18.180   20.422   19.162   24.087   27.943   11.344   28.830   12.070 -0.8871021 16.56401 
1 1 1    2   38   18 o   28.201   9.2839   0.3433   27.113   26.354   38.075 -26.4132   38.617   31.937   14.243   24.465   11.913 7.471596 18.56789 
1 1 1    2   38   19 o   23.152   7.4388  -4.2566   16.469   14.730   22.766 -25.1014   23.854   26.975   11.531   19.328   9.4004 7.647434 14.87752 
1 1 1    2   38   20 o   26.316   7.9817   7.0465   16.737 -14.5730   22.734   32.634   24.732   20.216   9.6649   32.417   12.705 -12.20054 15.96332 
1 1 1    2   38   21 o   36.829   8.3895   40.130   17.757   72.656   24.960   6.7963   25.268   48.735   12.390   24.923   11.314 23.81179 16.77907 
1 1 1    2   38   22 o   37.410   9.7352   52.318   20.579   59.281   26.408   41.550   32.839   41.398   13.481   33.422   14.048 7.975567 19.47050 
1 1 1    2   39    7 o   27.184   7.4561   16.445   11.897   20.819   13.597   2.1583   24.571   29.105   9.6830   25.262   11.341 3.843081 14.91227 
1 1 1    2   39    8 o   24.567   7.5943   5.9917   13.006   5.6335   14.990   7.0827   26.163   22.256   9.4301   26.879   11.906 -4.622547 15.18851 
1 1 1    2   39    9 o   25.173   6.2749   14.865   7.8262   8.8107   15.975   16.777   8.9772   23.807   9.8864   26.539   7.7303 -2.732277 12.54987 
1 1 1    2   39   10 o   36.811   7.8482   36.738   12.920   34.943   19.171   38.231   17.488   35.706   11.474   37.915   10.711 -2.208447 15.69647 
1 1 1    2   39   11 o   26.580   5.7521   19.201   8.1905  -8.6463   18.445   26.040   9.1412   19.792   9.2267   33.367   6.8711 -13.57552 11.50410 
1 1 1    2   39   12 o   31.511   6.6593   21.168   8.5677   38.456   16.822   15.113   9.9557   37.919   10.430   25.104   8.2826 12.81475 13.31869 
1 1 1    2   39   13 o   28.704   7.8398   20.075   13.020   16.004   16.979   25.885   20.284   26.518   10.485   30.891   11.659 -4.373077 15.67968 
1 1 1    2   39   14 o   29.504   7.6724   20.795   13.929   36.660   18.741   1.2166   20.820   36.047   11.318   22.962   10.362 13.08503 15.34482 
1 1 1    2   39   15 o   20.947   7.0767 -16.2696   14.945 -24.4013   17.777   3.3314   27.599   16.356   7.9901   25.538   11.682 -9.181875 14.15341 
1 1 1    2   39   16 o   47.554   8.1093   62.369   15.856   46.336   20.791   84.660   24.515   39.634   11.823   55.474   11.102 -15.84040 16.21857 
1 1 1    2   39   17 o   21.840   7.1414  -2.6840   15.072  -1.6451   20.073  -4.0268   22.821   21.564   9.9007   22.116   10.295 -0.5523090 14.28289 
1 1 1    2   39   18 o   31.693   9.8460   29.649   26.577   55.381   36.280  -0.1502   39.043   36.796   15.050   26.591   12.700 10.20532 19.69192 
1 1 1    2   39   19 o   24.785   7.7435   9.1522   15.953   17.834   21.682  -1.0966   23.558   26.918   11.370   22.651   10.515 4.266533 15.48706 
1 1 1    2   39   20 o   43.723   9.1948   63.018   17.755   61.557   23.927   64.808   26.485   43.857   12.576   43.590   13.417 0.2666702 18.38958 
1 1 1    3    0    1 o   56.820   1.6257   66.914   5.3680   66.914   5.3680   66.914   5.3680   56.820   2.2991   56.820   2.2991 0.000000 0.000000 
1 1 1    3    0    2 f  320.382   2.5876  2118.25   48.341  2118.25   48.341  2118.25   48.341  320.382   3.6594  320.382   3.6594 0.000000 0.000000 
1 1 1    3    0    3 o   82.981   2.3899  142.747   11.524  142.747   11.524  142.747   11.524   82.981   3.3798   82.981   3.3798 0.000000 0.000000 
1 1 1    3    0    4 o   96.661   2.4793  193.494   13.936  193.494   13.936  193.494   13.936   96.661   3.5062   96.661   3.5062 0.000000 0.000000 
1 1 1    3    0    5 o   37.175   2.5586   29.307   5.4274   29.307   5.4274   29.307   5.4274   37.175   3.6185   37.175   3.6185 0.000000 0.000000 
1 1 1    3    0    6 o   9.6252   4.2260   1.2380   4.7556   1.2380   4.7556   1.2380   4.7556   9.6252   5.9764   9.6252   5.9764 0.000000 0.000000 
1 1 1    3    0    7 o   95.252   2.8156  188.120   15.581  188.120   15.581  188.120   15.581   95.252   3.9819   95.252   3.9819 0.000000 0.000000 
1 1 1    3    0    8 o  269.039   2.4024  1493.69   37.686  1493.69   37.686  1493.69   37.686  269.039   3.3975  269.039   3.3975 0.000000 0.000000 
1 1 1    3    0    9 f  191.275   2.1073  755.196   23.498  755.196   23.498  755.196   23.498  191.275   2.9802  191.275   2.9802 0.000000 0.000000 
1 1 1    3    0   10 o  318.230   2.6553  2090.15   49.271  2090.15   49.271  2090.15   49.271  318.230   3.7551  318.230   3.7551 0.000000 0.000000 
1 1 1    3    0   11 o   60.689   4.0866   78.072   14.165   78.072   14.165   78.072   14.165   60.689   5.7793   60.689   5.7793 0.000000 0.000000 
1 1 1    3    0   12 o  158.057   2.1681  515.898   19.971  515.898   19.971  515.898   19.971  158.057   3.0661  158.057   3.0661 0.000000 0.000000 
1 1 1    3    0   13 o  457.388   3.4353  4318.15   91.626  4318.15   91.626  4318.15   91.626  457.388   4.8582  457.388   4.8582 0.000000 0.000000 
1 1 1    3    0   14 o  146.663   2.3134  444.335   19.768  444.335   19.768  444.335   19.768  146.663   3.2717  146.663   3.2717 0.000000 0.000000 
1 1 1    3    0   15 o  249.740   2.5027  1287.19   36.441  1287.19   36.441  1287.19   36.441  249.740   3.5394  249.740   3.5394 0.000000 0.000000 
1 1 1    3    0   16 o  368.310   3.0237  2799.30   64.938  2799.30   64.938  2799.30   64.938  368.310   4.2761  368.310   4.2761 0.000000 0.000000 
1 1 1    3    0   17 f  717.932   5.0295 10639.70  210.568 10639.70  210.568 10639.70  210.568  717.932   7.1128  717.932   7.1128 0.000000 0.000000 
1 1 1    3    0   18 o  368.419   4.2979  2802.92   92.303  2802.92   92.303  2802.92   92.303  368.419   6.0782  368.419   6.0782 0.000000 0.000000 
1 1 1    3    0   19 o  911.962   6.2510 17176.93  332.442 17176.93  332.442 17176.93  332.442  911.962   8.8403  911.962   8.8403 0.000000 0.000000 
1 1 1    3    0   20 o  293.224   2.7702  1774.54   47.361  1774.54   47.361  1774.54   47.361  293.224   3.9177  293.224   3.9177 0.000000 0.000000 
1 1 1    3    0   21 o   93.502   4.0661  182.457   21.983  182.457   21.983  182.457   21.983   93.502   5.7503   93.502   5.7503 0.000000 0.000000 
1 1 1    3    0   22 o  303.207   2.8374  1897.66   50.161  1897.66   50.161  1897.66   50.161  303.207   4.0127  303.207   4.0127 0.000000 0.000000 
1 1 1    3    0   23 o  337.761   2.9770  2354.99   58.631  2354.99   58.631  2354.99   58.631  337.761   4.2102  337.761   4.2102 0.000000 0.000000 
1 1 1    3    0   24 o  190.205   2.7979  747.429   31.011  747.429   31.011  747.429   31.011  190.205   3.9568  190.205   3.9568 0.000000 0.000000 
1 1 1    3    0   25 o  116.905   3.5698  283.694   24.238  283.694   24.238  283.694   24.238  116.905   5.0484  116.905   5.0484 0.000000 0.000000 
1 1 1    3    0   26 o  248.483   2.8276  1275.28   40.958  1275.28   40.958  1275.28   40.958  248.483   3.9988  248.483   3.9988 0.000000 0.000000 
1 1 1    3    0   27 o  107.414   4.7066  241.232   29.229  241.232   29.229  241.232   29.229  107.414   6.6562  107.414   6.6562 0.000000 0.000000 
1 1 1    3    0   28 o  113.215   3.6502  266.369   23.991  266.369   23.991  266.369   23.991  113.215   5.1622  113.215   5.1622 0.000000 0.000000 
1 1 1    3    0   29 o   18.557   8.3532   2.0079   19.879   2.0079   19.879   2.0079   19.879   18.557   11.813   18.557   11.813 0.000000 0.000000 
1 1 1    3    0   30 o  145.633   3.4058  439.527   28.859  439.527   28.859  439.527   28.859  145.633   4.8165  145.633   4.8165 0.000000 0.000000 
1 1 1    3    0   31 o   47.677   9.3817   56.982   22.570   56.982   22.570   56.982   22.570   47.677   13.268   47.677   13.268 0.000000 0.000000 
1 1 1    3    0   32 o  154.196   3.2442  492.463   29.120  492.463   29.120  492.463   29.120  154.196   4.5880  154.196   4.5880 0.000000 0.000000 
1 1 1    3    0   33 o   16.384   7.8376 -10.5837   22.079 -10.5837   22.079 -10.5837   22.079   16.384   11.084   16.384   11.084 0.000000 0.000000 
1 1 1    3    0   34 o   20.157   9.0461   3.1102   23.105   3.1102   23.105   3.1102   23.105   20.157   12.793   20.157   12.793 0.000000 0.000000 
1 1 1    3    0   35 o   15.826   7.7563 -20.3979   24.774 -20.3979   24.774 -20.3979   24.774   15.826   10.969   15.826   10.969 0.000000 0.000000 
1 1 1    3    0   36 o  121.729   7.9318  318.401   55.218  318.401   55.218  318.401   55.218  121.729   11.217  121.729   11.217 0.000000 0.000000 
1 1 1    3    0   37 o  102.070   6.2012  222.099   36.292  222.099   36.292  222.099   36.292  102.070   8.7698  102.070   8.7698 0.000000 0.000000 
1 1 1    3    0   38 o   96.658   7.4435  203.734   40.704  203.734   40.704  203.734   40.704   96.658   10.527   96.658   10.527 0.000000 0.000000 
1 1 1    3    0   39 o   34.404   11.783   38.344   27.599   38.344   27.599   38.344   27.599   34.404   16.664   34.404   16.664 0.000000 0.000000 
1 1 1    3    0   40 o   93.673   5.4897  187.775   29.521  187.775   29.521  187.775   29.521   93.673   7.7636   93.673   7.7636 0.000000 0.000000 
1 1 1    3    0   41 o   29.462   10.846   28.760   24.278   28.760   24.278   28.760   24.278   29.462   15.338   29.462   15.338 0.000000 0.000000 
1 1 1    3    0   42 o   18.100   8.5261  -4.8481   24.348  -4.8481   24.348  -4.8481   24.348   18.100   12.058   18.100   12.058 0.000000 0.000000 
1 1 1    3    0   43 o   16.325   8.0510 -22.8238   27.813 -22.8238   27.813 -22.8238   27.813   16.325   11.386   16.325   11.386 0.000000 0.000000 
1 1 1    3    0   44 o   21.923   9.5074   11.315   23.374   11.315   23.374   11.315   23.374   21.923   13.445   21.923   13.445 0.000000 0.000000 
1 1 1    3    0   45 f   16.070   7.9995 -27.7980   29.401 -27.7980   29.401 -27.7980   29.401   16.070   11.313   16.070   11.313 0.000000 0.000000 
1 1 1    3    0   46 o   17.699   8.3680  -3.9318   23.837  -3.9318   23.837  -3.9318   23.837   17.699   11.834   17.699   11.834 0.000000 0.000000 
1 1 1    3    0   47 o   17.181   8.1240  -3.4294   22.480  -3.4294   22.480  -3.4294   22.480   17.181   11.489   17.181   11.489 0.000000 0.000000 
1 1 1    3    0   48 o   24.465   9.9870   21.269   23.025   21.269   23.025   21.269   23.025   24.465   14.124   24.465   14.124 0.000000 0.000000 
1 1 1    3    0   49 o   22.224   9.8088   14.025   25.959   14.025   25.959   14.025   25.959   22.224   13.872   22.224   13.872 0.000000 0.000000 
1 1 1    3    0   50 o   15.905   7.9018 -19.9848   28.250 -19.9848   28.250 -19.9848   28.250   15.905   11.175   15.905   11.175 0.000000 0.000000 
1 1 1    3    1    0 o  288.834   2.4172  1721.61   40.710  1721.61   40.710  1721.61   40.710  288.834   3.4184  288.834   3.4184 0.000000 0.000000 
1 1 1    3    1    1 o  100.735   1.6576  209.260   6.8854  215.240   9.8226  203.483   9.6543  102.150   2.3314   99.321   2.3568 2.829185 3.315114 
1 1 1    3    1    2 o  217.509   2.0752  976.030   18.617  972.874   26.259  979.220   26.397  217.156   2.9319  217.863   2.9377 -0.7069702 4.150432 
1 1 1    3    1    3 o  347.714   2.9518  2499.19   42.038  2527.41   56.401  2463.92   63.056  349.945   3.9077  345.484   4.4252 4.461517 5.903590 
1 1 1    3    1    4 o  209.183   2.9221  903.050   25.211  902.208   35.608  903.896   35.699  209.085   4.1291  209.281   4.1358 -0.1952972 5.844179 
1 1 1    3    1    5 o  111.060   2.5405  254.356   11.634  261.609   16.629  247.401   16.283  112.611   3.5804  109.510   3.6052 3.100937 5.081000 
1 1 1    3    1    6 o  351.555   2.7921  2549.38   40.481  2565.27   57.694  2533.97   56.815  352.633   3.9668  350.477   3.9304 2.156494 5.584239 
1 1 1    3    1    7 o  422.907   4.1253  3693.19   70.581  3700.07   91.372  3683.02  111.139  423.432   5.2320  422.383   6.3796 1.049561 8.250620 
1 1 1    3    1    8 o  172.341   2.8755  607.019   20.327  669.892   30.781  558.395   27.069  180.177   4.1421  164.505   3.9896 15.67273 5.750960 
1 1 1    3    1    9 o  144.093   2.0237  428.351   12.027  426.813   17.015  429.887   17.002  143.835   2.8682  144.352   2.8557 -0.5171356 4.047455 
1 1 1    3    1   10 o  376.990   2.9609  2933.83   46.037  2930.51   65.004  2937.18   65.210  376.776   4.1831  377.203   4.1915 -0.4278259 5.921722 
1 1 1    3    1   11 o  278.705   2.8621  1602.56   32.885  1629.89   47.370  1577.13   45.689  280.995   4.0873  276.415   4.0076 4.579926 5.724234 
1 1 1    3    1   12 o  134.897   2.5213  375.562   14.025  384.614   19.855  366.546   19.815  136.520   3.5262  133.273   3.6047 3.247147 5.042622 
1 1 1    3    1   13 o  406.209   3.1505  3405.79   52.779  3423.52   75.142  3388.52   74.150  407.251   4.4735  405.167   4.4372 2.084259 6.300935 
1 1 1    3    1   14 o  150.225   2.3293  465.553   14.432  469.415   20.491  461.752   20.329  150.843   3.2936  149.607   3.2945 1.236465 4.658514 
1 1 1    3    1   15 o  393.092   3.1157  3186.77   50.494  3233.10   72.670  3143.52   70.212  395.852   4.4510  390.333   4.3612 5.518433 6.231493 
1 1 1    3    1   16 o  181.237   2.4663  677.615   18.434  678.086   25.898  677.132   26.243  181.301   3.4634  181.173   3.5121 0.1284180 4.932538 
1 1 1    3    1   17 o  353.919   3.2046  2589.92   46.581  2521.10   68.599  2648.79   63.451  349.538   4.7584  358.301   4.2937 -8.762665 6.409193 
1 1 1    3    1   18 o  196.410   2.9424  795.302   23.826  767.098   33.177  825.337   34.238  192.817   4.1718  200.003   4.1505 -7.186096 5.884778 
1 1 1    3    1   19 o  207.612   2.5910  888.510   22.172  869.371   30.707  909.359   32.049  205.279   3.6268  209.945   3.7012 -4.666183 5.181970 
1 1 1    3    1   20 o  286.395   2.7439  1692.24   32.409  1683.01   45.449  1701.79   46.226  285.602   3.8583  287.189   3.9026 -1.586853 5.487897 
1 1 1    3    1   21 o  103.027   3.9854  218.741   16.914  234.163   24.519  204.739   23.363  106.486   5.5827   99.569   5.6891 6.917351 7.970752 
1 1 1    3    1   22 o  426.314   3.8986  3753.69   68.550  3747.86   96.727  3759.56   97.163  425.983   5.5054  426.646   5.5216 -0.6627502 7.797297 
1 1 1    3    1   23 o  320.444   2.9093  2118.63   38.435  2156.58   55.318  2083.21   53.441  323.214   4.1497  317.674   4.0788 5.540466 5.818590 
1 1 1    3    1   24 o   77.917   4.6610  126.023   14.902  111.658   21.116  140.275   21.033   73.464   6.9690   82.370   6.1912 -8.905762 9.321899 
1 1 1    3    1   25 o   81.607   4.5038  137.838   15.152  133.600   21.486  142.032   21.373   80.354   6.4830   82.860   6.2538 -2.506348 9.007699 
1 1 1    3    1   26 o  159.454   3.0072  525.285   19.774  524.327   28.187  526.214   27.749  159.308   4.2898  159.600   4.2155 -0.2915039 6.014405 
1 1 1    3    1   27 o   83.599   5.3150  145.079   18.055  113.940   24.868  179.791   26.256   74.063   8.1410   93.134   6.8353 -19.07110 10.63003 
1 1 1    3    1   28 o  211.866   3.1508  937.327   27.132  862.905   41.079  994.914   36.135  204.283   4.8755  219.449   3.9924 -15.16681 6.301560 
1 1 1    3    1   29 o  139.503   3.3376  402.555   19.201  409.950   27.137  395.141   27.171  140.790   4.6733  138.216   4.7663 2.574310 6.675101 
1 1 1    3    1   30 o  168.303   3.6389  586.410   25.255  582.380   35.992  590.319   35.445  167.726   5.2029  168.879   5.0887 -1.153366 7.277702 
1 1 1    3    1   31 o   68.219   6.7900   97.282   19.040   96.867   25.867   97.774   28.130   68.098   9.2096   68.340   9.9800 -0.2420120 13.58001 
1 1 1    3    1   32 o   35.882   8.2832   23.233   15.534   41.956   21.872   4.1782   22.066   43.864   11.822   27.900   11.605 15.96432 16.56642 
1 1 1    3    1   33 o   39.103   9.4366   25.662   18.183   13.988   22.695   46.589   30.386   31.596   12.229   46.611   14.375 -15.01519 18.87314 
1 1 1    3    1   34 o   24.240   7.8996 -20.8223   18.666  -7.0734   23.515 -44.2416   30.690   25.498   11.292   22.981   11.050 2.517426 15.79924 
1 1 1    3    1   35 o   34.630   9.9740   7.1421   21.783   26.751   37.053  -3.2142   26.928   40.924   15.682   28.335   12.329 12.58889 19.94803 
1 1 1    3    1   36 o   41.078   9.4241   32.981   19.763   11.219   27.986   54.627   27.911   32.746   13.285   49.410   13.371 -16.66369 18.84828 
1 1 1    3    1   37 o   50.795   8.5977   57.601   18.431   34.656   25.613   82.241   26.542   40.415   13.283   61.175   10.920 -20.75950 17.19533 
1 1 1    3    1   38 o   95.534   6.1941  194.140   24.383  200.790   35.445  188.166   33.594   97.051   8.8551   94.016   8.6635 3.034691 12.38826 
1 1 1    3    1   39 o   72.176   7.1651  112.439   20.888  109.021   26.797  117.732   33.345   71.141   9.1327   73.211   11.043 -2.069763 14.33013 
1 1 1    3    1   40 o   37.444   8.8214   27.776   17.239   47.916   24.923   9.2990   23.871   45.325   12.780   29.563   12.163 15.76146 17.64287 
1 1 1    3    1   41 o   29.925   9.0496   6.2482   19.583  -0.2533   31.938   10.165   24.790   30.040   13.238   29.810   12.342 0.2300224 18.09926 
1 1 1    3    1   42 o   44.382   9.7650   46.136   19.314   38.402   24.335   59.302   31.750   40.189   12.929   48.575   14.638 -8.385471 19.52998 
1 1 1    3    1   43 o   37.740   9.9294   30.936   20.695   36.558   30.063   25.872   28.531   39.727   14.332   35.753   13.746 3.973312 19.85886 
1 1 1    3    1   44 o   44.214   8.8972   48.395   17.371   36.668   24.422   60.403   24.713   38.840   12.979   49.589   12.173 -10.74915 17.79446 
1 1 1    3    1   45 o   20.437   7.0922 -56.3387   20.307 -18.4090   29.646 -89.8699   27.874   24.659   11.561   16.214   8.2181 8.444981 14.18449 
1 1 1    3    1   46 o   24.549   7.7759  -5.4682   16.893   9.3155   23.551 -21.1352   24.245   27.780   11.798   21.317   10.132 6.463945 15.55171 
1 1 1    3    1   47 o   29.578   8.5192   16.624   16.396   13.855   23.434   19.279   22.948   28.747   11.959   30.409   12.136 -1.662472 17.03835 
1 1 1    3    1   48 o   24.119   7.5927  -1.2497   15.813   12.614   22.320 -15.2210   22.406   27.409   11.554   20.829   9.8534 6.579990 15.18532 
1 1 1    3    1   49 o   21.974   7.4075 -18.4710   18.599 -14.6992   26.681 -22.0364   25.941   22.701   10.743   21.247   10.202 1.454153 14.81495 
1 1 1    3    1   50 o   22.078   7.4924 -18.5324   19.703 -16.8186   26.864 -20.5277   28.985   21.943   10.495   22.213   10.696 -0.2706165 14.98485 
1 1 1    3    1   51 o   47.510   16.617   93.261   40.136   0.0000   0.0000   93.261   40.136  ?   ?    47.510   16.617      ?      ? 
1 1 1    3    2    0 o  334.360   2.6602  2307.15   51.866  2307.15   51.866  2307.15   51.866  334.360   3.7621  334.360   3.7621 0.000000 0.000000 
1 1 1    3    2    1 o  216.664   2.0709  968.415   18.505  962.063   26.017  974.918   26.325  215.945   2.9211  217.383   2.9361 -1.437454 4.141719 
1 1 1    3    2    2 o  543.843   3.8821  6108.65   87.075  6093.49  122.692  6124.02  123.598  543.165   5.4767  544.520   5.5034 -1.354858 7.764137 
1 1 1    3    2    3 o  351.854   3.1911  2553.94   46.278  2597.47   66.895  2513.99   64.090  354.723   4.5723  348.985   4.4527 5.737427 6.382202 
1 1 1    3    2    4 o  274.689   2.7353  1555.61   30.966  1588.15   44.838  1525.94   42.816  277.431   3.9186  271.947   3.8173 5.484009 5.470554 
1 1 1    3    2    5 o  320.232   3.0206  2115.71   39.895  2112.84   56.308  2118.60   56.532  320.015   4.2662  320.450   4.2773 -0.4351501 6.041138 
1 1 1    3    2    6 o  315.012   3.0013  2046.59   38.984  2072.89   55.905  2021.70   54.389  316.980   4.2761  313.044   4.2125 3.936310 6.002544 
1 1 1    3    2    7 o  208.119   2.4581  892.563   21.087  921.238   30.483  866.247   29.201  211.320   3.4974  204.917   3.4551 6.403229 4.916248 
1 1 1    3    2    8 o  262.014   2.7346  1416.39   29.549  1402.69   41.449  1430.56   42.137  260.726   3.8545  263.302   3.8801 -2.576263 5.469221 
1 1 1    3    2    9 o  154.044   2.0279  489.564   12.884  491.707   18.262  487.440   18.180  154.380   2.8682  153.709   2.8676 0.6712036 4.055817 
1 1 1    3    2   10 o  183.924   2.1146  697.890   16.040  690.435   22.523  705.560   22.847  182.928   2.9853  184.920   2.9956 -1.992416 4.229105 
1 1 1    3    2   11 o  423.213   3.7261  3699.43   65.036  3713.42   92.496  3685.75   91.464  424.002   5.2892  422.424   5.2497 1.577362 7.452166 
1 1 1    3    2   12 o  325.983   3.1457  2193.16   42.283  2170.10   59.013  2217.49   60.613  324.225   4.4131  327.741   4.4840 -3.516022 6.291394 
1 1 1    3    2   13 o  380.855   3.0171  2993.70   47.392  3001.59   67.238  2985.91   66.809  381.353   4.2749  380.357   4.2587 0.9963074 6.034151 
1 1 1    3    2   14 o  228.913   2.3810  1081.00   22.479  1075.11   31.607  1087.03   31.977  228.283   3.3569  229.544   3.3776 -1.261307 4.762020 
1 1 1    3    2   15 o  414.560   3.2268  3545.89   55.172  3557.96   78.337  3534.01   77.717  415.259   4.5738  413.860   4.5530 1.398651 6.453663 
1 1 1    3    2   16 o  324.075   2.8167  2166.63   37.646  2152.02   52.835  2181.69   53.654  322.966   3.9664  325.184   4.0005 -2.217651 5.633496 
1 1 1    3    2   17 o  540.204   4.5734  6024.29  101.886  5994.84  142.910  6054.74  145.296  538.865   6.4301  541.543   6.5051 -2.678528 9.146725 
1 1 1    3    2   18 o  180.905   2.7519  674.098   20.323  667.607   26.824  682.844   31.136  179.890   3.6154  181.920   4.1498 -2.029770 5.503770 
1 1 1    3    2   19 o  498.463   3.7380  5127.68   76.835  5091.29  107.471  5165.73  109.890  496.658   5.2465  500.268   5.3259 -3.610931 7.475992 
1 1 1    3    2   20 o   69.367   4.3588   99.621   12.437  104.493   17.266   94.365   17.931   71.138   5.8847   67.595   6.4317 3.543633 8.717616 
1 1 1    3    2   21 o  352.963   3.4806  2571.73   50.665  2590.14   72.229  2553.90   71.089  354.205   4.9441  351.722   4.9004 2.482758 6.961222 
1 1 1    3    2   22 o  150.251   3.3183  466.343   20.525  470.634   28.241  461.539   29.881  150.989   4.5349  149.512   4.8456 1.477219 6.636666 
1 1 1    3    2   23 o  453.631   3.5284  4249.48   66.005  4283.00   94.305  4217.30   92.413  455.380   5.0211  451.882   4.9584 3.497986 7.056716 
1 1 1    3    2   24 f  354.237   3.0846  2590.84   45.063  2609.04   64.244  2573.21   63.224  355.460   4.3821  353.014   4.3424 2.445465 6.169164 
1 1 1    3    2   25 o  145.710   3.0977  438.082   18.592  407.791   25.887  470.352   26.719  140.508   4.4670  150.911   4.2928 -10.40280 6.195310 
1 1 1    3    2   26 o   21.913   6.9916 -13.5076   13.877 -26.0119   19.629  -1.0121   19.622   18.932   9.0315   24.895   10.675 -5.962538 13.98329 
1 1 1    3    2   27 o  175.666   2.9830  637.491   21.610  628.381   30.314  646.905   30.815  174.390   4.2146  176.942   4.2225 -2.551178 5.965971 
1 1 1    3    2   28 o  148.197   3.5261  453.998   21.548  464.502   30.866  444.013   30.096  149.868   4.9935  146.526   4.9799 3.341446 7.052273 
1 1 1    3    2   29 o   73.793   5.1351  113.106   15.550   98.615   21.659  128.523   22.339   68.888   7.6231   78.699   6.8823 -9.810905 10.27024 
1 1 1    3    2   30 o   46.876   9.9799   35.566   21.511   13.399   26.190   81.527   37.711   33.031   13.034   60.720   15.117 -27.68873 19.95981 
1 1 1    3    2   31 o  204.004   3.9085  852.070   32.296  914.699   51.470  811.399   41.477  210.040   5.9413  197.968   5.0798 12.07262 7.816932 
1 1 1    3    2   32 f   35.471   8.8416   21.066   17.357   2.4819   25.535   37.028   23.665   29.273   12.350   41.669   12.656 -12.39585 17.68321 
1 1 1    3    2   33 o   43.736   8.9611   40.847   17.290   31.818   23.751   51.026   25.217   39.282   12.785   48.190   12.560 -8.908478 17.92212 
1 1 1    3    2   34 o   32.408   8.6099   12.725   16.924   30.315   23.659  -5.7048   24.218   38.557   12.770   26.259   11.552 12.29821 17.21989 
1 1 1    3    2   35 o   45.851   8.8786   44.173   19.392   13.374   27.421   74.987   27.427   33.307   13.275   58.394   11.794 -25.08738 17.75723 
1 1 1    3    2   36 o   49.125   9.2428   53.482   19.786   73.679   28.227   33.971   27.743   57.571   12.263   40.679   13.832 16.89198 18.48563 
1 1 1    3    2   37 o  102.207   4.7636  218.583   20.080  216.515   28.253  220.695   28.544  101.718   6.7344  102.695   6.7391 -0.9761734 9.527208 
1 1 1    3    2   38 o   43.217   10.344   40.809   21.960   35.727   33.568   44.611   29.034   41.887   15.139   44.547   14.100 -2.659973 20.68858 
1 1 1    3    2   39 o   55.987   9.6164   75.702   22.555   95.923   30.546   51.458   33.446   64.978   11.834   46.997   15.161 17.98144 19.23281 
1 1 1    3    2   40 o  130.806   3.8522  359.038   20.773  373.777   29.523  344.586   29.233  133.500   5.3619  128.112   5.5325 5.388123 7.704465 
1 1 1    3    2   41 o   26.180   8.0495   0.5604   16.234   3.0444   22.964  -1.9212   22.954   26.862   11.535   25.499   11.231 1.362928 16.09908 
1 1 1    3    2   42 o  120.928   4.2644  310.880   21.232  334.869   30.303  287.746   29.758  125.619   5.8489  116.238   6.2072 9.380630 8.528707 
1 1 1    3    2   43 o   22.820   7.4387 -19.3175   16.975   0.9060   24.163 -39.0248   23.853   26.659   11.637   18.981   9.2688 7.677509 14.87748 
1 1 1    3    2   44 o   29.193   8.9060   5.3194   18.997   13.129   30.886   0.5670   24.093   32.117   13.568   26.269   11.540 5.848352 17.81198 
1 1 1    3    2   45 o   31.784   9.3523   11.250   21.749   32.100   29.836 -12.3921   31.772   36.986   14.096   26.583   12.295 10.40365 18.70464 
1 1 1    3    2   46 o   24.182   8.1623 -26.7204   22.713 -19.4727   32.894 -33.3255   31.402   25.454   12.010   22.910   11.057 2.543705 16.32454 
1 1 1    3    2   47 o   34.005   8.8714   28.729   16.485   32.480   23.432   25.053   23.196   35.479   12.669   32.531   12.422 2.947701 17.74286 
1 1 1    3    2   48 o   42.396   8.7362   49.858   16.713   63.349   23.838   36.817   23.438   48.405   12.000   36.386   12.700 12.01861 17.47244 
1 1 1    3    2   49 o   23.063   7.5763  -8.7522   17.436 -17.2472   24.200   0.4184   25.144   21.189   10.086   24.938   11.308 -3.749556 15.15254 
1 1 1    3    2   50 o   30.642   9.1158   22.571   19.942   35.137   28.763   10.938   27.674   33.937   13.572   27.347   12.173 6.590813 18.23160 
1 1 1    3    2   51 o   26.389   8.9680  -7.3148   28.473 -10.7561   42.335  -4.4722   38.476   26.396   12.763   26.381   12.602 0.1486206E-01 17.93605 
1 1 1    3    3    0 o  629.238   4.4059  8175.50  161.673  8175.50  161.673  8175.50  161.673  629.238   6.2309  629.238   6.2309 0.000000 0.000000 
1 1 1    3    3    1 o  336.898   2.6746  2342.25   37.164  2341.64   52.548  2342.87   52.567  336.854   3.7823  336.942   3.7826 -0.8807373E-01 5.349154 
1 1 1    3    3    2 o  285.669   2.4060  1682.65   28.332  1652.69   39.289  1715.12   40.895  283.023   3.3658  288.316   3.4390 -5.293030 4.811989 
1 1 1    3    3    3 o  158.215   2.3880  505.466   15.031  557.043   25.304  477.346   18.684  164.312   3.7338  152.118   2.9780 12.19420 4.775970 
1 1 1    3    3    4 o  190.081   2.2996  743.905   18.004  719.745   24.700  771.294   26.299  186.795   3.2061  193.367   3.2975 -6.572098 4.599197 
1 1 1    3    3    5 o  259.773   2.5044  1391.20   26.536  1386.58   34.993  1397.46   40.708  259.270   3.2723  260.276   3.7921 -1.005157 5.008797 
1 1 1    3    3    6 o  500.392   4.7300  5148.70   94.794  5083.94  120.082  5255.80  154.421  496.299   5.8664  504.486   7.4215 -8.186737 9.460062 
1 1 1    3    3    7 o  136.025   1.9462  381.660   10.918  380.507   15.375  382.832   15.507  135.818   2.7447  136.232   2.7598 -0.4141541 3.892322 
1 1 1    3    3    8 o  367.712   3.3464  2791.26   50.751  2787.42   71.680  2795.11   71.866  367.459   4.7296  367.965   4.7353 -0.5056763 6.692719 
1 1 1    3    3    9 o   70.863   2.3334  103.699   6.8138   99.158   9.6701  108.177   9.6026   69.319   3.3823   72.406   3.2155 -3.086288 4.666832 
1 1 1    3    3   10 o  248.397   2.7008  1273.52   27.669  1271.83   39.210  1275.19   39.051  248.232   3.8297  248.561   3.8092 -0.3288574 5.401551 
1 1 1    3    3   11 o  242.969   2.3441  1218.07   23.489  1209.29   33.013  1227.08   33.429  242.082   3.3064  243.856   3.3237 -1.773331 4.688240 
1 1 1    3    3   12 o  445.461   3.6212  4104.90   66.166  4025.66   98.365  4170.39   89.419  441.494   5.4019  449.429   4.8240 -7.934418 7.242341 
1 1 1    3    3   13 o  415.940   3.2140  3570.38   55.128  3544.05   77.148  3597.84   78.803  414.376   4.5140  417.503   4.5763 -3.127502 6.428013 
1 1 1    3    3   14 o  471.838   3.5335  4594.59   68.764  4606.12   97.590  4583.23   96.908  472.425   5.0085  471.251   4.9859 1.174011 7.067091 
1 1 1    3    3   15 o  354.510   2.9267  2592.74   42.790  2582.57   60.154  2603.16   60.882  353.807   4.1223  355.213   4.1556 -1.406555 5.853376 
1 1 1    3    3   16 o  258.167   2.5775  1374.98   27.444  1371.52   38.657  1378.50   38.969  257.840   3.6351  258.494   3.6551 -0.6544495 5.154977 
1 1 1    3    3   17 o  272.885   3.0354  1536.11   34.160  1561.93   48.707  1511.12   47.921  275.142   4.2921  270.629   4.2933 4.512604 6.070765 
1 1 1    3    3   18 o  153.658   2.5895  486.934   16.402  510.571   23.426  464.202   22.973  157.316   3.6104  150.001   3.7132 7.315247 5.179083 
1 1 1    3    3   19 o  456.814   4.0549  4307.86   76.397  4294.46  107.593  4321.49  108.497  456.099   5.7195  457.530   5.7495 -1.430878 8.109882 
1 1 1    3    3   20 o  286.165   2.7346  1689.70   32.275  1702.20   45.724  1677.28   45.563  287.221   3.8598  285.110   3.8747 2.110870 5.469134 
1 1 1    3    3   21 o  143.673   2.8118  425.659   16.652  446.710   23.892  405.773   23.222  147.126   3.9374  140.221   4.0153 6.905380 5.623673 
1 1 1    3    3   22 o  154.381   2.9885  489.295   18.848  510.653   28.972  473.622   24.817  157.277   4.4663  151.484   3.9721 5.793213 5.977084 
1 1 1    3    3   23 o  120.997   3.2928  301.744   16.397  274.657   22.697  331.309   23.713  115.325   4.7718  126.670   4.5388 -11.34496 6.585643 
1 1 1    3    3   24 o  199.535   2.8204  821.935   23.211  828.179   32.968  815.799   32.683  200.286   3.9909  198.784   3.9864 1.502350 5.640836 
1 1 1    3    3   25 o  181.080   2.9181  676.375   21.774  717.808   31.331  637.669   30.283  186.441   4.0745  175.719   4.1784 10.72162 5.836162 
1 1 1    3    3   26 o  191.242   3.7484  754.027   28.568  747.136   35.949  765.835   47.061  190.131   4.5843  192.352   5.9319 -2.221603 7.496891 
1 1 1    3    3   27 o  138.642   3.5471  396.475   20.099  404.825   30.698  390.210   26.591  139.893   5.3204  137.392   4.6925 2.501328 7.094105 
1 1 1    3    3   28 o  144.415   3.5471  431.778   21.101  407.746   29.896  455.634   29.787  140.394   5.1629  148.435   4.8654 -8.041397 7.094198 
1 1 1    3    3   29 o   57.033   6.8059   67.934   15.451   53.541   20.634   86.307   23.313   49.699   10.400   64.366   8.7814 -14.66705 13.61174 
1 1 1    3    3   30 o  129.288   3.4718  345.911   18.472  377.216   26.422  315.981   25.835  135.025   4.7445  123.551   5.0699 11.47336 6.943653 
1 1 1    3    3   31 o  190.007   3.3283  738.745   25.697  793.958   40.524  701.613   33.233  195.835   5.0171  184.180   4.3748 11.65553 6.656588 
1 1 1    3    3   32 o   42.280   8.6120   38.612   15.852   41.032   22.488   36.222   22.349   43.443   12.101   41.117   12.256 2.326050 17.22396 
1 1 1    3    3   33 o   69.536   6.0284  100.966   17.284  102.718   24.829   99.319   24.074   70.114   8.5859   68.957   8.4646 1.157059 12.05681 
1 1 1    3    3   34 o   87.925   5.1198  161.099   18.559  158.780   26.502  163.331   25.999   87.289   7.3612   88.561   7.1178 -1.271881 10.23963 
1 1 1    3    3   35 o   33.158   8.9621   10.538   18.416  -8.5300   25.023   33.071   27.201   25.952   11.562   40.363   13.697 -14.41077 17.92427 
1 1 1    3    3   36 o   41.388   9.2202   36.429   17.983   46.890   25.278   25.708   25.589   45.917   12.844   36.859   13.231 9.057976 18.44038 
1 1 1    3    3   37 o   33.805   9.0711   13.677   18.652  -4.6520   25.570   34.521   27.268   27.015   11.877   40.596   13.714 -13.58085 18.14214 
1 1 1    3    3   38 o   95.805   4.9711  193.831   19.596  181.550   27.990  205.637   27.445   92.737   7.3180   98.873   6.7300 -6.136734 9.942110 
1 1 1    3    3   39 o   82.276   6.8996  145.999   23.336  134.057   31.532  160.460   34.700   78.593   9.7275   85.959   9.7874 -7.365707 13.79919 
1 1 1    3    3   40 o   95.800   4.8795  194.619   19.258  182.763   27.035  206.834   27.440   92.774   7.0653   98.826   6.7320 -6.051926 9.759038 
1 1 1    3    3   41 o   31.767   8.7969   17.461   16.760   17.200   23.890   17.713   23.518   31.735   12.472   31.799   12.410 -0.6317520E-01 17.59386 
1 1 1    3    3   42 o   69.784   6.8496  108.526   19.693  106.637   28.331  110.291   27.393   69.055   9.9473   70.512   9.4192 -1.457314 13.69926 
1 1 1    3    3   43 o   43.232   8.6105   44.521   17.320   22.469   24.452   66.726   24.537   33.517   12.764   52.948   11.560 -19.43062 17.22105 
1 1 1    3    3   44 o   32.160   9.1317   17.675   18.676   10.847   26.425   24.490   26.398   30.004   12.606   34.316   13.215 -4.311361 18.26334 
1 1 1    3    3   45 o   31.486   8.7539   17.482   17.180   30.214   24.841   5.8103   23.785   35.731   13.007   27.241   11.719 8.490076 17.50780 
1 1 1    3    3   46 o   36.659   9.6521   30.116   21.341   54.652   30.254   5.8191   30.107   44.278   14.430   29.040   12.823 15.23817 19.30428 
1 1 1    3    3   47 o   45.402   9.0140   58.219   18.746   36.569   29.125   73.532   24.494   37.014   13.970   53.790   11.395 -16.77524 18.02803 
1 1 1    3    3   48 o   24.519   7.9805 -10.3310   19.899   10.565   25.944 -40.1842   31.010   27.814   12.102   21.224   10.407 6.590284 15.96109 
1 1 1    3    3   49 o   24.375   7.8444  -0.8028   17.257  -0.4017   23.366  -1.2843   25.598   24.054   10.904   24.696   11.280 -0.6425877 15.68877 
1 1 1    3    3   50 o   32.378   10.129   26.066   27.748   3.9495   40.909   44.913   37.763   28.726   13.504   36.030   15.100 -7.303463 20.25785 
1 1 1    3    3   51 o   29.142   9.5807   15.077   27.796   16.884   40.213   13.424   38.464   29.504   13.711   28.780   13.386 0.7238045 19.16143 
1 1 1    3    4    0 o  264.167   2.2971  1439.99   35.383  1439.99   35.383  1439.99   35.383  264.167   3.2486  264.167   3.2486 0.000000 0.000000 
1 1 1    3    4    1 o  421.169   3.1501  3660.15   54.719  3669.79   77.655  3650.64   77.117  421.719   4.4646  420.619   4.4453 1.100464 6.300207 
1 1 1    3    4    2 o  261.751   2.4801  1406.97   26.340  1448.25   41.398  1378.89   34.143  264.955   3.7883  258.546   3.2018 6.408569 4.960127 
1 1 1    3    4    3 o  372.251   3.3228  2859.05   51.016  2852.56   71.917  2865.63   72.379  371.826   4.6895  372.676   4.7089 -0.8503418 6.645691 
1 1 1    3    4    4 o  436.077   3.2492  3923.36   58.439  3933.33   82.936  3913.52   82.358  436.627   4.6054  435.527   4.5848 1.100067 6.498464 
1 1 1    3    4    5 o  151.389   2.4462  475.411   15.054  489.524   19.852  456.313   23.093  154.051   3.1244  148.726   3.7647 5.325714 4.892366 
1 1 1    3    4    6 o  436.004   4.2021  3933.07   74.418  3973.72   97.409  3876.07  115.332  438.760   5.3828  433.247   6.4543 5.513367 8.404280 
1 1 1    3    4    7 o   91.202   1.9943  171.599   7.5012  173.457   10.599  169.734   10.618   91.697   2.8024   90.707   2.8382 0.9898529 3.988562 
1 1 1    3    4    8 o  467.897   3.7410  4521.25   71.435  4519.21   94.416  4523.97  109.247  467.824   4.8933  467.969   5.6601 -0.1439819 7.482042 
1 1 1    3    4    9 o  228.314   2.4266  1074.94   22.581  1080.82   34.748  1070.64   29.710  228.843   3.6815  227.785   3.1623 1.057205 4.853218 
1 1 1    3    4   10 o  120.179   2.4183  297.534   11.976  311.620   17.373  284.780   16.532  122.884   3.4278  117.473   3.4121 5.410843 4.836538 
1 1 1    3    4   11 o  260.271   2.4113  1397.81   25.884  1403.96   36.739  1391.76   36.474  260.838   3.4150  259.703   3.4051 1.135223 4.822583 
1 1 1    3    4   12 o  407.669   3.1528  3427.41   52.960  3362.98   73.032  3498.87   76.911  403.638   4.3869  411.700   4.5294 -8.061798 6.305583 
1 1 1    3    4   13 o  542.323   4.5473  6074.71  101.710  6059.37  143.251  6090.31  144.435  541.635   6.4125  543.011   6.4491 -1.376221 9.094547 
1 1 1    3    4   14 o  602.155   4.2986  7484.65  106.755  7464.75  150.364  7504.87  151.592  601.350   6.0625  602.961   6.0957 -1.610901 8.597149 
1 1 1    3    4   15 o   71.272   3.5503  104.733   10.432  101.571   14.493  108.132   15.027   70.157   5.0085   72.388   5.0333 -2.230492 7.100659 
1 1 1    3    4   16 o  572.421   4.7829  6765.66  112.915  6794.02  160.566  6737.91  158.820  573.605   6.7869  571.236   6.7410 2.368835 9.565757 
1 1 1    3    4   17 o  224.418   2.5055  1038.95   23.190  1036.19   32.658  1041.76   32.936  224.117   3.5330  224.719   3.5536 -0.6015930 5.011022 
1 1 1    3    4   18 o  242.822   2.5717  1216.26   25.752  1206.63   36.040  1226.31   36.809  241.841   3.6131  243.804   3.6605 -1.962387 5.143390 
1 1 1    3    4   19 o  111.022   3.5465  254.112   16.229  267.341   23.361  241.775   22.561  113.812   4.9767  108.232   5.0541 5.580040 7.093061 
1 1 1    3    4   20 o  220.333   2.9719  999.902   26.965  1035.18   39.477  969.045   36.920  223.966   4.2736  216.699   4.1309 7.267273 5.943714 
1 1 1    3    4   21 o  272.815   2.7164  1535.87   30.564  1548.80   43.433  1523.18   43.019  273.953   3.8439  271.678   3.8392 2.274445 5.432783 
1 1 1    3    4   22 o  467.986   3.8977  4510.84   73.994  4452.46   96.009  4596.24  116.122  464.335   5.0132  471.637   5.9696 -7.301514 7.795368 
1 1 1    3    4   23 o  225.209   3.1829  1045.89   29.525  1022.28   40.536  1072.57   43.090  222.511   4.4170  227.908   4.5841 -5.397263 6.365801 
1 1 1    3    4   24 f  308.168   3.5873  1954.40   42.649  1984.00   75.282  1940.41   51.756  309.779   5.8922  306.557   4.0934 3.221130 7.174502 
1 1 1    3    4   25 o  253.467   2.9897  1326.61   31.073  1324.11   41.737  1329.71   46.543  253.221   3.9963  253.714   4.4478 -0.4928131 5.979388 
1 1 1    3    4   26 o   34.665   8.1432   19.839   15.365   40.156   21.469  -1.4921   21.998   43.109   11.752   26.221   11.275 16.88733 16.28642 
1 1 1    3    4   27 o  153.152   3.0718  484.415   19.397  501.415   27.793  468.270   27.085  155.771   4.3259  150.532   4.3624 5.239120 6.143625 
1 1 1    3    4   28 o  250.211   3.0303  1293.94   31.044  1293.67   41.477  1294.28   46.812  250.215   4.0191  250.207   4.5362 0.8621216E-02 6.060551 
1 1 1    3    4   29 o   33.571   7.1045   1.0127   16.615 -61.8910   24.595   53.818   22.535   17.431   8.6756   49.710   11.253 -32.27905 14.20907 
1 1 1    3    4   30 o  100.396   4.0022  209.179   16.526  227.712   23.420  190.799   23.324  104.852   5.4156   95.940   5.8943 8.912666 8.004456 
1 1 1    3    4   31 o   38.329   8.9746   29.766   17.100   15.740   27.017   39.141   22.088   34.138   13.307   42.520   12.046 -8.381592 17.94929 
1 1 1    3    4   32 o   57.441   8.2751   80.197   18.462  102.454   23.206   41.819   30.472   70.115   8.0246   44.768   14.475 25.34711 16.55015 
1 1 1    3    4   33 o   48.197   8.3762   51.112   16.540   53.794   22.960   48.218   23.849   49.530   11.466   46.864   12.214 2.666389 16.75245 
1 1 1    3    4   34 o   77.637   6.1212  127.037   19.439  143.164   27.201  110.203   27.791   82.796   7.9654   72.478   9.2966 10.31816 12.24238 
1 1 1    3    4   35 f  119.184   4.0675  295.207   19.963  273.503   27.928  317.881   28.546  114.680   5.9046  123.687   5.5957 -9.006996 8.134907 
1 1 1    3    4   36 o   34.874   8.9970   21.017   17.207   30.740   24.481   11.523   24.190   38.622   12.994   31.125   12.447 7.496851 17.99405 
1 1 1    3    4   37 o   42.417   10.984   32.276   25.093   49.236   39.176   20.478   32.675   47.761   16.433   37.074   14.581 10.68688 21.96899 
1 1 1    3    4   38 o   35.066   8.8875   21.701   17.162   7.3618   23.857   37.077   24.705   29.244   12.108   40.888   13.014 -11.64447 17.77491 
1 1 1    3    4   39 o   49.028   8.7129   56.023   17.746   65.199   24.862   46.492   25.339   53.322   11.632   44.734   12.975 8.588078 17.42588 
1 1 1    3    4   40 o   30.785   8.6192   12.323   16.786   1.0409   23.807   23.478   23.672   27.054   11.681   34.517   12.677 -7.463783 17.23849 
1 1 1    3    4   41 o   31.087   8.7443   15.517   16.800   16.291   23.496   14.708   24.031   31.267   12.343   30.907   12.390 0.3598843 17.48851 
1 1 1    3    4   42 o   54.077   8.3248   70.253   19.020  103.228   27.030   37.916   26.767   68.104   9.6231   40.049   13.587 28.05406 16.64966 
1 1 1    3    4   43 o   32.421   8.7461   19.623   16.628   29.414   23.788   10.267   23.253   35.994   12.775   28.848   11.949 7.146280 17.49214 
1 1 1    3    4   44 o   26.942   8.8165 -14.2266   22.851 -10.6489   35.064 -16.8676   30.126   28.505   13.087   25.378   11.818 3.126493 17.63310 
1 1 1    3    4   45 o   31.984   8.8364   20.459   16.959   24.900   24.105   16.105   23.865   33.569   12.700   30.399   12.290 3.169529 17.67288 
1 1 1    3    4   46 o   36.085   8.4755   29.775   17.090   3.3853   24.561   54.547   23.796   26.429   11.630   45.741   12.332 -19.31211 16.95096 
1 1 1    3    4   47 o   26.186   8.0214   5.2462   16.199   13.796   23.202  -2.8851   22.626   28.562   11.892   23.810   10.768 4.752628 16.04284 
1 1 1    3    4   48 o   28.929   8.5737   14.350   17.736   26.138   25.015   2.4358   25.150   32.274   12.737   25.585   11.481 6.688715 17.14742 
1 1 1    3    4   49 o   20.944   7.0391 -16.0686   16.545 -17.0684   23.249 -15.0426   23.551   20.703   9.8634   21.186   10.045 -0.4824390 14.07813 
1 1 1    3    4   50 o   39.079   10.175   45.737   27.158 -10.9000   39.875   94.744   37.092   26.570   12.729   51.589   15.878 -25.01870 20.34980 
1 1 1    3    4   51 o   26.913   9.0260  -1.7344   27.793 -28.2925   41.818   19.278   37.196   24.369   11.976   29.456   13.507 -5.086996 18.05190 
1 1 1    3    5    0 o  571.542   4.0499  6740.92  134.981  6740.92  134.981  6740.92  134.981  571.542   5.7274  571.542   5.7274 0.000000 0.000000 
1 1 1    3    5    1 o  463.921   3.4019  4440.30   65.087  4416.93   91.357  4464.39   92.751  462.683   4.7874  465.159   4.8345 -2.476471 6.803774 
1 1 1    3    5    2 o  632.983   4.7658  8284.57  123.820  8126.21  183.416  8417.17  167.836  627.382   7.0883  638.584   6.3724 -11.20197 9.531550 
1 1 1    3    5    3 o  380.502   3.3800  2986.81   53.035  3014.82   75.857  2960.03   74.176  382.246   4.8116  378.759   4.7483 3.486603 6.759962 
1 1 1    3    5    4 o  288.155   2.4420  1712.88   29.022  1708.05   40.936  1717.76   41.151  287.746   3.4493  288.563   3.4576 -0.8166199 4.883929 
1 1 1    3    5    5 o  234.803   2.8305  1141.08   26.922  1156.69   35.057  1118.63   42.035  236.779   3.5897  232.827   4.3773 3.953003 5.661003 
1 1 1    3    5    6 o  175.162   2.1645  636.906   15.524  674.780   21.133  592.522   22.877  180.858   2.8331  169.467   3.2731 11.39159 4.328934 
1 1 1    3    5    7 o  257.770   2.3361  1370.94   24.834  1362.34   34.885  1379.78   35.362  256.950   3.2917  258.589   3.3156 -1.638458 4.672119 
1 1 1    3    5    8 o  399.179   3.0722  3285.61   50.516  3214.99   69.407  3365.17   73.663  394.631   4.2643  403.727   4.4238 -9.095825 6.144441 
1 1 1    3    5    9 o  248.380   2.6882  1273.30   27.538  1276.48   39.102  1270.16   38.789  248.687   3.8122  248.072   3.7911 0.6151886 5.376350 
1 1 1    3    5   10 o   97.085   2.5506  194.379   10.208  198.651   14.721  190.423   14.167   98.111   3.6380   96.059   3.5758 2.052277 5.101118 
1 1 1    3    5   11 o  389.023   3.0420  3123.89   48.809  3121.21   68.925  3126.58   69.127  388.856   4.2976  389.190   4.3065 -0.3336792 6.083978 
1 1 1    3    5   12 o  151.220   2.2167  471.777   13.826  471.468   19.548  472.086   19.557  151.171   3.1352  151.270   3.1346 -0.9893799E-01 4.433417 
1 1 1    3    5   13 o  497.163   4.2441  5102.97   87.024  5089.68  122.544  5116.50  123.605  496.512   5.9841  497.815   6.0201 -1.303009 8.488256 
1 1 1    3    5   14 o  584.823   4.1952  7058.56  101.178  7014.19  141.753  7104.65  144.460  582.953   5.8957  586.693   5.9700 -3.740845 8.390421 
1 1 1    3    5   15 o  706.147   4.9440 10297.63  143.993 10296.39  203.746 10298.87  203.530  706.104   6.9961  706.191   6.9878 -0.8642578E-01 9.888085 
1 1 1    3    5   16 o  177.637   2.8521  650.806   20.889  674.895   29.812  627.570   29.279  180.866   3.9963  174.408   4.0702 6.457977 5.704170 
1 1 1    3    5   17 o   68.143   4.0797   97.316   11.254  116.725   15.743   77.031   16.094   75.205   5.0755   61.080   6.3886 14.12480 8.159378 
1 1 1    3    5   18 o  230.768   2.7743  1104.39   26.159  1145.10   35.073  1053.35   39.271  235.594   3.6094  225.943   4.2141 9.651718 5.548563 
1 1 1    3    5   19 o  180.431   2.9837  671.921   22.196  649.538   31.356  694.399   31.423  177.417   4.2851  183.445   4.1531 -6.028015 5.967477 
1 1 1    3    5   20 o   86.146   6.3350  139.843   18.132  177.507   42.385  131.407   20.060   92.530   11.106   79.761   6.0977 12.76898 12.67005 
1 1 1    3    5   21 o  139.409   3.0018  398.881   17.179  379.295   22.995  423.616   25.842  135.562   4.1128  143.256   4.3736 -7.693649 6.003612 
1 1 1    3    5   22 o  240.571   2.7177  1194.38   26.962  1218.68   38.343  1170.62   37.922  242.991   3.8258  238.150   3.8608 4.840744 5.435307 
1 1 1    3    5   23 o  115.980   4.1862  280.114   19.849  317.981   27.801  240.740   28.348  124.056   5.4334  107.904   6.3698 16.15215 8.372311 
1 1 1    3    5   24 o  125.952   3.3044  328.086   17.133  304.316   24.205  351.953   24.255  121.367   4.8354  130.537   4.5050 -9.169449 6.608827 
1 1 1    3    5   25 o  162.963   2.9695  548.334   19.955  561.306   28.542  535.931   27.910  164.848   4.1980  161.079   4.2010 3.769394 5.938954 
1 1 1    3    5   26 o   30.693   7.8321   11.632   14.341  -8.1977   20.673   30.027   19.911   23.527   10.493   37.859   11.630 -14.33174 15.66417 
1 1 1    3    5   27 o   47.185   7.4077   48.401   14.063   42.589   20.014   54.067   19.763   44.290   11.005   50.079   9.9190 -5.788986 14.81546 
1 1 1    3    5   28 o  114.499   3.6256  271.476   17.109  280.367   24.019  262.318   24.375  116.413   5.0025  112.585   5.2493 3.827698 7.251220 
1 1 1    3    5   29 o   92.154   6.0047  180.650   22.298  152.649   33.586  202.720   29.818   85.515   9.5224   98.792   7.3179 -13.27626 12.00950 
1 1 1    3    5   30 o  214.956   2.8989  954.807   25.695  980.284   36.812  930.601   35.882  217.751   4.0989  212.161   4.1006 5.589996 5.797868 
1 1 1    3    5   31 o   25.239   7.3479 -14.9388   15.835   19.991   20.829 -62.7796   24.376   33.285   11.939   17.192   8.5695 16.09265 14.69575 
1 1 1    3    5   32 o  155.040   3.9653  495.926   25.241  475.009   33.839  522.163   37.897  151.399   5.4190  158.681   5.7905 -7.282181 7.930672 
1 1 1    3    5   33 o  173.641   3.1983  623.892   22.896  648.847   32.695  599.875   32.075  177.053   4.4772  170.228   4.5684 6.825546 6.396543 
1 1 1    3    5   34 o  149.318   3.9253  462.925   24.163  469.726   33.825  455.838   34.529  150.455   5.4509  148.180   5.6498 2.274963 7.850627 
1 1 1    3    5   35 o   77.851   5.7292  127.124   18.382  121.958   26.063  132.238   25.930   76.247   8.2876   79.455   7.9126 -3.208122 11.45835 
1 1 1    3    5   36 o   42.236   8.2147   34.510   17.583   1.0706   24.441   70.383   25.315   28.007   11.960   56.466   11.265 -28.45897 16.42944 
1 1 1    3    5   37 o   52.053   10.732   62.867   25.186   44.209   37.137   78.757   34.272   45.648   15.983   58.458   14.326 -12.81054 21.46353 
1 1 1    3    5   38 o   58.155   7.8855   76.240   18.299   47.128   25.369  107.818   26.422   45.360   12.931   70.950   9.0290 -25.59076 15.77098 
1 1 1    3    5   39 o   80.232   5.4438  137.415   18.002  134.750   25.759  139.958   25.169   79.412   7.8647   81.051   7.5290 -1.638382 10.88762 
1 1 1    3    5   40 o   49.793   9.8129   59.911   21.278   70.944   28.979   47.003   31.344   54.822   13.011   44.764   14.693 10.05807 19.62582 
1 1 1    3    5   41 o   62.982   7.2441   90.126   17.997  113.036   25.954   68.909   24.977   71.828   8.7609   54.136   11.539 17.69213 14.48813 
1 1 1    3    5   42 o   44.379   8.0690   44.583   17.247   80.824   24.903   11.173   23.911   59.166   10.594   29.593   12.174 29.57310 16.13794 
1 1 1    3    5   43 o   31.445   8.3200   13.327   16.631   38.042   23.644 -10.8734   23.397   39.578   12.745   23.312   10.698 16.26582 16.63998 
1 1 1    3    5   44 o   68.217   8.7192  113.130   23.825  129.397   33.759   96.990   33.627   74.508   10.986   61.927   13.543 12.58015 17.43836 
1 1 1    3    5   45 o   33.107   8.8724   23.933   16.755   27.876   23.303   19.713   24.107   34.562   12.595   31.651   12.500 2.911648 17.74486 
1 1 1    3    5   46 o   25.613   7.8664   0.6406   16.220   16.375   22.983 -14.9711   22.894   29.629   12.032   21.597   10.136 8.031342 15.73278 
1 1 1    3    5   47 o   22.323   7.4419 -15.8408   17.441 -20.0018   22.803  -9.9754   27.073   20.448   9.7490   24.198   11.247 -3.750385 14.88378 
1 1 1    3    5   48 o   22.523   7.4183 -12.8395   17.226 -28.0488   24.400   2.2749   24.324   19.783   9.5952   25.263   11.316 -5.480034 14.83668 
1 1 1    3    5   49 o   22.276   7.3788 -10.6747   17.139 -18.5369   24.365  -2.9745   24.113   20.914   10.000   23.639   10.852 -2.725149 14.75757 
1 1 1    3    5   50 o   29.785   9.6540   14.604   26.733   13.709   40.434   15.299   35.633   29.990   13.870   29.580   13.432 0.4094009 19.30807 
1 1 1    3    5   51 o   34.803   10.493   46.034   28.277   19.542   42.191   67.641   38.102   29.771   13.904   39.835   15.720 -10.06453 20.98666 
1 1 1    3    6    0 o  360.180   3.2423  2677.42   68.093  2677.42   68.093  2677.42   68.093  360.180   4.5854  360.180   4.5854 0.000000 0.000000 
1 1 1    3    6    1 o  221.838   2.2710  1014.20   20.542  1021.65   31.575  1008.72   27.050  222.540   3.4401  221.137   2.9658 1.402832 4.542021 
1 1 1    3    6    2 o  371.567   3.1014  2848.51   47.043  2851.48   71.873  2846.30   62.223  371.720   4.6880  371.415   4.0619 0.3056641 6.202896 
1 1 1    3    6    3 o  222.566   2.7109  1026.12   24.547  1048.03   32.357  996.427   37.676  225.385   3.4808  219.747   4.1570 5.638611 5.421830 
1 1 1    3    6    4 o  104.526   2.2165  227.278   9.4249  238.384   12.526  212.783   14.309  107.498   2.8251  101.554   3.4162 5.943878 4.433066 
1 1 1    3    6    5 o  275.577   3.0429  1573.61   34.183  1610.08   45.322  1525.50   52.060  279.315   3.9341  271.839   4.6433 7.475586 6.085879 
1 1 1    3    6    6 o  144.340   2.4751  428.783   14.454  435.825   22.863  424.094   18.656  145.316   3.8146  143.365   3.1550 1.950912 4.950280 
1 1 1    3    6    7 o   89.756   2.1677  167.010   7.9439  172.298   10.610  160.263   11.985   91.384   2.8149   88.127   3.2972 3.256897 4.335333 
1 1 1    3    6    8 o  222.363   2.2045  1019.79   20.212  1039.07   29.011  1001.60   28.175  224.404   3.1345  220.322   3.1006 4.081985 4.408951 
1 1 1    3    6    9 o  405.779   4.0207  3409.55   66.274  3355.94  102.647  3447.87   86.788  402.971   6.1760  408.586   5.1500 -5.615173 8.041471 
1 1 1    3    6   10 o  135.310   2.4897  376.199   13.860  355.421   18.809  400.889   20.503  131.240   3.4747  139.380   3.5665 -8.139816 4.979323 
1 1 1    3    6   11 o  478.529   3.5483  4727.52   70.029  4714.08   98.647  4741.18   99.431  477.844   5.0053  479.213   5.0307 -1.368896 7.096545 
1 1 1    3    6   12 o  565.712   4.0695  6606.77   94.938  6564.25  132.959  6651.00  135.607  563.860   5.7171  567.565   5.7930 -3.704712 8.139053 
1 1 1    3    6   13 o  328.827   3.0020  2231.57   40.308  2225.79   61.458  2235.94   53.395  328.443   4.5368  329.212   3.9325 -0.7691040 6.003928 
1 1 1    3    6   14 o  403.068   3.4275  3350.79   56.319  3341.38   74.163  3363.62   86.562  402.419   4.4683  403.718   5.1985 -1.298676 6.854985 
1 1 1    3    6   15 o  226.037   2.6777  1053.15   24.701  1060.36   37.834  1047.80   32.610  226.704   4.0463  225.369   3.5083 1.334625 5.355422 
1 1 1    3    6   16 o  509.820   6.1874  5363.53  112.278  5386.87  225.893  5355.87  129.393  510.285   10.733  509.355   6.1592 0.9306641 12.37474 
1 1 1    3    6   17 f  219.040   2.6682  987.164   23.837  972.241   31.341  1007.64   36.714  217.088   3.5003  220.991   4.0281 -3.903244 5.336440 
1 1 1    3    6   18 o  198.218   2.4959  810.387   20.402  799.661   28.555  821.573   29.160  196.878   3.5166  199.557   3.5429 -2.678436 4.991859 
1 1 1    3    6   19 o  147.122   2.6933  446.607   16.343  449.126   23.160  444.108   23.064  147.535   3.8060  146.709   3.8117 0.8266296 5.386555 
1 1 1    3    6   20 o  406.827   3.5229  3421.16   58.625  3384.66   88.535  3449.66   78.234  404.861   5.3021  408.793   4.6401 -3.931396 7.045712 
1 1 1    3    6   21 o  446.028   3.4664  4107.79   63.768  4108.85   90.228  4106.73   90.135  446.086   4.9041  445.971   4.9003 0.1148987 6.932754 
1 1 1    3    6   22 o  166.751   2.8065  573.669   19.296  586.749   27.702  561.343   26.893  168.596   3.9838  164.907   3.9540 3.689255 5.612903 
1 1 1    3    6   23 o  115.778   3.7258  276.996   17.680  276.588   26.519  277.323   23.720  115.688   5.5579  115.867   4.9634 -0.1783371 7.451544 
1 1 1    3    6   24 o  270.472   2.7918  1509.47   31.133  1550.84   44.768  1470.72   43.325  274.057   3.9606  266.886   3.9359 7.170319 5.583694 
1 1 1    3    6   25 o  276.267   3.2127  1577.03   36.601  1567.64   51.243  1586.82   52.297  275.431   4.5108  277.102   4.5758 -1.671234 6.425391 
1 1 1    3    6   26 o  120.747   3.3747  300.892   16.785  280.626   23.252  322.946   24.256  116.504   4.8389  124.989   4.7051 -8.485039 6.749310 
1 1 1    3    6   27 o  103.590   3.7645  222.034   16.080  216.367   22.731  227.710   22.751  102.263   5.3894  104.918   5.2575 -2.654633 7.529064 
1 1 1    3    6   28 o   97.925   3.9395  198.616   15.906  201.465   22.330  195.681   22.663   98.644   5.4885   97.206   5.6528 1.437881 7.878929 
1 1 1    3    6   29 o   25.244   7.8422  -6.2916   15.760  -0.1335   23.343 -11.4499   21.364   27.356   11.685   23.133   10.462 4.223696 15.68437 
1 1 1    3    6   30 o  222.790   2.8702  1026.16   26.373  1032.53   37.281  1019.79   37.313  223.483   4.0446  222.096   4.0733 1.386765 5.740313 
1 1 1    3    6   31 o   92.540   4.3897  177.899   16.662  202.620   23.870  154.409   23.268   98.848   5.8548   86.232   6.5422 12.61674 8.779426 
1 1 1    3    6   32 o  197.724   3.6570  810.594   29.796  832.359   41.644  787.767   42.649  200.469   5.0367  194.979   5.3033 5.489685 7.313928 
1 1 1    3    6   33 o   87.491   4.9925  159.885   17.937  175.292   25.212  144.095   25.525   91.819   6.6575   83.164   7.4415 8.655388 9.984907 
1 1 1    3    6   34 o  150.072   3.8724  467.283   23.961  458.527   33.383  476.588   34.413  148.628   5.4458  151.516   5.5069 -2.887863 7.744810 
1 1 1    3    6   35 o   68.915   6.3584  100.019   18.035  108.746   25.788   91.664   25.231   71.904   8.6956   65.925   9.2792 5.978088 12.71681 
1 1 1    3    6   36 o  103.045   4.5687  221.738   19.416  220.217   27.577  223.233   27.340  102.684   6.5113  103.405   6.4106 -0.7208252 9.137448 
1 1 1    3    6   37 o   25.413   8.1201 -15.3401   18.624   0.5911   26.864 -30.0842   25.843   28.873   12.438   21.953   10.442 6.919699 16.24022 
1 1 1    3    6   38 o   57.679   7.9052   74.848   18.120   71.893   25.172   78.027   26.103   56.461   11.205   58.897   11.154 -2.435966 15.81037 
1 1 1    3    6   39 o   38.123   8.9934   31.753   16.767   38.827   23.934   24.935   23.496   41.162   12.769   35.085   12.668 6.077160 17.98677 
1 1 1    3    6   40 o   45.892   10.155   49.051   21.844   34.165   29.659   66.696   32.291   39.538   14.239   52.246   14.483 -12.70777 20.31027 
1 1 1    3    6   41 o   46.101   9.1797   51.657   18.234   48.040   26.146   55.081   25.443   44.474   13.257   47.727   12.702 -3.253468 18.35936 
1 1 1    3    6   42 o   66.665   6.8811  100.572   17.949  128.129   25.849   74.909   24.944   76.675   8.1736   56.654   11.072 20.02092 13.76216 
1 1 1    3    6   43 o   29.219   8.5611   11.164   16.900   9.5057   24.085   12.771   23.719   28.777   12.060   29.661   12.154 -0.8842945 17.12224 
1 1 1    3    6   44 o   25.828   7.9433  -7.7009   17.233   19.203   25.105 -31.6713   23.697   31.977   12.715   19.680   9.5238 12.29700 15.88655 
1 1 1    3    6   45 o   23.108   7.4954 -11.6770   16.525 -23.6429   23.062   0.9484   23.689   20.419   9.7545   25.797   11.383 -5.377302 14.99087 
1 1 1    3    6   46 o   58.527   7.3542   82.965   17.118  102.412   24.721   65.052   23.726   66.523   9.0100   50.531   11.626 15.99166 14.70841 
1 1 1    3    6   47 o   37.017   10.093   36.326   22.697   53.918   32.309   19.187   31.891   42.245   14.899   31.788   13.620 10.45749 20.18625 
1 1 1    3    6   48 o   25.582   8.1114   2.5173   17.733   0.4300   25.087   4.6015   25.069   25.106   11.348   26.059   11.594 -0.9530373 16.22283 
1 1 1    3    6   49 o   24.802   7.8055  -3.2862   17.429   21.784   24.740 -27.9867   24.557   30.053   12.375   19.551   9.5157 10.50183 15.61092 
1 1 1    3    6   50 o   26.304   8.5471  -0.3392   22.168 -23.7199   32.359   20.339   30.431   22.827   11.067   29.781   13.028 -6.953047 17.09430 
1 1 1    3    6   51 o   26.909   9.0630   2.4521   27.529   1.8411   42.254   2.9027   36.288   27.315   13.090   26.503   12.538 0.8115940 18.12601 
1 1 1    3    7    0 f  135.797   1.7752  380.731   14.050  380.731   14.050  380.731   14.050  135.797   2.5105  135.797   2.5105 0.000000 0.000000 
1 1 1    3    7    1 o  234.419   2.4935  1130.41   24.054  1183.49   35.495  1085.32   32.711  239.491   3.5934  229.348   3.4580 10.14330 4.987044 
1 1 1    3    7    2 o  738.128   5.5022 11269.78  165.878 11255.93  252.736 11280.25  219.858  737.582   8.3079  738.675   7.2164 -1.093567 11.00447 
1 1 1    3    7    3 o  299.974   3.1903  1865.08   39.034  1911.43   51.862  1804.52   59.284  304.315   4.1320  295.633   4.8620 8.682068 6.380641 
1 1 1    3    7    4 o   98.352   2.2033  200.945   8.8182  208.807   11.693  190.577   13.427  100.603   2.8181   96.101   3.3877 4.501350 4.406595 
1 1 1    3    7    5 o  201.400   2.6070  841.066   21.394  864.387   28.368  810.312   32.577  204.665   3.3607  198.134   3.9865 6.531509 5.214058 
1 1 1    3    7    6 o  258.513   2.5148  1381.66   26.603  1399.65   35.594  1358.89   40.043  260.435   3.3136  256.590   3.7837 3.845215 5.029569 
1 1 1    3    7    7 f  230.510   2.4002  1097.40   22.606  1103.24   30.031  1089.77   34.341  231.229   3.1490  229.791   3.6234 1.437668 4.800487 
1 1 1    3    7    8 o  337.486   2.9626  2351.25   40.817  2352.20   54.011  2349.99   62.325  337.588   3.8791  337.383   4.4789 0.2051697 5.925217 
1 1 1    3    7    9 o  359.556   3.7073  2664.96   53.686  2647.41   68.758  2692.38   85.928  358.096   4.6554  361.016   5.7709 -2.919769 7.414573 
1 1 1    3    7   10 o  317.704   3.0973  2083.00   40.580  2102.97   57.960  2063.79   56.835  319.197   4.4026  316.212   4.3578 2.984772 6.194621 
1 1 1    3    7   11 o  415.478   3.4590  3559.29   58.536  3586.30   90.344  3539.75   76.848  416.806   5.2553  414.149   4.4990 2.657227 6.918038 
1 1 1    3    7   12 o  213.113   2.5266  934.342   21.879  951.791   34.144  922.186   28.499  214.791   3.8542  211.436   3.2680 3.354813 5.053181 
1 1 1    3    7   13 o  575.083   4.4580  6834.69  104.995  6893.03  140.727  6761.43  157.689  577.890   5.9043  572.276   6.6808 5.614014 8.915925 
1 1 1    3    7   14 o  660.516   5.3939  9006.16  146.803  8880.66  202.616  9144.84  212.993  655.695   7.4921  665.336   7.7617 -9.641968 10.78781 
1 1 1    3    7   15 o  368.912   3.4657  2807.29   52.709  2772.86   73.287  2844.20   75.864  366.572   4.8473  371.252   4.9545 -4.680206 6.931385 
1 1 1    3    7   16 o  128.936   2.5924  342.917   13.785  335.604   19.368  350.424   19.623  127.543   3.6818  130.329   3.6506 -2.786018 5.184844 
1 1 1    3    7   17 o  111.878   2.9331  258.476   13.458  260.316   18.129  256.218   20.085  112.325   3.9131  111.431   4.3702 0.8942719 5.866105 
1 1 1    3    7   18 o  394.684   3.1657  3214.68   51.532  3219.62   73.063  3209.79   72.693  394.986   4.4849  394.383   4.4690 0.6026917 6.331384 
1 1 1    3    7   19 o  389.241   3.6386  3127.42   58.405  3096.38   81.770  3159.74   83.450  387.272   5.1193  391.209   5.1719 -3.937317 7.277100 
1 1 1    3    7   20 o  265.697   3.0576  1456.93   33.498  1466.60   48.015  1447.76   46.756  266.553   4.3674  264.841   4.2805 1.712189 6.115290 
1 1 1    3    7   21 o  341.059   2.9589  2401.02   41.619  2417.25   59.277  2385.23   58.448  342.195   4.2000  339.923   4.1689 2.271698 5.917752 
1 1 1    3    7   22 o  163.610   2.8351  552.506   19.129  557.430   27.303  547.757   26.809  164.325   4.0284  162.895   3.9903 1.430450 5.670184 
1 1 1    3    7   23 o  138.246   3.0764  394.714   17.540  391.748   24.897  397.637   24.714  137.729   4.3829  138.763   4.3181 -1.034332 6.152734 
1 1 1    3    7   24 o  129.284   3.6139  348.769   18.877  363.538   24.654  327.840   29.348  132.656   4.5060  125.912   5.6514 6.744209 7.227840 
1 1 1    3    7   25 o   86.290   4.7044  154.416   16.719  164.061   23.672  144.816   23.618   88.993   6.4493   83.586   6.8507 5.406540 9.408781 
1 1 1    3    7   26 o   91.384   4.1239  172.753   15.538  166.532   21.701  179.297   22.256   89.695   5.8661   93.073   5.7978 -3.378059 8.247781 
1 1 1    3    7   27 o  103.238   3.8071  220.592   16.207  214.960   22.912  226.230   22.927  101.914   5.4508  104.561   5.3164 -2.646667 7.614122 
1 1 1    3    7   28 o   72.144   5.9116  108.372   17.537  107.692   25.774  108.958   23.931   71.907   8.6906   72.382   8.0163 -0.4747162 11.82314 
1 1 1    3    7   29 o  132.126   3.7292  362.058   20.279  335.598   28.733  388.318   28.624  127.288   5.4730  136.964   5.0671 -9.676437 7.458491 
1 1 1    3    7   30 o  180.967   3.0202  677.030   22.538  662.413   31.551  692.260   32.207  178.972   4.2743  182.961   4.2680 -3.988403 6.040318 
1 1 1    3    7   31 o   27.529   8.0483   4.2085   15.007  -1.1052   21.168   9.5783   21.280   25.738   11.064   29.320   11.691 -3.581604 16.09668 
1 1 1    3    7   32 o   86.997   5.0486  161.703   17.514  116.856   25.131  204.052   24.421   74.836   8.1422   99.158   5.9714 -24.32226 10.09711 
1 1 1    3    7   33 o  185.243   3.8659  712.233   28.983  714.491   37.569  708.914   45.549  185.709   4.9050  184.777   5.9768 0.9315643 7.731805 
1 1 1    3    7   34 o  140.352   3.6337  408.562   21.022  428.463   30.034  389.446   29.435  143.714   5.0669  136.991   5.2097 6.722748 7.267339 
1 1 1    3    7   35 f   47.657   8.7770   50.698   17.469   55.248   24.452   45.956   24.966   49.810   12.037   45.503   12.777 4.306053 17.55398 
1 1 1    3    7   36 o   92.782   6.0213  181.581   22.978  182.518   33.804  180.777   31.329   92.928   8.8197   92.636   8.1998 0.2915421 12.04260 
1 1 1    3    7   37 o   67.767   6.3487   98.398   17.654  107.604   24.689   88.767   25.252   71.163   8.4119   64.371   9.5113 6.791763 12.69740 
1 1 1    3    7   38 o   30.970   8.8060   11.195   17.749  -0.6884   26.229   21.233   24.107   27.963   12.167   33.978   12.733 -6.014376 17.61198 
1 1 1    3    7   39 o   80.617   5.5185  139.166   18.255  155.818   25.933  122.812   25.700   85.567   7.3483   75.666   8.2350 9.900513 11.03692 
1 1 1    3    7   40 o   27.043   8.4068  -2.3396   17.992   5.3470   27.488  -8.1011   23.798   29.597   12.662   24.489   11.062 5.108089 16.81357 
1 1 1    3    7   41 o   65.606   7.1447   97.721   18.727   85.111   26.593  110.126   26.376   60.522   11.061   70.691   9.0465 -10.16850 14.28943 
1 1 1    3    7   42 o   28.060   8.3935   6.1953   16.781   10.210   24.221   2.4895   23.272   29.402   12.189   26.717   11.543 2.685053 16.78690 
1 1 1    3    7   43 o   22.524   7.6128 -30.0024   20.070 -40.7205   29.589 -20.8685   27.315   21.659   10.519   23.389   11.007 -1.729748 15.22564 
1 1 1    3    7   44 o   78.570   5.7008  137.604   18.336  121.059   26.151  153.605   25.717   73.499   8.6267   83.641   7.4549 -10.14132 11.40150 
1 1 1    3    7   45 o   50.000   9.0981   65.239   18.970   71.980   26.396   58.039   27.280   53.232   12.274   46.768   13.433 6.464157 18.19612 
1 1 1    3    7   46 o   45.194   8.5214   53.465   16.215   57.057   22.602   49.655   23.276   47.082   11.692   43.305   12.400 3.777115 17.04287 
1 1 1    3    7   47 o   33.865   9.6647   25.440   22.509   48.034   31.211   0.9539   32.492   39.941   14.573   27.789   12.698 12.15212 19.32945 
1 1 1    3    7   48 o   29.099   8.6592   16.037   17.739   20.959   25.414   11.360   24.773   30.562   12.559   27.637   11.925 2.924505 17.31837 
1 1 1    3    7   49 f   25.654   8.4369  -4.7370   21.898   11.105   31.362 -19.8091   30.590   28.332   12.757   22.976   11.044 5.355452 16.87383 
1 1 1    3    7   50 o   32.636   9.5069   29.305   22.672   1.7970   33.536   52.462   30.770   26.576   12.407   38.696   14.408 -12.11980 19.01374 
1 1 1    3    7   51 o   25.079   8.5853 -12.5316   27.650 -30.4948   41.416   1.9131   37.139   23.764   11.725   26.394   12.544 -2.630068 17.17052 
1 1 1    3    8    0 o  310.333   2.9367  1988.11   53.136  1988.11   53.136  1988.11   53.136  310.333   4.1531  310.333   4.1531 0.000000 0.000000 
1 1 1    3    8    1 o  430.436   3.4693  3822.94   60.849  3846.44   93.732  3805.82   79.998  431.533   5.2664  429.339   4.5176 2.193817 6.938559 
1 1 1    3    8    2 o  240.432   2.5254  1191.71   25.021  1222.46   36.310  1163.92   34.527  243.379   3.6172  237.485   3.5250 5.894501 5.050725 
1 1 1    3    8    3 f  174.377   2.4551  632.643   17.477  672.267   23.574  584.290   26.042  180.499   3.1666  168.254   3.7527 12.24463 4.910174 
1 1 1    3    8    4 o  136.341   1.9821  384.940   11.068  396.951   14.938  370.318   16.481  138.712   2.6110  133.969   2.9828 4.742401 3.964118 
1 1 1    3    8    5 o  217.206   3.0519  973.431   27.315  961.707   37.724  986.350   39.602  215.837   4.2377  218.576   4.3929 -2.739319 6.103720 
1 1 1    3    8    6 o  249.922   2.7395  1294.89   25.443  1302.43   30.096  1275.99   47.634  251.249   2.9042  248.594   4.6458 2.655167 5.478907 
1 1 1    3    8    7 o  389.323   3.9062  3127.79   61.283  3145.51   97.827  3116.34   78.621  390.162   6.0792  388.483   4.9068 1.678864 7.812425 
1 1 1    3    8    8 o  182.051   2.2585  684.154   16.767  686.037   22.127  681.615   25.693  182.352   2.9421  181.750   3.4275 0.6027374 4.517063 
1 1 1    3    8    9 o  316.537   3.4194  2066.18   43.697  2057.68   56.250  2079.12   69.392  315.750   4.3193  317.325   5.3020 -1.575287 6.838716 
1 1 1    3    8   10 o  684.283   5.5300  9676.67  156.053  9730.57  222.656  9624.63  218.779  686.146   7.8678  682.419   7.7730 3.726990 11.05991 
1 1 1    3    8   11 o  366.931   2.9401  2777.79   44.495  2768.77   62.714  2786.93   63.138  366.332   4.1507  367.530   4.1652 -1.198578 5.880236 
1 1 1    3    8   12 o  456.732   3.4407  4304.25   64.811  4285.85   91.144  4323.08   92.178  455.745   4.8489  457.718   4.8827 -1.972900 6.881344 
1 1 1    3    8   13 o  358.335   2.9328  2648.57   43.334  2618.10   60.497  2680.68   62.102  356.220   4.1177  360.450   4.1773 -4.229980 5.865572 
1 1 1    3    8   14 o  215.034   2.8511  951.049   25.242  905.718   34.466  1003.49   37.072  209.525   3.9883  220.542   4.0755 -11.01749 5.702291 
1 1 1    3    8   15 o  226.873   2.7932  1061.89   26.136  1070.73   37.099  1053.19   36.826  227.810   3.9485  225.936   3.9519 1.873245 5.586382 
1 1 1    3    8   16 o  167.858   2.3898  580.868   16.539  597.390   23.769  565.361   23.028  170.170   3.3867  165.545   3.3727 4.624435 4.779576 
1 1 1    3    8   17 o  375.478   3.0497  2908.41   47.217  2877.46   65.880  2941.10   67.706  373.427   4.2775  377.530   4.3482 -4.103088 6.099471 
1 1 1    3    8   18 o  309.518   2.7768  1976.28   35.441  1950.81   49.517  2003.03   50.748  307.475   3.9046  311.561   3.9492 -4.085968 5.553559 
1 1 1    3    8   19 o  385.451   3.6088  3067.22   57.366  3039.76   80.415  3095.68   81.860  383.696   5.0814  387.205   5.1258 -3.508911 7.217682 
1 1 1    3    8   20 o  142.767   2.9977  418.114   17.527  400.150   23.236  441.828   26.696  139.237   4.0461  146.296   4.4244 -7.059174 5.995480 
1 1 1    3    8   21 o  103.957   3.5159  222.534   15.023  197.901   20.687  250.024   21.854   97.883   5.1241  110.031   4.8156 -12.14793 7.031821 
1 1 1    3    8   22 o  277.739   2.8011  1592.47   32.087  1594.76   45.420  1590.20   45.336  277.938   3.9622  277.540   3.9605 0.3979492 5.602185 
1 1 1    3    8   23 o  236.259   2.7338  1152.43   26.638  1133.11   37.552  1172.01   37.791  234.264   3.8865  238.254   3.8458 -3.989929 5.467668 
1 1 1    3    8   24 o  112.099   4.3585  259.435   20.115  249.516   27.470  270.904   29.538  109.801   6.0657  114.397   6.2604 -4.595879 8.716917 
1 1 1    3    8   25 f   63.903   5.5014   85.306   14.370   97.970   20.274   72.518   20.373   68.733   7.1516   59.074   8.3615 9.658825 11.00271 
1 1 1    3    8   26 o  151.810   3.0041  476.254   18.808  481.069   26.520  471.382   26.677  152.584   4.2140  151.035   4.2825 1.548798 6.008156 
1 1 1    3    8   27 o   86.870   4.3169  156.372   15.466  156.235   21.720  156.513   22.027   86.834   6.0646   86.906   6.1452 -0.7161713E-01 8.633828 
1 1 1    3    8   28 f  135.830   3.7854  382.048   21.200  377.071   30.232  386.864   29.737  134.952   5.4316  136.708   5.2739 -1.756790 7.570720 
1 1 1    3    8   29 o  156.075   3.2586  499.477   20.768  474.231   27.229  534.587   32.111  151.428   4.3597  160.722   4.8441 -9.293839 6.517110 
1 1 1    3    8   30 o  212.472   3.1385  912.913   26.959  1037.57   43.593  835.719   34.305  223.910   4.7204  201.035   4.1373 22.87457 6.276910 
1 1 1    3    8   31 o  120.883   3.7441  302.752   18.667  302.344   26.503  303.155   26.295  120.799   5.3195  120.966   5.2704 -0.1670609 7.488263 
1 1 1    3    8   32 o   73.696   5.5391  113.418   16.759  127.300   23.917  100.029   23.490   78.175   7.4178   69.218   8.2281 8.957275 11.07811 
1 1 1    3    8   33 f   62.731   9.5503   81.522   24.535   54.028   31.732  122.390   38.688   49.601   14.559   75.862   12.365 -26.26105 19.10070 
1 1 1    3    8   34 f  122.693   4.0072  313.013   20.268  302.792   28.734  323.135   28.594  120.681   5.7728  124.705   5.5593 -4.024574 8.014417 
1 1 1    3    8   35 o   79.478   5.6297  132.706   18.361  150.557   26.357  115.878   25.591   84.746   7.5408   74.209   8.3612 10.53639 11.25936 
1 1 1    3    8   36 o   33.855   9.6958   13.201   21.103   8.0166   31.324   17.510   28.557   33.014   13.788   34.695   13.635 -1.680290 19.39153 
1 1 1    3    8   37 o   47.806   8.5291   52.009   17.002   63.119   24.270   41.303   23.825   52.868   11.461   42.745   12.634 10.12344 17.05811 
1 1 1    3    8   38 o   78.406   6.0097  132.537   19.323  118.530   27.597  146.010   27.065   74.126   9.0266   82.685   7.9363 -8.559311 12.01938 
1 1 1    3    8   39 f   60.008   7.2492   80.206   17.471   74.931   25.236   85.061   24.211   57.420   11.057   62.597   9.3776 -5.177006 14.49840 
1 1 1    3    8   40 o   22.264   7.3123 -17.7848   16.452 -29.7278   23.699  -6.6753   22.857   20.292   9.7454   24.237   10.904 -3.944422 14.62457 
1 1 1    3    8   41 o   40.061   9.9336   36.353   19.695   32.207   24.662   43.651   32.720   37.535   13.031   42.587   14.996 -5.052223 19.86715 
1 1 1    3    8   42 o   31.107   8.6320   16.496   16.349   23.027   23.242   10.098   23.003   33.439   12.508   28.774   11.899 4.664984 17.26402 
1 1 1    3    8   43 o   41.417   9.7190   41.377   21.017   18.329   30.350   62.612   29.132   33.360   13.719   49.473   13.771 -16.11333 19.43800 
1 1 1    3    8   44 o   63.214   6.8613   92.706   17.359  103.395   24.481   81.897   24.617   67.775   8.7577   58.653   10.565 9.121212 13.72269 
1 1 1    3    8   45 o   24.193   7.6102 -18.2245   17.714 -57.8766   25.506   18.723   24.621   17.391   8.6840   30.995   12.500 -13.60396 15.22050 
1 1 1    3    8   46 o   27.824   8.1257   11.035   15.696  -0.4504   22.295   22.320   22.101   24.309   10.866   31.339   12.085 -7.029963 16.25145 
1 1 1    3    8   47 o   30.557   8.4827   0.9709   18.584   54.460   29.508 -34.1893   23.924   42.368   14.266   18.747   9.1814 23.62106 16.96534 
1 1 1    3    8   48 o   28.214   8.4700   13.630   17.341   21.031   24.691   6.4261   24.361   30.320   12.410   26.108   11.531 4.211496 16.93999 
1 1 1    3    8   49 o   25.096   8.3172  -5.1432   21.739 -11.9018   32.382   0.4016   29.330   24.548   11.680   25.644   11.844 -1.095886 16.63433 
1 1 1    3    8   50 o   26.704   8.5870   4.1588   21.761 -19.9567   31.433   26.355   30.156   22.712   10.986   30.697   13.201 -7.985233 17.17404 
1 1 1    3    8   51 o   34.005   9.9742   30.224   28.082 -32.5943   40.469   88.563   38.999   23.284   11.507   44.726   16.295 -21.44226 19.94839 
1 1 1    3    9    1 o   66.307   2.2620   88.229   6.0193   80.724   7.5521  101.302   9.9670   62.550   2.9274   70.063   3.4491 -7.513706 4.523925 
1 1 1    3    9    2 o  321.911   2.8241  2141.16   37.175  2122.03   56.252  2155.99   49.533  320.613   4.2540  323.208   3.7157 -2.595551 5.648264 
1 1 1    3    9    3 o  268.711   4.6363  1490.86   51.384   0.0000   0.0000  1490.86   51.384  ?   ?   268.711   4.6363      ?      ? 
1 1 1    3    9    4 o  369.273   3.7182  2811.60   55.263  2794.62   70.705  2838.27   88.595  367.902   4.6596  370.643   5.7954 -2.740814 7.436352 
1 1 1    3    9    5 o  221.750   2.3372  1016.50   21.186  1029.01   28.237  1000.39   32.045  223.322   3.0657  220.177   3.5288 3.145142 4.674456 
1 1 1    3    9    6 f  265.631   2.9610  1437.17   29.893  1407.94   35.705  1505.68   54.664  261.218   3.3140  270.043   4.9080 -8.824677 5.922071 
1 1 1    3    9    7 o  189.737   2.1669  741.626   16.342  738.631   20.513  746.830   27.038  189.224   2.6284  190.250   3.4457 -1.025421 4.333756 
1 1 1    3    9    8 o  155.671   2.2216  502.182   14.085  515.039   18.642  485.080   21.501  158.009   2.8606  153.334   3.3998 4.674789 4.443103 
1 1 1    3    9    9 o   46.717   4.3503   47.982   7.7187   56.484   10.088   35.980   11.987   52.316   4.6754   41.118   7.3377 11.19852 8.700586 
1 1 1    3    9   10 o  358.008   3.1191  2643.72   45.574  2639.24   60.225  2649.72   69.712  357.666   4.0826  358.350   4.7167 -0.6841431 6.238149 
1 1 1    3    9   11 o  607.608   4.6690  7622.79  115.824  7616.00  176.772  7627.90  153.319  607.322   7.0572  607.893   6.1151 -0.5708008 9.337973 
1 1 1    3    9   12 o  399.228   3.1352  3288.59   51.622  3302.09   73.371  3275.35   72.644  400.039   4.4469  398.417   4.4207 1.621887 6.270370 
1 1 1    3    9   13 o  655.281   5.0072  8856.73  133.547  8804.09  174.980  8930.17  206.680  653.022   6.4967  657.541   7.6210 -4.518921 10.01434 
1 1 1    3    9   14 o  205.533   2.8851  870.694   23.146  874.334   39.822  868.837   28.445  205.842   4.6906  205.225   3.3605 0.6164398 5.770134 
1 1 1    3    9   15 o  409.980   4.1525  3464.96   68.493  3447.21   87.583  3492.91  109.900  408.678   5.1960  411.281   6.4788 -2.603027 8.305034 
1 1 1    3    9   16 o  229.557   2.4533  1086.76   23.222  1070.41   32.412  1104.01   33.286  227.784   3.4500  231.330   3.4888 -3.545486 4.906530 
1 1 1    3    9   17 o  330.847   2.8500  2257.28   38.869  2218.41   53.919  2299.33   56.082  327.886   3.9871  333.809   4.0735 -5.922913 5.699998 
1 1 1    3    9   18 o  154.264   2.8014  491.333   17.561  489.739   27.254  492.465   22.964  154.040   4.2897  154.487   3.6040 -0.4470062 5.602715 
1 1 1    3    9   19 o  416.805   3.2961  3586.12   56.655  3561.89   79.382  3611.29   80.884  415.372   4.6336  418.237   4.6889 -2.865265 6.592120 
1 1 1    3    9   20 o  401.800   3.2370  3333.44   53.643  3337.64   75.865  3329.23   75.861  402.054   4.5750  401.546   4.5806 0.5075989 6.473956 
1 1 1    3    9   21 o  186.585   2.9313  718.638   22.341  719.447   34.047  718.027   29.606  186.663   4.4224  186.507   3.8488 0.1558228 5.862647 
1 1 1    3    9   22 o   40.392   7.7645   35.051   13.278   33.787   18.731   36.327   18.825   39.714   11.038   41.069   10.923 -1.354336 15.52904 
1 1 1    3    9   23 o   50.986   6.6994   55.734   13.651   45.527   19.620   65.311   19.005   45.860   10.587   56.112   8.2119 -10.25166 13.39884 
1 1 1    3    9   24 o  163.091   4.1476  550.977   27.828  556.479   38.122  544.702   40.715  163.986   5.6365  162.195   6.0862 1.790985 8.295295 
1 1 1    3    9   25 f  116.362   3.4600  279.746   16.585  299.745   23.793  260.847   23.130  120.410   4.7910  112.314   4.9932 8.096291 6.919938 
1 1 1    3    9   26 o   86.564   4.2389  154.941   15.122  162.484   21.893  148.060   20.912   88.575   5.9928   84.552   5.9966 4.022957 8.477753 
1 1 1    3    9   27 o  145.848   3.1035  439.788   18.668  437.567   26.426  442.001   26.376  145.479   4.4042  146.217   4.3737 -0.7378082 6.206977 
1 1 1    3    9   28 o   51.337   7.0849   57.229   14.578   69.709   20.265   43.844   20.986   57.838   8.4952   44.836   11.341 13.00228 14.16973 
1 1 1    3    9   29 o   64.564   5.6991   87.033   15.111   96.426   21.405   77.700   21.337   68.079   7.6233   61.049   8.4739 7.029930 11.39829 
1 1 1    3    9   30 o  114.991   4.1193  273.852   19.523  288.474   28.134  260.273   27.112  117.952   5.7832  112.029   5.8677 5.922653 8.238616 
1 1 1    3    9   31 o   30.279   8.4006   11.728   15.322   9.7435   22.188   13.538   21.183   29.818   11.922   30.740   11.838 -0.9220295 16.80121 
1 1 1    3    9   32 o   54.928   7.6066   65.094   16.827   79.861   24.053   50.940   23.549   61.718   9.4490   48.137   11.923 13.58076 15.21314 
1 1 1    3    9   33 o   39.465   10.618   25.188   23.957   30.220   31.791   18.574   36.444   40.520   14.720   38.411   15.305 2.109138 21.23516 
1 1 1    3    9   34 o   27.023   8.2289  -0.8581   16.637  -3.0970   23.856   1.2618   23.213   26.595   11.588   27.451   11.687 -0.8564892 16.45788 
1 1 1    3    9   35 o   73.640   6.0016  114.458   18.130  129.205   25.848  100.176   25.438   78.406   7.9931   68.874   8.9548 9.532356 12.00323 
1 1 1    3    9   36 o   30.523   8.7626   10.259   17.242   9.4142   24.669   11.066   24.108   30.381   12.416   30.665   12.368 -0.2842045 17.52527 
1 1 1    3    9   37 o   48.775   8.4590   54.801   17.263   70.495   24.284   38.766   24.546   56.040   10.899   41.511   12.940 14.52895 16.91798 
1 1 1    3    9   38 o   67.958   6.8844  100.503   19.282  106.069   27.638   95.226   26.913   69.842   9.5947   66.075   9.8754 3.767319 13.76888 
1 1 1    3    9   39 o   40.728   8.9627   38.310   16.662   38.885   23.549   37.734   23.578   40.991   12.657   40.465   12.693 0.5260735 17.92533 
1 1 1    3    9   40 o   26.006   8.1528  -3.1719   17.435  -7.7595   25.545   0.8294   23.857   25.385   11.464   26.626   11.595 -1.241291 16.30561 
1 1 1    3    9   41 o   47.122   10.054   53.686   21.985   34.650   29.970   75.861   32.347   39.132   14.280   55.111   14.156 -15.97825 20.10798 
1 1 1    3    9   42 o   38.837   8.9315   36.368   16.405   38.437   23.441   34.381   22.966   39.750   12.679   37.925   12.583 1.825436 17.86305 
1 1 1    3    9   43 o   51.203   8.4307   64.928   17.631   77.080   24.539   51.960   25.350   56.988   10.836   45.417   12.918 11.57078 16.86144 
1 1 1    3    9   44 o   60.615   7.0288   85.759   16.993  100.153   24.351   72.095   23.726   66.578   8.8680   54.653   10.908 11.92550 14.05764 
1 1 1    3    9   45 o   54.807   8.2844   76.115   18.162   73.222   25.783   78.964   25.587   53.504   11.982   56.111   11.444 -2.606541 16.56889 
1 1 1    3    9   46 o   28.676   7.9227   9.5423   15.795 -16.3683   22.428   35.039   22.248   20.910   9.8812   36.442   12.387 -15.53220 15.84541 
1 1 1    3    9   47 o   25.434   8.0142   2.7171   17.115   9.3974   24.506  -3.6432   23.912   27.100   11.776   23.767   10.873 3.333103 16.02838 
1 1 1    3    9   48 o   22.531   7.5064 -12.3888   18.043 -16.5837   25.018  -7.8422   26.046   21.566   10.263   23.497   10.957 -1.930944 15.01277 
1 1 1    3    9   49 o   28.131   8.6111 -12.2299   22.056   50.674   32.367 -66.7656   30.137   38.298   14.661   17.965   9.0362 20.33268 17.22218 
1 1 1    3    9   50 o   26.505   8.5186   0.8733   21.492   32.895   31.271 -27.7939   29.588   32.012   13.595   20.998   10.268 11.01393 17.03729 
1 1 1    3    9   51 o   26.119   8.8301   0.1946   26.552   1.3011   41.106  -0.5977   34.782   26.770   12.850   25.468   12.114 1.301907 17.66018 
1 1 1    3   10    0 o   37.040   3.2917   29.622   6.8068   29.622   6.8068   29.622   6.8068   37.040   4.6551   37.040   4.6551 0.000000 0.000000 
1 1 1    3   10    2 o  235.827   2.6792  1133.26   24.320  1108.37   29.348  1187.81   43.451  231.777   3.0700  239.878   4.3918 -8.101852 5.358413 
1 1 1    3   10    3 o  159.536   2.3993  529.945   15.642  578.193   21.410  474.704   22.909  167.403   3.1009  151.669   3.6622 15.73398 4.798641 
1 1 1    3   10    4 o   96.148   2.2290  193.418   8.7158  217.496   11.917  165.725   12.780  102.678   2.8140   89.619   3.4576 13.05824 4.457960 
1 1 1    3   10    5 o  178.044   2.0141  653.881   14.789  644.998   20.793  662.976   21.040  176.821   2.8511  179.268   2.8457 -2.447464 4.028235 
1 1 1    3   10    6 o   70.591   2.4567  104.009   7.0696  115.341   9.6703   91.001   10.361   74.772   3.1357   66.410   3.7827 8.362312 4.913435 
1 1 1    3   10    7 o  188.860   2.1927  734.269   16.464  730.090   20.662  741.535   27.246  188.134   2.6628  189.587   3.4845 -1.452377 4.385451 
1 1 1    3   10    8 o  544.463   5.0542  6127.08  111.459  6149.46  144.719  6094.44  174.745  545.760   6.4292  543.166   7.8002 2.593994 10.10832 
1 1 1    3   10    9 o  236.560   2.3944  1153.05   22.504  1149.47   28.236  1159.27   37.258  236.068   2.9000  237.053   3.8107 -0.9851685 4.788738 
1 1 1    3   10   10 o  385.169   3.2848  3056.77   51.500  3033.93   67.468  3088.66   79.720  383.466   4.2659  386.873   4.9961 -3.407410 6.569542 
1 1 1    3   10   11 o  748.250   5.6221 11554.76  171.252 11642.72  264.814 11491.54  224.518  750.588   8.5541  745.913   7.2979 4.675110 11.24418 
1 1 1    3   10   12 o  173.332   2.3227  619.469   16.600  631.114   23.832  608.496   23.135  174.913   3.3035  171.751   3.2659 3.162292 4.645370 
1 1 1    3   10   13 o  472.532   3.5408  4602.29   68.910  4506.23   94.578  4710.98  100.608  467.290   4.9073  477.775   5.1056 -10.48453 7.081539 
1 1 1    3   10   14 o  243.825   2.8150  1221.63   28.230  1291.51   41.872  1163.40   38.223  250.189   4.0578  237.461   3.9027 12.72807 5.630037 
1 1 1    3   10   15 o  291.604   2.8933  1743.00   34.125  1697.88   43.874  1812.09   54.294  286.872   3.7081  296.335   4.4423 -9.462921 5.786519 
1 1 1    3   10   16 o  249.719   2.5209  1286.25   25.960  1268.75   36.300  1304.57   37.141  247.982   3.5491  251.456   3.5811 -3.474426 5.041884 
1 1 1    3   10   17 o  103.243   2.9466  220.051   12.542  217.191   17.931  222.791   17.549  102.584   4.2379  103.901   4.0950 -1.316925 5.893117 
1 1 1    3   10   18 o  267.060   3.0338  1472.14   33.417  1465.87   47.236  1478.43   47.281  266.491   4.2976  267.630   4.2834 -1.139557 6.067673 
1 1 1    3   10   19 o  321.664   2.8568  2135.33   37.896  2112.86   53.072  2158.71   54.131  319.940   4.0219  323.389   4.0584 -3.449402 5.713689 
1 1 1    3   10   20 o   81.586   3.9598  137.430   13.319  141.492   19.167  133.636   18.522   82.750   5.6160   80.421   5.5841 2.329109 7.919663 
1 1 1    3   10   21 o  251.349   3.1277  1304.76   32.422  1294.86   46.017  1314.51   45.687  250.400   4.4557  252.298   4.3905 -1.897980 6.255357 
1 1 1    3   10   22 f  136.651   3.0613  385.700   17.244  368.302   24.264  403.454   24.510  133.533   4.4056  139.768   4.2518 -6.234909 6.122667 
1 1 1    3   10   23 o  179.231   2.7890  663.114   20.611  679.860   29.604  647.360   28.712  181.425   3.9562  177.037   3.9322 4.387772 5.577990 
1 1 1    3   10   24 o  121.763   3.7296  306.553   18.724  311.497   26.892  301.902   26.087  122.713   5.3134  120.813   5.2353 1.899307 7.459223 
1 1 1    3   10   25 o  114.972   3.8526  273.615   17.831  274.034   22.864  272.963   28.487  115.126   4.8151  114.818   6.0154 0.3079681 7.705239 
1 1 1    3   10   26 o   37.520   7.9104   29.415   13.358   37.264   19.287   22.177   18.520   41.460   11.071   33.580   11.302 7.880207 15.82076 
1 1 1    3   10   27 o  118.610   4.0021  290.839   19.515  297.840   28.926  284.990   26.439  119.900   5.8492  117.320   5.4640 2.580536 8.004278 
1 1 1    3   10   28 o  130.863   3.3058  354.293   17.841  356.778   25.405  351.874   25.062  131.314   4.6907  130.412   4.6594 0.9028625 6.611546 
1 1 1    3   10   29 o  166.238   3.0445  571.687   20.868  577.171   29.234  565.989   29.797  167.058   4.2428  165.417   4.3674 1.640274 6.089002 
1 1 1    3   10   30 o   77.439   5.5663  125.271   17.698  120.884   26.024  129.045   24.140   76.132   8.2880   78.746   7.4327 -2.614326 11.13262 
1 1 1    3   10   31 o   79.866   5.1118  133.653   16.612  107.764   23.308  160.379   23.682   71.886   7.8614   87.847   6.5362 -15.96103 10.22363 
1 1 1    3   10   32 o   55.052   8.1281   66.398   18.427   97.651   26.493   37.113   25.646   68.215   9.4164   41.888   13.251 26.32730 16.25614 
1 1 1    3   10   33 o   67.874   6.9645   95.508   19.204  106.848   30.467   88.033   24.736   71.071   10.394   64.677   9.2728 6.394203 13.92899 
1 1 1    3   10   34 o   45.901   8.8315   46.831   17.336   55.378   24.511   38.276   24.524   49.845   12.054   41.956   12.910 7.889076 17.66294 
1 1 1    3   10   35 o  123.573   4.8168  320.449   24.493  302.522   35.126  337.414   34.170  120.124   7.0899  127.022   6.5223 -6.898293 9.633600 
1 1 1    3   10   36 o   94.240   4.7824  186.665   18.580  194.818   26.626  178.927   25.940   96.260   6.7064   92.221   6.8198 4.039497 9.564839 
1 1 1    3   10   37 o   38.216   8.8895   31.245   16.544   41.573   23.955   21.826   22.876   42.611   12.686   33.820   12.456 8.791328 17.77892 
1 1 1    3   10   38 o   20.319   6.8840 -29.6279   16.509 -28.1849   23.130 -31.1264   23.571   20.417   9.7577   20.220   9.7130 0.1969566 13.76794 
1 1 1    3   10   39 o   53.036   7.7826   65.236   16.466   60.602   23.407   69.776   23.168   50.912   11.428   55.160   10.568 -4.247086 15.56520 
1 1 1    3   10   40 o   38.719   9.2596   34.096   18.134   22.140   25.738   45.883   25.554   33.926   13.053   43.511   13.137 -9.585297 18.51924 
1 1 1    3   10   41 o   24.740   8.0920 -23.4471   20.628   0.9269   28.099 -51.9373   30.379   28.507   12.494   20.972   10.287 7.534464 16.18393 
1 1 1    3   10   42 o   36.622   9.8179   29.819   20.389   29.548   29.546   30.065   28.172   36.642   14.013   36.602   13.755 0.4058075E-01 19.63577 
1 1 1    3   10   43 o   44.019   8.6596   48.164   16.944   32.249   23.630   65.008   24.310   36.591   12.753   51.448   11.719 -14.85703 17.31919 
1 1 1    3   10   44 o   23.064   7.4413  -7.9926   15.803  -1.9295   22.409 -13.9918   22.290   24.433   10.909   21.694   10.123 2.739620 14.88261 
1 1 1    3   10   45 o   45.036   7.7582   51.631   16.827   84.443   23.484   17.006   24.124   60.024   9.4861   30.049   12.279 29.97508 15.51638 
1 1 1    3   10   46 o   35.718   9.0911   34.321   17.186   30.189   24.558   38.287   24.059   34.094   12.837   37.342   12.876 -3.247784 18.18210 
1 1 1    3   10   47 o   29.942   8.7130   18.961   17.414   24.178   24.862   13.936   24.399   31.578   12.622   28.306   12.015 3.271467 17.42607 
1 1 1    3   10   48 o   27.981   9.6423 -24.0597   36.098 -12.6956   50.090 -36.3383   52.067   28.859   13.937   27.103   13.329 1.755775 19.28466 
1 1 1    3   10   49 o   32.880   9.5445   29.123   22.524   3.3582   32.601   52.656   31.157   26.795   12.415   38.965   14.501 -12.16943 19.08902 
1 1 1    3   10   50 o   21.003   7.2905 -29.3544   21.459 -27.0230   32.406 -31.1749   28.636   21.857   10.701   20.150   9.9044 1.707178 14.58097 
1 1 1    3   11    0 o  117.453   2.0745  285.072   14.192  285.072   14.192  285.072   14.192  117.453   2.9337  117.453   2.9337 0.000000 0.000000 
1 1 1    3   11    1 o  256.515   3.0139  1326.51   30.281  1262.58   36.970  1456.80   52.781  247.370   3.6235  265.661   4.8171 -18.29118 6.027816 
1 1 1    3   11    2 o  416.553   4.1247  3530.14   67.503  3415.43   82.966  3754.79  116.106  406.768   4.9453  426.338   6.6029 -19.57037 8.249475 
1 1 1    3   11    3 f  292.739   2.9858  1779.21   34.513  1806.63   43.166  1730.61   57.465  295.914   3.5368  289.564   4.8116 6.350128 5.971662 
1 1 1    3   11    4 o  336.996   3.4544  2349.79   47.368  2380.91   62.321  2307.22   72.890  339.668   4.4485  334.323   5.2861 5.345245 6.908869 
1 1 1    3   11    5 o  223.796   2.3531  1035.30   21.574  1014.26   32.267  1052.31   29.012  221.731   3.5283  225.861   3.1144 -4.130371 4.706184 
1 1 1    3   11    6 o  211.050   3.0985  918.789   26.971  918.789   26.971   0.0000   0.0000  211.050   3.0985  ?   ?       ?      ? 
1 1 1    3   11    7 o  567.441   6.1663  6778.45  122.173  6893.34  140.210  6416.09  249.002  577.910   5.8824  556.972   10.839 20.93750 12.33265 
1 1 1    3   11    8 o  664.314   7.5859  9123.90  179.901  9119.15  207.686  9138.16  360.041  664.475   7.5782  664.152   13.144 0.3225098 15.17188 
1 1 1    3   11    9 o  510.766   4.3103  5385.58   90.798  5407.97  129.033  5363.61  127.792  511.816   6.1125  509.716   6.0787 2.100128 8.620507 
1 1 1    3   11   10 o  341.599   3.0564  2406.42   42.583  2399.48   56.149  2415.82   65.331  341.032   3.9919  342.165   4.6293 -1.133087 6.112757 
1 1 1    3   11   11 o  196.518   2.4563  793.348   19.584  778.727   25.387  814.838   30.777  194.297   3.1680  198.740   3.7547 -4.443024 4.912651 
1 1 1    3   11   12 o   60.220   3.6190   76.820   8.6681   53.912   12.331   99.198   12.188   51.103   5.8503   69.337   4.2618 -18.23346 7.237987 
1 1 1    3   11   13 o  202.066   2.3217  842.192   19.348  832.059   27.174  852.610   27.554  200.833   3.2807  203.298   3.2861 -2.464996 4.643391 
1 1 1    3   11   14 o  275.673   2.9374  1567.43   33.389  1595.33   47.899  1541.06   46.568  278.057   4.1766  273.289   4.1314 4.768616 5.874770 
1 1 1    3   11   15 o  202.834   2.8088  847.960   23.476  827.625   32.378  870.501   34.089  200.274   3.9198  205.393   4.0240 -5.119034 5.617596 
1 1 1    3   11   16 o  399.675   3.1685  3297.11   52.230  3299.05   73.886  3295.17   73.843  399.793   4.4808  399.557   4.4809 0.2356262 6.336917 
1 1 1    3   11   17 o  239.853   2.5210  1186.86   24.935  1172.25   34.899  1202.10   35.641  238.346   3.5500  241.360   3.5802 -3.013596 5.041921 
1 1 1    3   11   18 o  301.534   3.1736  1876.55   39.456  1898.76   56.655  1855.62   54.980  303.263   4.5295  299.805   4.4463 3.458466 6.347160 
1 1 1    3   11   19 o   95.447   3.4614  188.481   13.600  176.548   19.353  200.123   19.115   92.452   5.0754   98.442   4.7079 -5.990173 6.922738 
1 1 1    3   11   20 o   94.749   3.6775  185.850   14.334  171.112   20.329  200.423   20.215   90.998   5.4164   98.500   4.9758 -7.501701 7.355043 
1 1 1    3   11   21 o   65.566   5.3080   89.253   14.319   93.022   19.860   85.171   20.666   67.024   7.1842   64.109   7.8157 2.915268 10.61590 
1 1 1    3   11   22 o  147.131   2.9273  447.090   17.757  430.436   24.955  464.171   25.273  144.353   4.1914  149.909   4.0875 -5.556076 5.854545 
1 1 1    3   11   23 o  122.226   3.2420  308.563   16.336  295.971   22.785  321.880   23.432  119.660   4.6168  124.791   4.5526 -5.131592 6.483932 
1 1 1    3   11   24 o  167.263   2.8535  578.092   19.681  569.140   27.966  586.877   27.703  165.976   4.0852  168.550   3.9850 -2.573853 5.706942 
1 1 1    3   11   25 o  144.930   3.6836  434.589   22.013  433.440   30.761  435.795   31.514  144.739   5.1529  145.121   5.2651 -0.3820496 7.367125 
1 1 1    3   11   26 o  236.114   2.9698  1149.00   28.628  1129.43   37.737  1175.53   43.938  233.789   3.9136  238.439   4.4678 -4.649673 5.939517 
1 1 1    3   11   27 o  139.652   3.6498  403.750   20.991  404.014   30.537  403.513   28.902  139.681   5.3006  139.624   5.0188 0.5690002E-01 7.299638 
1 1 1    3   11   28 o  181.070   2.9246  677.859   21.841  685.754   31.013  670.090   30.763  182.117   4.1288  180.023   4.1432 2.093582 5.849228 
1 1 1    3   11   29 f  155.968   3.1516  503.277   20.274  499.437   28.612  507.148   28.731  155.370   4.4649  156.567   4.4492 -1.196655 6.303239 
1 1 1    3   11   30 o   83.197   5.3043  150.300   17.353  191.239   23.767  103.554   25.397   95.999   6.0027   70.396   8.7471 25.60268 10.60862 
1 1 1    3   11   31 o  121.037   4.0604  304.068   20.106  303.183   30.402  304.756   26.804  120.833   6.1004  121.241   5.3602 -0.4080658 8.120724 
1 1 1    3   11   32 o   47.289   9.0670   49.160   18.189   55.838   26.250   42.993   25.228   50.204   12.675   44.375   12.968 5.828720 18.13396 
1 1 1    3   11   33 o  152.723   3.4931  484.183   21.991  479.318   31.519  488.798   30.698  151.958   5.0291  153.488   4.8492 -1.530670 6.986116 
1 1 1    3   11   34 o  141.026   4.2570  420.145   24.076  441.318   31.113  388.546   38.009  145.710   5.1771  136.343   6.7591 9.367294 8.513998 
1 1 1    3   11   35 o   85.356   6.3233  154.484   22.189  160.431   32.956  149.553   30.010   86.777   9.2081   83.936   8.6686 2.840408 12.64651 
1 1 1    3   11   36 o   34.037   8.7050   20.747   16.264   32.834   23.366   9.3872   22.652   38.781   12.684   29.292   11.926 9.488422 17.41008 
1 1 1    3   11   37 o   25.785   7.9600  -1.6503   16.026   1.4143   22.634  -4.7315   22.695   26.598   11.437   24.972   11.074 1.626139 15.92008 
1 1 1    3   11   38 o   54.692   7.6910   68.593   16.927   91.363   23.987   46.006   23.891   64.975   8.9509   44.410   12.510 20.56521 15.38208 
1 1 1    3   11   39 o   53.535   8.1422   67.297   17.433   68.842   25.202   65.878   24.141   54.068   11.645   53.002   11.383 1.065952 16.28443 
1 1 1    3   11   40 o   48.398   8.3003   55.688   16.635   70.361   24.011   42.143   23.069   54.900   10.987   41.895   12.444 13.00407 16.60060 
1 1 1    3   11   41 o   46.650   9.3486   53.871   18.613   53.507   29.404   54.114   24.044   46.111   14.128   47.189   12.247 -1.077374 18.69723 
1 1 1    3   11   42 o   33.635   9.5494   20.848   20.196   20.430   29.580   21.214   27.641   33.759   13.671   33.511   13.337 0.2476730 19.09875 
1 1 1    3   11   43 o   28.637   8.3078   9.8514   16.383  -3.3236   23.229   22.890   23.109   24.629   11.044   32.645   12.414 -8.016701 16.61555 
1 1 1    3   11   44 o   27.156   8.2461   7.3215   16.595   7.4008   23.175   7.2380   23.773   27.068   11.604   27.245   11.719 -0.1771889 16.49212 
1 1 1    3   11   45 o   50.955   7.7925   65.065   16.344   83.194   23.452   47.945   22.790   59.381   9.5756   42.530   12.296 16.85131 15.58506 
1 1 1    3   11   46 o   32.414   9.2690   25.387   19.345   31.329   27.267   19.364   27.450   34.241   13.362   30.587   12.850 3.653654 18.53801 
1 1 1    3   11   47 o   41.386   8.6453   46.852   17.892   19.657   24.959   75.603   25.663   29.988   12.397   52.784   12.053 -22.79567 17.29057 
1 1 1    3   11   48 o   33.691   11.105   27.479   38.336   2.7235   54.466   51.784   53.968   30.667   14.740   36.715   16.615 -6.047989 22.21086 
1 1 1    3   11   49 o   28.005   9.4562   1.5235   28.344   0.4671   33.555   4.1550   52.959   26.248   12.304   29.763   14.363 -3.514507 18.91249 
1 1 1    3   11   50 o   35.371   14.123   47.295   31.091   0.0000   0.0000   47.295   31.091  ?   ?    35.371   14.123      ?      ? 
1 1 1    3   12    0 o  296.965   2.5190  1819.73   43.619  1819.73   43.619  1819.73   43.619  296.965   3.5624  296.965   3.5624 0.000000 0.000000 
1 1 1    3   12    1 o  188.019   2.0184  729.171   15.652  733.459   22.156  724.899   22.115  188.571   2.8487  187.467   2.8602 1.103806 4.036781 
1 1 1    3   12    2 o  900.334   6.3337 16748.31  227.616 16741.12  287.701 16760.33  372.155  900.308   7.7479  900.360   10.022 -0.5175781E-01 12.66748 
1 1 1    3   12    3 o  119.385   1.9818  290.199   9.6228  272.806   12.455  315.952   15.156  115.006   2.6259  123.764   2.9691 -8.757866 3.963641 
1 1 1    3   12    4 o  339.005   3.4391  2375.84   47.967  2560.23   67.684  2189.79   67.988  352.253   4.6587  325.758   5.0603 26.49487 6.878203 
1 1 1    3   12    5 f  540.633   4.7862  6026.39  100.109  6010.85  121.933  6058.54  175.352  539.675   5.4780  541.591   7.8501 -1.916260 9.572465 
1 1 1    3   12    6 o  469.711   3.5880  4557.39   67.370  4570.49   85.412  4535.82  109.601  470.647   4.4001  468.774   5.6687 1.873047 7.175973 
1 1 1    3   12    7 o  236.371   2.4710  1156.03   23.874  1179.73   31.887  1125.78   36.014  239.143   3.2329  233.599   3.7379 5.544189 4.942063 
1 1 1    3   12    8 o  329.414   3.3047  2256.55   43.114  2303.50   54.205  2175.70   71.132  334.144   3.9332  324.685   5.3118 9.458496 6.609439 
1 1 1    3   12    9 f  625.229   4.7595  8084.53  122.133  8213.25  165.485  7930.54  181.000  630.745   6.3612  619.714   7.0814 11.03088 9.519019 
1 1 1    3   12   10 f  571.943   4.7406  6740.79  111.548  6941.97  164.615  6569.97  151.684  579.797   6.8838  564.088   6.5197 15.70862 9.481172 
1 1 1    3   12   11 o  132.294   2.8335  359.186   15.225  350.500   19.762  371.870   23.881  130.342   3.6760  134.246   4.3131 -3.903961 5.667037 
1 1 1    3   12   12 o  261.807   3.9157  1422.97   37.984  1433.45   44.862  1396.42   71.385  263.577   4.1267  260.038   6.6559 3.539063 7.831346 
1 1 1    3   12   13 o  429.965   3.5552  3820.20   62.622  3855.92   84.042  3775.60   93.895  432.249   4.7141  427.680   5.3230 4.569153 7.110368 
1 1 1    3   12   14 o   99.854   2.8642  206.506   11.742  196.239   17.190  215.486   16.076   97.515   4.2740  102.193   3.8141 -4.677635 5.728446 
1 1 1    3   12   15 o  258.267   2.7557  1379.17   29.038  1357.71   44.263  1395.38   38.474  256.487   4.1842  260.048   3.5871 -3.561127 5.511336 
1 1 1    3   12   16 o  146.629   3.1919  434.605   17.734  421.197   21.082  467.052   32.794  142.869   3.5777  150.389   5.2871 -7.519852 6.383835 
1 1 1    3   12   17 o  267.873   2.8345  1483.06   31.041  1465.95   46.979  1496.32   41.355  266.484   4.2744  269.263   3.7238 -2.779358 5.668917 
1 1 1    3   12   18 o  161.059   2.6175  535.299   17.379  559.433   24.763  511.879   24.395  164.637   3.6468  157.480   3.7558 7.156601 5.235034 
1 1 1    3   12   19 o  213.885   2.5951  943.852   22.888  919.719   32.000  969.126   32.749  211.087   3.6756  216.683   3.6644 -5.596191 5.190149 
1 1 1    3   12   20 o   57.164   5.3318   67.435   12.392   84.172   18.208   52.993   16.914   63.767   6.9230   50.561   8.1108 13.20607 10.66363 
1 1 1    3   12   21 o   93.746   3.6894  181.634   14.263  185.341   20.358  178.061   19.990   94.686   5.2130   92.807   5.2222 1.878517 7.378850 
1 1 1    3   12   22 o   45.407   7.4028   43.489   13.522   55.044   20.949   35.236   17.704   50.462   10.411   40.353   10.527 10.10886 14.80553 
1 1 1    3   12   23 o   30.246   7.5846   11.092   13.764 -10.6556   19.988   30.709   18.983   22.439   10.137   38.053   11.285 -15.61451 15.16915 
1 1 1    3   12   24 o   41.099   7.5753   36.509   13.060   42.724   18.631   30.505   18.313   44.364   10.369   37.834   11.047 6.530155 15.15061 
1 1 1    3   12   25 o  106.898   4.4286  236.254   19.500  222.380   26.815  251.824   28.408  103.575   6.2770  110.221   6.2489 -6.646278 8.857191 
1 1 1    3   12   26 o   45.780   7.9933   43.734   15.064   60.870   23.531   31.835   19.608   52.911   11.135   38.650   11.471 14.26081 15.98667 
1 1 1    3   12   27 f  113.740   3.5683  266.932   16.655  306.750   24.272  231.501   22.896  121.747   4.8337  105.732   5.2503 16.01522 7.136533 
1 1 1    3   12   28 o   40.035   8.1879   33.895   14.613   44.629   21.062   23.932   20.292   45.189   11.323   34.881   11.830 10.30734 16.37587 
1 1 1    3   12   29 o  120.149   3.5685  298.643   17.674  312.105   25.450  286.103   24.562  122.764   5.0263  117.535   5.0669 5.228989 7.136977 
1 1 1    3   12   30 o   53.361   7.3066   61.388   15.688   96.786   23.182   31.481   21.308   68.084   8.2554   38.638   12.058 29.44615 14.61325 
1 1 1    3   12   31 o   52.998   8.1801   61.491   17.369   66.182   25.259   57.283   23.922   54.952   11.513   51.043   11.623 3.908646 16.36018 
1 1 1    3   12   32 o   26.889   8.2142  -1.8183   16.521   1.5062   25.168  -4.3358   21.901   28.629   12.178   25.150   11.026 3.479542 16.42838 
1 1 1    3   12   33 o   75.840   5.7274  121.546   17.687  144.973   25.205   98.819   24.825   83.207   7.3445   68.473   8.7905 14.73422 11.45487 
1 1 1    3   12   34 o  134.211   4.6700  376.665   25.784  375.132   35.192  378.443   37.884  133.982   6.3685  134.439   6.8322 -0.4566193 9.340014 
1 1 1    3   12   35 o  115.100   4.2248  277.542   20.040  264.646   28.326  290.464   28.355  112.382   6.1111  117.819   5.8351 -5.436798 8.449513 
1 1 1    3   12   36 o   40.110   8.4753   33.618   16.513   56.958   24.074   12.879   22.693   49.822   11.882   30.398   12.089 19.42386 16.95063 
1 1 1    3   12   37 o   33.594   8.7404   20.320   16.720   6.6589   24.343   32.522   23.006   28.950   12.128   38.239   12.589 -9.289541 17.48080 
1 1 1    3   12   38 o   63.293   6.5633   87.730   17.038   99.936   24.530   76.352   23.684   67.742   8.7796   58.845   9.7584 8.896660 13.12661 
1 1 1    3   12   39 o   43.497   9.2330   44.669   19.431   21.244   27.726   67.277   27.238   34.185   13.435   52.809   12.668 -18.62395 18.46607 
1 1 1    3   12   40 o   27.120   8.0014  -1.0300   16.516 -23.9664   23.287   22.185   23.428   20.932   9.9436   33.307   12.539 -12.37462 16.00289 
1 1 1    3   12   41 o   56.613   7.5558   75.037   17.208   83.954   24.212   65.938   24.460   60.982   9.6266   52.244   11.649 8.737606 15.11153 
1 1 1    3   12   42 o   36.253   9.3559   23.089   19.134   3.6809   24.384   54.194   30.869   27.084   11.758   45.423   14.556 -18.33933 18.71186 
1 1 1    3   12   43 o   45.715   8.6851   52.940   16.738   50.656   23.699   55.214   23.643   44.631   12.420   46.800   12.144 -2.168377 17.37019 
1 1 1    3   12   44 o   35.407   8.7134   30.493   16.508   15.830   23.463   44.867   23.230   29.572   12.100   41.242   12.542 -11.67060 17.42687 
1 1 1    3   12   45 o   29.158   8.4731   15.111   16.827   23.888   22.803   4.6175   24.934   31.835   12.276   26.481   11.682 5.353565 16.94611 
1 1 1    3   12   46 o   45.862   9.7554   61.665   20.392   47.351   28.019   77.786   29.735   39.912   13.888   51.813   13.704 -11.90064 19.51077 
1 1 1    3   12   47 o   29.343   9.0681   15.050   20.224   12.822   25.484   18.842   33.240   27.868   12.059   30.818   13.546 -2.950069 18.13617 
1 1 1    3   12   48 o   28.897   13.438   7.8770   38.739   0.0000   0.0000   7.8770   38.739  ?   ?    28.897   13.438      ?      ? 
1 1 1    3   12   49 o   44.002   10.381   69.365   22.448   88.294   33.476   53.901   30.258   49.519   15.055   38.485   14.296 11.03326 20.76134 
1 1 1    3   12   50 o   35.692   9.8023   45.806   23.244   14.972   33.673   73.873   32.126   27.707   12.759   43.678   14.885 -15.97075 19.60465 
1 1 1    3   13    0 o  197.458   2.0688  804.683   23.815  804.683   23.815  804.683   23.815  197.458   2.9257  197.458   2.9257 0.000000 0.000000 
1 1 1    3   13    1 o  434.663   3.7619  3897.65   67.410  3952.35   97.076  3846.70   93.679  437.603   5.3785  431.723   5.2610 5.880432 7.523777 
1 1 1    3   13    2 o  466.957   4.0640  4509.53   70.992  4521.41   84.279  4480.50  131.723  468.112   4.3652  465.802   6.8564 2.310059 8.128036 
1 1 1    3   13    3 o  474.948   3.7751  4653.65   73.067  4642.29   96.136  4669.18  112.434  474.292   4.9144  475.604   5.7317 -1.311890 7.550106 
1 1 1    3   13    4 o  307.961   3.0193  1976.18   37.972  2198.23   52.341  1729.47   55.172  326.418   3.8878  289.504   4.6206 36.91364 6.038615 
1 1 1    3   13    5 o  281.088   2.6235  1633.73   30.340  1703.53   42.067  1558.07   43.799  287.363   3.5493  274.812   3.8643 12.55136 5.246919 
1 1 1    3   13    6 o  134.841   2.8674  363.350   15.156  339.607   18.463  412.406   26.539  128.307   3.4890  141.375   4.5514 -13.06866 5.734850 
1 1 1    3   13    7 o  290.204   3.0300  1756.19   34.846  1807.76   43.950  1668.91   57.181  296.023   3.5997  284.386   4.8751 11.63712 6.060060 
1 1 1    3   13    8 o  279.147   2.5599  1608.83   28.507  1612.56   36.023  1602.59   46.627  279.594   3.1238  278.701   4.0563 0.8928528 5.119785 
1 1 1    3   13    9 o  215.182   2.3301  948.555   19.850  932.018   24.705  978.677   33.342  212.564   2.8179  217.800   3.7116 -5.235886 4.660143 
1 1 1    3   13   10 o  371.186   3.0501  2846.39   45.260  2856.94   57.395  2829.04   73.600  372.124   3.7396  370.248   4.8197 1.875336 6.100274 
1 1 1    3   13   11 f  216.402   2.5057  962.332   22.053  944.055   28.751  988.453   34.371  213.922   3.2586  218.881   3.8073 -4.958679 5.011347 
1 1 1    3   13   12 o  549.283   4.2947  6227.50   96.189  6212.19  126.754  6248.30  147.699  548.541   5.6026  550.024   6.5107 -1.483276 8.589417 
1 1 1    3   13   13 o  143.594   2.6987  429.440   14.913  436.757   18.166  414.319   26.114  145.503   3.0271  141.684   4.4688 3.818192 5.397486 
1 1 1    3   13   14 o  342.776   2.8661  2424.84   40.518  2429.20   57.535  2420.56   57.070  343.081   4.0660  342.472   4.0403 0.6090393 5.732099 
1 1 1    3   13   15 o  350.508   3.1573  2530.78   45.002  2567.63   69.971  2504.78   58.770  352.651   4.8107  348.365   4.0903 4.286346 6.314527 
1 1 1    3   13   16 o  183.554   2.9183  695.231   22.088  717.334   31.547  673.976   30.936  186.416   4.1030  180.693   4.1511 5.723724 5.836621 
1 1 1    3   13   17 o   92.935   3.9799  178.556   15.246  182.025   21.333  174.935   21.797   93.861   5.5105   92.008   5.7438 1.853622 7.959739 
1 1 1    3   13   18 o   81.296   4.2544  136.127   14.108  133.346   18.536  139.957   21.752   80.326   5.5949   82.266   6.4108 -1.939598 8.508853 
1 1 1    3   13   19 o   75.316   4.3370  117.134   13.347  118.732   20.370  115.931   17.669   75.751   6.5199   74.881   5.7210 0.8699570 8.674008 
1 1 1    3   13   20 o  116.126   3.2340  275.686   15.349  299.641   23.689  258.354   20.150  120.418   4.7697  111.833   4.3687 8.585098 6.467991 
1 1 1    3   13   21 o   98.944   3.5142  201.912   14.320  217.137   20.820  188.242   19.728  102.477   4.9260   95.411   5.0133 7.066307 7.028392 
1 1 1    3   13   22 o   35.546   8.2118   25.449   13.781   25.521   20.839   25.393   18.373   35.897   11.989   35.195   11.225 0.7022629 16.42369 
1 1 1    3   13   23 o  310.902   3.2864  1995.57   42.094  1944.57   57.917  2052.67   61.286  306.709   4.5784  315.095   4.7158 -8.386597 6.572732 
1 1 1    3   13   24 o  133.923   3.0712  370.854   16.959  360.776   23.986  380.929   23.982  132.099   4.4025  135.747   4.2834 -3.648666 6.142381 
1 1 1    3   13   25 o   72.837   5.2414  111.866   15.249  103.156   24.314  117.512   19.577   70.391   8.3747   75.284   6.3050 -4.893250 10.48278 
1 1 1    3   13   26 o   66.141   7.8988   96.626   19.740  104.109   24.669   83.305   32.914   70.672   8.4633   61.610   13.339 9.061668 15.79763 
1 1 1    3   13   27 o   26.137   7.9102  -0.6756   15.277   5.1035   19.986  -8.7989   23.695   27.041   11.128   25.232   11.245 1.809052 15.82039 
1 1 1    3   13   28 o   78.175   4.8670  127.150   15.541  151.004   22.415  105.067   21.567   85.287   6.3722   71.063   7.3583 14.22401 9.733927 
1 1 1    3   13   29 o  180.438   3.0392  673.610   22.617  663.956   31.897  683.372   32.074  179.135   4.3172  181.741   4.2789 -2.605621 6.078406 
1 1 1    3   13   30 o   40.943   8.3131   35.725   15.515   20.519   22.098   50.508   21.788   33.896   12.278   47.990   11.210 -14.09393 16.62625 
1 1 1    3   13   31 o  225.925   3.9452  1059.94   36.761  1045.32   51.773  1074.80   52.205  224.350   5.5951  227.500   5.5637 -3.150116 7.890498 
1 1 1    3   13   32 o   85.515   4.9145  152.586   17.324  158.908   24.962  146.710   24.064   87.224   6.9386   83.806   6.9618 3.418259 9.829085 
1 1 1    3   13   33 o   31.833   8.4252   11.542   16.355   31.856   23.579  -7.2950   22.705   38.896   12.742   24.770   11.026 14.12595 16.85049 
1 1 1    3   13   34 o  136.372   5.4753  401.107   29.309  362.652   48.263  423.574   36.890  130.541   8.9640  142.203   6.2898 -11.66129 10.95060 
1 1 1    3   13   35 o   27.582   7.9254   0.8910   15.761 -21.1875   22.569   21.908   22.019   21.421   10.057   33.744   12.252 -12.32326 15.85079 
1 1 1    3   13   36 o   91.703   4.7822  177.950   18.074  168.882   25.294  187.412   25.837   89.279   6.8692   94.126   6.6551 -4.847595 9.564326 
1 1 1    3   13   37 o   29.147   8.2760   8.0082   16.059  -6.6153   22.795   22.419   22.628   24.506   10.968   33.789   12.397 -9.283211 16.55194 
1 1 1    3   13   38 o   34.634   8.7389   25.656   15.925   20.079   23.004   30.789   22.068   32.501   12.380   36.767   12.337 -4.265846 17.47770 
1 1 1    3   13   39 o   31.644   8.9505   11.182   19.158 -10.2071   27.423   31.576   26.777   25.730   11.722   37.558   13.529 -11.82747 17.90104 
1 1 1    3   13   40 o   73.677   5.8583  118.870   17.794  123.558   25.309  114.288   25.022   75.176   8.1627   72.178   8.4054 2.998253 11.71663 
1 1 1    3   13   41 o   38.253   9.6211   33.456   19.997   17.602   28.469   48.896   28.096   32.639   13.338   43.867   13.869 -11.22795 19.24213 
1 1 1    3   13   42 o   34.057   9.5825   21.938   20.444   11.246   27.763   34.605   30.218   30.220   12.821   37.894   14.245 -7.673750 19.16505 
1 1 1    3   13   43 o   46.242   8.6572   54.965   16.777   53.509   24.013   56.353   23.449   45.485   12.441   47.000   12.042 -1.514893 17.31445 
1 1 1    3   13   44 o   31.161   8.0051   13.465   16.259   45.335   23.235 -17.1148   22.760   41.266   12.542   21.056   9.9515 20.20979 16.01015 
1 1 1    3   13   45 o   54.673   10.417   78.503   21.863  121.128   42.824   63.477   25.427   61.399   16.540   47.946   12.668 13.45295 20.83358 
1 1 1    3   13   46 o   30.585   8.4594   5.6856   18.468 -28.6531   24.389   51.845   28.276   19.665   9.5507   41.506   13.965 -21.84070 16.91883 
1 1 1    3   13   47 o   37.421   10.337   46.614   23.327   40.339   34.638   51.822   31.556   35.504   14.634   39.338   14.602 -3.833706 20.67343 
1 1 1    3   13   48 o   30.269   9.0775   13.459   22.705 -27.2198   32.974   50.136   31.310   22.572   10.995   37.965   14.447 -15.39241 18.15506 
1 1 1    3   13   49 o   26.037   8.5023   6.8180   21.475  -0.0028   30.825   13.250   29.935   24.942   11.724   27.132   12.317 -2.190559 17.00453 
1 1 1    3   14    0 o  593.442   4.8558  7270.10  168.030  7270.10  168.030  7270.10  168.030  593.442   6.8671  593.442   6.8671 0.000000 0.000000 
1 1 1    3   14    1 o  655.330   4.5825  8865.14  123.840  8929.77  177.007  8803.18  173.323  657.664   6.5256  652.996   6.4355 4.668091 9.165076 
1 1 1    3   14    2 o  350.939   5.6046  2541.96   81.123  2541.96   81.123   0.0000   0.0000  350.939   5.6046  ?   ?       ?      ? 
1 1 1    3   14    3 o  302.279   2.7484  1883.70   33.799  1876.67   44.256  1893.54   52.356  301.613   3.5576  302.945   4.1902 -1.331879 5.496765 
1 1 1    3   14    4 o  208.533   2.2374  889.196   18.351  871.611   22.646  922.826   31.317  205.565   2.6710  211.501   3.5901 -5.936066 4.474739 
1 1 1    3   14    5 o  351.507   3.0352  2552.68   43.636  2575.35   58.215  2523.62   65.921  353.303   3.9951  349.711   4.5704 3.591431 6.070321 
1 1 1    3   14    6 o  406.029   3.3769  3396.77   55.728  3370.88   72.731  3433.60   86.728  404.181   4.3629  407.876   5.1554 -3.695526 6.753768 
1 1 1    3   14    7 o  181.772   2.4550  673.124   16.553  662.469   19.452  701.092   31.515  179.212   2.6316  184.333   4.1452 -5.120300 4.910048 
1 1 1    3   14    8 o  265.514   2.4989  1453.08   26.384  1449.48   33.150  1459.31   43.579  265.079   3.0321  265.948   3.9730 -0.8691101 4.997820 
1 1 1    3   14    9 o  316.613   2.7499  2069.11   34.730  2071.59   43.868  2064.96   56.846  316.887   3.3565  316.339   4.3569 0.5472412 5.499890 
1 1 1    3   14   10 o  469.750   3.6080  4558.10   67.726  4568.15   85.798  4541.50  110.316  470.491   4.4214  469.009   5.7028 1.482513 7.216017 
1 1 1    3   14   11 o  333.912   3.0186  2294.53   40.963  2264.13   53.375  2338.09   63.895  331.248   3.9068  336.576   4.6028 -5.328278 6.037255 
1 1 1    3   14   12 o  139.723   2.3172  405.123   12.848  411.555   16.175  394.125   21.150  141.244   2.7765  138.202   3.7105 3.042130 4.634330 
1 1 1    3   14   13 o  324.795   3.5209  2186.35   46.599  2234.58   61.700  2122.30   71.095  329.013   4.5468  320.576   5.3770 8.436432 7.041713 
1 1 1    3   14   14 o   96.132   2.9946  189.275   11.827  172.106   15.929  210.370   17.656   91.311   4.2296  100.953   4.2404 -9.641327 5.989216 
1 1 1    3   14   15 o  207.101   2.4309  884.657   20.754  899.453   29.906  870.911   28.826  208.769   3.4732  205.433   3.4021 3.336060 4.861820 
1 1 1    3   14   16 o  252.167   2.7856  1308.84   28.517  1333.69   44.642  1291.71   37.064  254.162   4.2586  250.172   3.5921 3.990158 5.571244 
1 1 1    3   14   17 o  290.920   3.3658  1742.23   37.886  1731.19   46.108  1765.18   66.474  289.585   3.8604  292.255   5.5147 -2.669891 6.731627 
1 1 1    3   14   18 o  112.270   2.9860  259.692   13.810  274.559   20.113  246.430   18.997  115.303   4.2293  109.238   4.2164 6.065559 5.972004 
1 1 1    3   14   19 o  291.843   2.7559  1758.68   33.168  1769.86   47.346  1747.90   46.480  292.752   3.9212  290.934   3.8735 1.817780 5.511756 
1 1 1    3   14   20 o   78.399   4.0300  129.666   12.774  105.123   18.648  151.361   17.533   71.241   6.3465   85.557   4.9686 -14.31609 8.060063 
1 1 1    3   14   21 o   38.386   7.4182   27.105   12.628   51.581   20.733   12.672   15.922   48.791   10.606   27.980   10.375 20.81155 14.83647 
1 1 1    3   14   22 o  143.456   3.5972  425.255   21.257  418.454   29.234  432.885   30.964  142.249   4.9828  144.663   5.1896 -2.414932 7.194401 
1 1 1    3   14   23 o  137.165   3.6764  381.166   20.569  333.332   26.799  449.745   32.088  126.920   5.1195  147.411   5.2778 -20.49033 7.352848 
1 1 1    3   14   24 o   96.685   3.9113  192.361   15.544  179.093   20.951  208.604   23.181   93.005   5.4618  100.365   5.6001 -7.360291 7.822546 
1 1 1    3   14   25 o   67.359   5.2340   95.143   14.398   86.856   21.307  102.108   19.534   64.590   7.9981   70.127   6.7535 -5.537033 10.46801 
1 1 1    3   14   26 o  252.067   5.0307  1318.51   49.749  1327.12   84.684  1313.97   61.475  252.394   8.1350  251.740   5.9208 0.6535950 10.06149 
1 1 1    3   14   27 o  190.902   2.8836  753.678   22.701  737.992   32.111  769.350   32.096  188.910   4.1213  192.893   4.0344 -3.982895 5.767219 
1 1 1    3   14   28 o   62.090   5.9875   81.284   15.177   70.953   22.034   90.609   20.935   58.233   9.1741   65.948   7.6967 -7.714207 11.97509 
1 1 1    3   14   29 o   51.263   7.7780   57.424   15.954   58.964   22.693   55.919   22.434   51.967   10.934   50.560   11.065 1.407318 15.55605 
1 1 1    3   14   30 o  126.709   3.6793  333.024   19.222  322.110   27.094  344.084   27.275  124.609   5.2719  128.809   5.1340 -4.199936 7.358688 
1 1 1    3   14   31 o   83.009   5.8177  145.125   19.827  154.534   27.409  134.798   28.716   85.924   7.7342   80.094   8.6927 5.829582 11.63535 
1 1 1    3   14   32 o   70.362   6.1975  102.951   17.835  123.547   26.910   86.818   23.817   76.595   8.5181   64.130   9.0044 12.46491 12.39508 
1 1 1    3   14   33 o   86.404   5.0732  156.848   18.054  146.987   25.451  166.836   25.615   83.624   7.3793   89.184   6.9637 -5.559868 10.14631 
1 1 1    3   14   34 f   79.964   6.7303  139.066   21.781  124.238   32.978  150.539   29.008   75.777   10.552   84.151   8.3578 -8.373947 13.46068 
1 1 1    3   14   35 o   84.069   6.1562  156.024   20.231  167.825   25.543  136.159   33.140   89.056   6.9541   79.082   10.160 9.974152 12.31232 
1 1 1    3   14   36 o   32.356   7.9408   12.317   16.041 -19.1722   22.964   42.324   22.417   21.909   10.241   42.803   12.139 -20.89433 15.88169 
1 1 1    3   14   37 o   30.304   8.5328   13.587   16.088   18.700   23.183   8.8379   22.345   32.186   12.387   28.423   11.739 3.763330 17.06566 
1 1 1    3   14   38 o   37.927   8.1868   30.077   16.365   2.8402   23.243   56.853   23.046   26.857   11.570   48.997   11.586 -22.13958 16.37362 
1 1 1    3   14   39 o   28.177   8.1318   2.7929   16.611 -19.8467   23.510   25.365   23.475   21.787   10.240   34.567   12.635 -12.77959 16.26355 
1 1 1    3   14   40 o   48.171   8.5100   57.040   16.894   52.115   24.640   61.409   23.208   45.819   12.631   50.523   11.407 -4.703648 17.01998 
1 1 1    3   14   41 o   35.957   9.3459   26.613   20.038   2.7066   29.415   47.312   27.371   28.884   12.718   43.031   13.698 -14.14648 18.69174 
1 1 1    3   14   42 o   43.258   10.043   49.611   20.743   52.129   28.742   46.876   29.966   44.363   14.028   42.153   14.375 2.210339 20.08567 
1 1 1    3   14   43 o   40.230   8.9682   38.953   17.717   66.305   27.339   19.146   23.264   49.800   13.125   30.661   12.225 19.13946 17.93635 
1 1 1    3   14   44 o   36.854   7.4352   28.877   15.731  -9.7721   22.403   66.465   22.093   22.180   10.281   51.528   10.744 -29.34892 14.87050 
1 1 1    3   14   45 o   24.036   7.6588  -3.9532   16.664 -19.8484   23.646   11.730   23.488   20.630   9.8613   27.441   11.721 -6.810513 15.31767 
1 1 1    3   14   46 f   33.540   9.2565   30.642   18.518   34.761   26.824   26.891   25.597   34.891   13.349   32.190   12.827 2.701458 18.51305 
1 1 1    3   14   47 o   26.083   8.4991  -0.5956   21.788 -18.2587   31.803   15.027   29.910   23.466   11.275   28.699   12.721 -5.233387 16.99829 
1 1 1    3   14   48 o   32.965   9.7102   35.481   22.043   30.533   33.024   39.457   29.603   31.706   13.724   34.225   13.740 -2.519295 19.42036 
1 1 1    3   14   49 o   27.530   9.2833   7.7741   28.149   12.110   33.098  -3.5604   53.515   27.183   12.564   27.877   13.670 -0.6941853 18.56654 
1 1 1    3   15    0 o  101.752   1.8887  213.976   11.192  213.976   11.192  213.976   11.192  101.752   2.6710  101.752   2.6710 0.000000 0.000000 
1 1 1    3   15    1 o  172.949   1.9953  617.027   14.232  621.967   20.082  612.042   20.173  173.645   2.8040  172.253   2.8395 1.391510 3.990633 
1 1 1    3   15    2 o  638.185   5.2792  8434.28  126.345  8463.26  150.286  8364.42  233.320  640.294   5.6908  636.076   8.8936 4.217712 10.55848 
1 1 1    3   15    3 o  596.733   4.5568  7360.67  111.285  7416.33  148.733  7289.88  167.737  599.348   6.0168  594.117   6.8453 5.231262 9.113689 
1 1 1    3   15    4 o  677.343   5.1150  9479.25  141.441  9493.22  187.224  9460.68  215.877  678.004   6.6952  676.682   7.7349 1.322754 10.23010 
1 1 1    3   15    5 o  256.224   2.5336  1357.92   26.565  1384.20   35.610  1324.95   39.891  259.033   3.3332  253.415   3.8166 5.618027 5.067189 
1 1 1    3   15    6 o  318.114   3.2942  2073.43   39.884  2050.06   47.794  2127.06   72.386  315.224   3.6761  321.004   5.4674 -5.779449 6.588308 
1 1 1    3   15    7 o  297.650   3.6209  1827.86   44.451  1827.86   44.451   0.0000   0.0000  297.650   3.6209  ?   ?       ?      ? 
1 1 1    3   15    8 o  181.186   2.2066  671.016   15.754  656.713   19.477  698.083   26.793  178.428   2.6466  183.944   3.5316 -5.515747 4.413228 
1 1 1    3   15    9 o  160.525   2.1980  531.043   13.959  529.616   17.419  533.605   23.335  160.233   2.6357  160.818   3.5182 -0.5847473 4.395940 
1 1 1    3   15   10 o  278.647   2.6069  1593.36   28.686  1572.16   35.625  1632.47   48.378  276.048   3.1290  281.245   4.1706 -5.196655 5.213830 
1 1 1    3   15   11 o  159.643   2.9005  524.466   17.572  522.097   21.042  529.926   31.941  159.074   3.2071  160.212   4.8338 -1.137939 5.801013 
1 1 1    3   15   12 o  407.180   3.8949  3410.08   61.226  3384.05   74.334  3464.98  107.965  404.884   4.4513  409.477   6.3927 -4.592743 7.789850 
1 1 1    3   15   13 o  148.466   3.0026  451.502   17.987  471.641   28.857  438.706   23.002  151.138   4.6292  145.793   3.8252 5.344360 6.005166 
1 1 1    3   15   14 o  161.243   2.4441  544.784   15.693  570.940   20.033  503.243   25.246  166.346   2.9199  156.141   3.9202 10.20596 4.888175 
1 1 1    3   15   15 o  188.392   2.6108  730.600   20.114  717.970   26.650  747.317   30.660  186.516   3.4643  190.269   3.9069 -3.753448 5.221601 
1 1 1    3   15   16 o  272.326   3.4066  1531.09   37.161  1535.76   60.252  1528.23   47.210  272.605   5.3588  272.047   4.2075 0.5581970 6.813254 
1 1 1    3   15   17 o  231.444   2.7971  1103.25   26.304  1089.99   34.271  1122.26   41.037  229.780   3.6162  233.108   4.2683 -3.327621 5.594166 
1 1 1    3   15   18 o   40.429   6.0993   33.158   10.729   61.354   16.206   11.159   14.315   54.411   7.2215   26.447   9.8314 27.96404 12.19865 
1 1 1    3   15   19 o  146.103   2.8654  442.042   17.040  434.367   26.194  447.674   22.438  144.979   4.3805  147.227   3.6951 -2.248535 5.730830 
1 1 1    3   15   20 o  228.385   2.6039  1075.70   24.510  1030.68   33.930  1124.83   35.444  223.394   3.6826  233.375   3.6824 -9.980240 5.207799 
1 1 1    3   15   21 o  276.697   2.7151  1581.43   30.985  1569.75   43.654  1593.29   43.986  275.667   3.8395  277.726   3.8400 -2.059601 5.430236 
1 1 1    3   15   22 o  135.936   3.2328  381.968   18.118  397.361   25.873  367.156   25.380  138.627   4.5251  133.246   4.6182 5.380264 6.465670 
1 1 1    3   15   23 o  123.185   3.2792  311.013   16.515  334.388   25.418  293.937   21.725  127.138   4.8473  119.232   4.4178 7.906197 6.558457 
1 1 1    3   15   24 o  168.971   2.7880  590.033   19.427  603.236   27.677  577.210   27.276  170.836   3.9281  167.107   3.9574 3.728683 5.575950 
1 1 1    3   15   25 o  142.614   3.4032  424.960   19.673  396.926   30.211  445.600   25.922  138.438   5.2910  146.790   4.2817 -8.351074 6.806424 
1 1 1    3   15   26 o  191.695   3.1612  764.705   24.618  733.102   37.829  787.920   32.422  188.181   4.8740  195.209   4.0270 -7.028137 6.322330 
1 1 1    3   15   27 o   58.320   7.3470   77.991   16.068   56.375   26.399   90.710   20.251   50.628   12.672   66.013   7.4379 -15.38519 14.69397 
1 1 1    3   15   28 o   27.073   8.2285  -1.3660   16.029   3.4757   26.396  -4.1944   20.175   29.957   12.593   24.188   10.594 5.768612 16.45704 
1 1 1    3   15   29 o   45.978   7.3159   33.693   17.169  -7.6001   22.164   95.642   27.147   24.507   10.902   67.449   9.7585 -42.94189 14.63184 
1 1 1    3   15   30 o   85.306   5.7637  158.722   19.348  181.360   25.155  125.929   30.276   93.301   6.5369   77.311   9.4947 15.98946 11.52743 
1 1 1    3   15   31 o  132.082   3.8720  360.219   21.017  397.473   31.335  329.753   28.336  138.241   5.4957  125.923   5.4560 12.31831 7.744043 
1 1 1    3   15   32 o   92.193   5.4829  178.738   20.596  177.941   31.625  179.326   27.141   91.877   8.3456   92.509   7.1133 -0.6319046 10.96579 
1 1 1    3   15   33 o   85.037   5.2768  151.319   18.272  188.153   27.125  120.724   24.722   94.559   6.9552   75.515   7.9375 19.04386 10.55360 
1 1 1    3   15   34 o   42.575   8.7834   41.204   16.450   46.342   23.414   36.195   23.117   44.960   12.280   40.190   12.562 4.769379 17.56688 
1 1 1    3   15   35 o   32.036   9.1006   4.9091   20.849   33.181   28.633 -27.0012   30.419   39.384   14.011   24.687   11.618 14.69759 18.20112 
1 1 1    3   15   36 o   44.045   8.2080   44.154   16.691   18.010   23.491   70.812   23.721   32.275   12.456   55.816   10.693 -23.54158 16.41607 
1 1 1    3   15   37 o   71.104   5.8591  110.675   17.024  126.430   23.995   94.706   24.157   76.526   7.6024   65.682   8.9174 10.84380 11.71817 
1 1 1    3   15   38 o   30.263   8.7661   12.286   17.473   14.853   24.558   9.6541   24.865   31.026   12.494   29.500   12.299 1.525185 17.53217 
1 1 1    3   15   39 o   43.718   8.8594   46.640   16.803   47.649   23.418   45.570   24.123   44.247   12.358   43.188   12.698 1.059402 17.71882 
1 1 1    3   15   40 o   38.648   8.4843   32.555   20.072 -25.9969   33.375   65.734   25.124   25.395   12.017   51.900   11.980 -26.50469 16.96852 
1 1 1    3   15   41 o   29.975   8.6064   14.012   17.093   22.994   23.266   3.4787   25.195   32.735   12.454   27.215   11.882 5.520449 17.21289 
1 1 1    3   15   42 o   49.457   8.8999   64.001   18.216   57.909   27.688   68.650   24.188   46.454   13.589   52.460   11.497 -6.006203 17.79975 
1 1 1    3   15   43 o   57.895   7.2823   82.011   16.715   65.113   23.789   98.486   23.490   50.408   11.672   65.381   8.7110 -14.97330 14.56456 
1 1 1    3   15   44 o   55.606   7.9527   79.432   17.901   98.758   25.822   61.550   24.838   63.839   9.8070   47.374   12.522 16.46520 15.90549 
1 1 1    3   15   45 o   38.581   9.1771   42.593   17.315   39.840   25.092   45.095   23.925   37.348   13.134   39.814   12.821 -2.466438 18.35420 
1 1 1    3   15   46 o   25.617   7.9467   3.2005   17.052 -15.4081   23.934   22.382   24.300   21.107   10.042   30.127   12.319 -9.020527 15.89340 
1 1 1    3   15   47 o   39.346   11.119   58.200   27.183   74.571   41.315   45.705   36.095   42.639   16.501   36.052   14.907 6.586452 22.23741 
1 1 1    3   15   48 o   28.133   8.8861   16.333   20.962   29.009   31.663   6.4429   27.968   30.774   13.379   25.493   11.698 5.281452 17.77215 
1 1 1    3   16    0 o   92.973   2.7228  179.219   14.708  179.219   14.708  179.219   14.708   92.973   3.8506   92.973   3.8506 0.000000 0.000000 
1 1 1    3   16    1 f   99.025   2.0050  201.248   8.1194  194.807   10.728  209.887   12.423   97.181   2.6764  100.869   2.9861 -3.688400 4.010026 
1 1 1    3   16    2 o  176.990   2.4737  640.452   16.768  630.844   20.178  661.892   30.142  174.878   2.7976  179.102   4.0804 -4.224365 4.947370 
1 1 1    3   16    3 o  184.672   2.6091  698.547   18.313  690.684   21.921  716.714   33.321  182.981   2.9046  186.363   4.3350 -3.381546 5.218126 
1 1 1    3   16    4 o  367.226   3.1232  2784.92   46.863  2797.23   62.247  2768.81   71.201  368.182   4.0991  366.270   4.7133 1.911713 6.246407 
1 1 1    3   16    5 f  510.007   4.2904  5371.52   90.247  5383.67  128.058  5359.52  127.203  510.578   6.0811  509.435   6.0540 1.143158 8.580821 
1 1 1    3   16    6 o  543.087   6.2468  6196.60  126.055  6325.88  149.707  5881.66  233.671  553.361   6.5595  532.813   10.633 20.54822 12.49367 
1 1 1    3   16    7 o  326.341   3.2443  2197.66   38.945  2196.91   45.700  2199.64   74.428  326.308   3.3957  326.373   5.5291 -0.6472778E-01 6.488586 
1 1 1    3   16    8 o  296.851   2.6327  1827.82   31.415  1861.84   40.355  1775.50   50.048  300.397   3.2571  293.305   4.1372 7.092499 5.265439 
1 1 1    3   16    9 o  329.639   2.9437  2248.41   39.900  2333.93   55.001  2153.40   57.971  336.286   3.9655  322.993   4.3516 13.29327 5.887436 
1 1 1    3   16   10 o  195.277   2.3084  790.939   17.942  802.887   22.673  770.926   29.344  197.275   2.7866  193.280   3.6810 3.995392 4.616830 
1 1 1    3   16   11 o  174.363   2.3185  626.637   16.020  624.778   20.031  629.935   26.683  174.020   2.7909  174.707   3.7030 -0.6872711 4.636985 
1 1 1    3   16   12 o  324.589   3.5169  2178.63   46.201  2189.77   59.915  2162.29   72.565  325.662   4.4607  323.517   5.4383 2.145386 7.033710 
1 1 1    3   16   13 o  342.296   2.9459  2415.81   40.115  2407.22   50.418  2430.64   66.222  341.517   3.5794  343.075   4.6800 -1.558044 5.891887 
1 1 1    3   16   14 o  331.044   3.0254  2268.43   41.034  2314.26   55.263  2212.10   61.261  334.807   4.0019  327.281   4.5384 7.525970 6.050814 
1 1 1    3   16   15 o  157.094   2.6549  510.444   17.133  521.177   23.354  497.934   25.212  158.895   3.5636  155.294   3.9363 3.600479 5.309787 
1 1 1    3   16   16 o  263.664   3.0777  1437.80   31.618  1441.60   38.832  1430.31   54.462  264.253   3.5629  263.075   5.0194 1.177612 6.155331 
1 1 1    3   16   17 o  124.961   3.0447  322.068   15.295  325.126   24.603  320.142   19.526  125.418   4.7563  124.504   3.8024 0.9134674 6.089384 
1 1 1    3   16   18 o  185.175   2.7063  708.558   20.548  710.960   27.628  705.586   30.738  185.543   3.6103  184.807   4.0326 0.7352905 5.412570 
1 1 1    3   16   19 o  209.217   2.5377  903.254   21.887  924.776   31.576  883.351   30.365  211.612   3.6178  206.823   3.5597 4.789124 5.075456 
1 1 1    3   16   20 o   84.494   3.5995  148.934   12.434  133.624   18.175  162.404   17.049   80.356   5.4840   88.631   4.6638 -8.274460 7.198960 
1 1 1    3   16   21 o   28.733   7.2414   14.460   11.089   7.9261   16.394   19.971   15.056   26.076   10.305   31.390   10.177 -5.314718 14.48288 
1 1 1    3   16   22 o   87.110   3.8478  158.080   13.651  150.384   20.735  163.969   18.137   85.196   5.9009   89.023   4.9397 -3.827057 7.695504 
1 1 1    3   16   23 o   72.558   4.9064  111.418   14.392   95.050   21.539  124.618   19.343   67.591   7.7264   77.526   6.0494 -9.934494 9.812878 
1 1 1    3   16   24 o  181.410   2.7602  680.274   20.645  679.357   29.557  681.148   28.850  181.285   3.9531  181.535   3.8532 -0.2495575 5.520305 
1 1 1    3   16   25 o   95.033   4.4457  183.991   17.244  212.295   26.858  164.141   22.492  101.122   6.4396   88.945   6.1310 12.17702 8.891446 
1 1 1    3   16   26 o  144.511   3.4486  430.762   20.073  439.872   32.200  424.972   25.671  145.696   5.3585  143.326   4.3427 2.370331 6.897285 
1 1 1    3   16   27 o  107.725   4.3947  237.957   19.131  226.620   24.451  255.852   30.720  104.521   5.6719  110.928   6.7144 -6.406479 8.789452 
1 1 1    3   16   28 o   83.925   4.6829  145.937   16.084  172.827   23.530  122.352   22.036   91.192   6.2561   76.658   6.9698 14.53468 9.365702 
1 1 1    3   16   29 o  125.761   3.6118  328.379   18.714  322.537   26.962  333.810   25.995  124.660   5.2439  126.862   4.9682 -2.201485 7.223686 
1 1 1    3   16   30 o  123.707   4.0816  318.310   20.814  332.961   29.776  304.310   29.107  126.502   5.7070  120.912   5.8367 5.589867 8.163121 
1 1 1    3   16   31 o   94.931   4.5244  188.584   17.672  178.522   25.400  198.025   24.604   92.422   6.6635   97.440   6.1221 -5.018364 9.048826 
1 1 1    3   16   32 f   42.278   9.0524   39.970   17.344   32.462   25.345   46.582   23.784   39.172   13.222   45.384   12.368 -6.212051 18.10488 
1 1 1    3   16   33 o   95.635   5.4677  195.795   21.312  178.358   31.736  210.116   28.761   91.479   8.4115   99.792   6.9879 -8.313484 10.93546 
1 1 1    3   16   34 o   52.125   8.6628   64.856   18.578   48.041   29.963   75.358   23.679   45.387   14.320   58.863   9.7534 -13.47609 17.32564 
1 1 1    3   16   35 f   34.312   10.538 -13.7016   30.874   32.368   43.014 -62.6625   44.343   42.049   16.668   26.574   12.900 15.47543 21.07655 
1 1 1    3   16   36 f   31.626   9.0272   15.050   18.151   19.491   23.262   8.1373   29.023   32.391   12.422   30.860   13.101 1.530239 18.05433 
1 1 1    3   16   37 o   54.168   12.307   54.623   23.908   41.615   25.848  131.640   62.897   41.610   13.318   66.727   20.699 -25.11673 24.61345 
1 1 1    3   16   38 o   49.576   9.0269   59.748   18.386   59.525   28.737   59.903   23.923   49.013   13.689   50.140   11.770 -1.126991 18.05371 
1 1 1    3   16   39 o   39.861   8.9346   38.520   16.566   45.786   24.253   32.165   22.681   42.910   12.762   36.812   12.507 6.098061 17.86914 
1 1 1    3   16   40 o   33.988   9.9376   19.970   22.805   11.366   35.707   25.898   29.637   32.817   14.238   35.158   13.867 -2.340435 19.87519 
1 1 1    3   16   41 o   30.483   8.5377   16.665   16.206   8.6415   22.502   25.311   23.360   27.468   11.592   33.497   12.538 -6.028828 17.07531 
1 1 1    3   16   42 o   21.631   7.1400 -13.2100   15.699  -8.9817   22.689 -17.0940   21.745   22.674   10.453   20.588   9.7292 2.086073 14.27992 
1 1 1    3   16   43 o   23.044   7.6041 -11.4110   17.496 -11.5247   22.776 -11.2472   27.328   21.988   10.251   24.101   11.234 -2.113049 15.20819 
1 1 1    3   16   44 o   31.162   8.3663   20.479   16.794  -3.1890   24.761   40.643   22.855   24.202   11.069   38.122   12.548 -13.91963 16.73255 
1 1 1    3   16   45 o   26.570   8.0871   9.4219   16.376   0.1580   23.619   17.999   22.726   24.258   10.983   28.882   11.873 -4.624100 16.17425 
1 1 1    3   16   46 o   26.475   8.5188   2.9508   20.664   18.677   30.174 -10.9402   28.359   29.573   12.954   23.377   11.066 6.196018 17.03765 
1 1 1    3   16   47 o   26.733   8.9619 -11.6282   26.929   30.950   39.976 -46.9975   36.435   31.995   14.406   21.471   10.665 10.52418 17.92376 
1 1 1    3   16   48 o   29.339   9.1385   24.306   21.553   21.227   31.281   27.090   29.739   28.720   12.851   29.958   12.996 -1.237879 18.27697 
1 1 1    3   17    0 o  544.713   3.9028  6124.91  123.974  6124.91  123.974  6124.91  123.974  544.713   5.5195  544.713   5.5195 0.000000 0.000000 
1 1 1    3   17    1 o  428.639   3.9737  3771.32   65.400  3732.05   78.963  3857.12  116.705  425.215   4.5025  432.063   6.5490 -6.848022 7.947444 
1 1 1    3   17    2 o  210.245   2.1300  910.919   18.452  890.776   25.422  933.344   26.823  207.792   2.9663  212.697   3.0576 -4.904297 4.260069 
1 1 1    3   17    3 f  189.639   2.1670  742.577   16.286  744.191   20.394  739.735   27.060  189.936   2.6033  189.343   3.4650 0.5923309 4.334024 
1 1 1    3   17    4 o  534.918   4.4653  5910.12   98.482  5976.69  141.453  5847.49  137.194  537.831   6.3768  532.005   6.2525 5.825195 8.930654 
1 1 1    3   17    5 o  422.426   4.1435  3699.92   71.330  3781.41   94.468  3591.84  108.794  427.916   5.3526  416.937   6.3266 10.97842 8.287057 
1 1 1    3   17    6 o  223.288   3.6838  1027.45   26.305  1026.23   29.118  1032.89   61.342  223.021   3.1656  223.554   6.6529 -0.5321808 7.367609 
1 1 1    3   17    7 o  417.476   3.9089  3619.35   63.940  3663.42   79.192  3536.83  108.375  421.252   4.5580  413.700   6.3515 7.551697 7.817750 
1 1 1    3   17    8 o   94.239   3.2440  182.951   10.716  182.586   12.258  184.132   22.066   94.069   3.1595   94.409   5.6668 -0.3399887 6.488070 
1 1 1    3   17    9 o  147.850   2.2161  446.945   12.908  437.516   15.954  464.810   21.962  145.626   2.6562  150.075   3.5481 -4.449066 4.432208 
1 1 1    3   17   10 o  187.982   2.2964  730.425   17.154  733.796   21.571  724.628   28.292  188.589   2.7733  187.374   3.6609 1.214859 4.592747 
1 1 1    3   17   11 o  322.088   2.8406  2135.33   36.283  2119.06   45.364  2164.24   60.447  320.435   3.4325  323.742   4.5270 -3.307495 5.681171 
1 1 1    3   17   12 o  418.234   3.9087  3629.38   64.030  3661.69   79.205  3568.46  108.777  421.073   4.5607  415.395   6.3491 5.677887 7.817338 
1 1 1    3   17   13 o  260.182   2.7205  1394.07   28.814  1376.10   37.707  1419.29   44.670  258.194   3.5409  262.169   4.1311 -3.974762 5.440930 
1 1 1    3   17   14 o  102.049   3.2140  217.102   13.403  192.349   19.524  239.169   18.433   96.482   4.9062  107.616   4.1530 -11.13371 6.427933 
1 1 1    3   17   15 o  287.940   2.7091  1716.54   31.215  1730.54   39.693  1693.84   50.535  289.532   3.3239  286.348   4.2789 3.183990 5.418240 
1 1 1    3   17   16 o  210.802   2.7698  923.583   22.059  932.202   26.421  903.748   40.080  212.507   3.0145  209.096   4.6475 3.410385 5.539517 
1 1 1    3   17   17 o  211.956   2.6091  929.590   22.556  939.977   29.853  915.771   34.433  213.362   3.3924  210.549   3.9651 2.813583 5.218237 
1 1 1    3   17   18 o  174.905   3.2243  624.744   21.432  613.186   25.611  651.750   39.150  172.313   3.6036  177.497   5.3478 -5.183960 6.448650 
1 1 1    3   17   19 o  106.778   3.0321  237.241   13.263  214.716   19.262  257.547   18.288  101.909   4.5826  111.647   3.9716 -9.737694 6.064133 
1 1 1    3   17   20 o  223.965   2.5736  1036.18   23.770  1039.56   33.907  1032.91   33.333  224.322   3.6649  223.609   3.6142 0.7123413 5.147225 
1 1 1    3   17   21 o  198.779   3.1995  820.398   25.905  839.192   34.268  795.339   39.570  201.493   4.1235  196.065   4.8933 5.427887 6.399051 
1 1 1    3   17   22 f  284.290   2.7579  1670.26   32.335  1651.62   45.377  1689.48   46.087  282.680   3.8920  285.899   3.9084 -3.219421 5.515751 
1 1 1    3   17   23 o  125.445   3.2138  324.422   16.562  313.672   22.295  337.659   24.739  123.148   4.3894  127.743   4.6956 -4.594711 6.427696 
1 1 1    3   17   24 o   64.657   5.2854   86.140   13.769   90.928   22.222   83.157   17.543   66.046   8.1577   63.269   6.7226 2.776615 10.57083 
1 1 1    3   17   25 o  174.154   3.7126  645.305   24.741  677.107   30.274  581.357   42.929  180.951   4.0565  167.357   6.2193 13.59357 7.425269 
1 1 1    3   17   26 o  153.192   3.0731  486.357   19.387  464.057   27.730  507.682   27.116  149.733   4.4902  156.650   4.1970 -6.916397 6.146227 
1 1 1    3   17   27 o  146.716   5.5430  446.579   33.542   0.0000   0.0000  446.579   33.542  ?   ?   146.716   5.5430      ?      ? 
1 1 1    3   17   28 o   87.941   4.5611  162.833   16.342  137.912   23.581  185.862   22.668   81.315   7.0311   94.568   5.8118 -13.25241 9.122143 
1 1 1    3   17   29 o   89.519   4.6859  169.053   17.050  137.758   24.297  199.418   23.933   81.161   7.2583   97.877   5.9285 -16.71558 9.371738 
1 1 1    3   17   30 o   50.981   8.2522   57.413   16.982   66.006   25.008   50.060   23.133   54.575   11.474   47.387   11.863 7.188095 16.50441 
1 1 1    3   17   31 o   76.369   5.3746  123.006   16.835  139.989   24.135  106.911   23.495   81.598   7.1713   71.141   8.0075 10.45692 10.74930 
1 1 1    3   17   32 o   47.315   8.4687   51.224   16.857   64.186   23.674   37.894   24.008   53.441   11.103   41.189   12.790 12.25280 16.93739 
1 1 1    3   17   33 o   27.985   8.5131   1.6566   17.742   2.4746   25.581   0.8983   24.629   28.434   12.191   27.536   11.886 0.8982716 17.02626 
1 1 1    3   17   34 o   34.515   9.2260   15.611   18.099   2.0099   22.536   40.322   30.376   26.702   11.445   42.328   14.474 -15.62626 18.45207 
1 1 1    3   17   35 o   73.744   6.8673  116.277   19.692  131.453   34.875  109.174   23.859   76.452   11.060   71.037   8.1432 5.415154 13.73456 
1 1 1    3   17   36 o   41.623   9.4810   43.437   19.322   53.299   22.998   19.767   35.628   47.322   11.818   35.924   14.829 11.39753 18.96201 
1 1 1    3   17   37 o   34.161   9.0779   23.672   17.370   25.681   24.623   21.682   24.507   34.924   12.912   33.397   12.764 1.527157 18.15572 
1 1 1    3   17   38 o   24.071   7.6610  -5.5820   15.975  -6.0484   22.722  -5.1261   22.464   24.030   10.836   24.112   10.833 -0.8200455E-01 15.32207 
1 1 1    3   17   39 o   33.066   8.7825   23.220   16.244   21.701   23.672   24.572   22.332   32.651   12.529   33.480   12.310 -0.8295822 17.56490 
1 1 1    3   17   40 o   32.487   9.4041   15.853   20.949   32.395   29.464  -1.0559   29.790   37.014   14.032   27.961   12.524 9.052862 18.80818 
1 1 1    3   17   41 o   24.736   7.9917  -5.8427   17.765  -6.7353   28.662  -5.2858   22.638   25.914   11.873   23.558   10.701 2.355383 15.98346 
1 1 1    3   17   42 o   29.334   8.7506   13.351   18.027   17.801   27.099   9.8185   24.145   30.890   12.856   27.777   11.875 3.113583 17.50122 
1 1 1    3   17   43 o   29.145   9.7376  -7.9966   25.460 -17.7321   29.192   22.948   52.044   23.445   11.136   34.844   15.977 -11.39858 19.47524 
1 1 1    3   17   44 o   29.463   8.7324   17.358   17.969   21.658   23.463   11.256   27.946   30.482   12.234   28.445   12.463 2.036873 17.46472 
1 1 1    3   17   45 o   19.576   6.7090 -27.2981   16.894 -11.9171   24.142 -42.0553   23.648   21.758   10.273   17.395   8.6322 4.362331 13.41802 
1 1 1    3   17   46 o   34.238   9.7932   37.227   21.895   26.765   31.862   46.588   30.139   31.380   13.532   37.095   14.160 -5.715302 19.58632 
1 1 1    3   17   47 o   23.900   8.0823 -12.9895   22.756 -33.4426   31.616   8.9957   32.778   20.935   10.313   26.864   12.447 -5.929230 16.16453 
1 1 1    3   18    0 o  203.216   2.4457  852.639   28.971  852.639   28.971  852.639   28.971  203.216   3.4588  203.216   3.4588 0.000000 0.000000 
1 1 1    3   18    1 o  146.249   2.0687  442.317   12.372  449.562   16.527  433.084   18.658  147.619   2.7145  144.879   3.1224 2.739685 4.137405 
1 1 1    3   18    2 o  319.168   3.4432  2087.21   43.713  2043.69   54.709  2164.05   72.694  314.653   4.2156  323.683   5.4452 -9.029602 6.886311 
1 1 1    3   18    3 o  358.226   3.0635  2655.38   45.050  2720.84   61.259  2578.28   66.481  363.065   4.0909  353.387   4.5612 9.678802 6.127003 
1 1 1    3   18    4 o  140.768   2.3794  408.687   13.810  423.177   19.772  394.884   19.297  143.204   3.3476  138.333   3.3823 4.871017 4.758774 
1 1 1    3   18    5 o  303.417   3.3597  1905.41   41.392  1875.63   64.195  1926.60   54.153  301.347   5.1650  305.487   4.2980 -4.140442 6.719339 
1 1 1    3   18    6 o  147.138   3.5794  445.447   16.106  444.610   17.613  449.714   39.788  146.795   2.9091  147.481   6.5411 -0.6865540 7.158820 
1 1 1    3   18    7 o  224.513   2.8807  1047.99   24.799  1061.05   30.078  1020.26   43.822  226.757   3.2160  222.269   4.7803 4.488251 5.761391 
1 1 1    3   18    8 o  100.923   3.3361  215.348   11.574  219.591   13.205  201.287   24.041  103.159   3.1036   98.686   5.9064 4.472237 6.672147 
1 1 1    3   18    9 f   62.147   4.4107   74.038   8.5783   71.179   9.3596   89.048   21.447   58.720   3.8646   65.573   7.9299 -6.852982 8.821447 
1 1 1    3   18   10 o  129.273   3.1213  345.915   14.550  346.765   16.895  343.473   28.626  129.626   3.1602  128.920   5.3836 0.7056885 6.242584 
1 1 1    3   18   11 o  255.967   2.8433  1352.13   27.171  1351.14   32.186  1354.59   50.687  255.872   3.0499  256.061   4.7994 -0.1888428 5.686502 
1 1 1    3   18   12 o  135.699   2.3849  375.960   12.950  363.710   16.308  396.862   21.303  132.755   2.9785  138.644   3.7255 -5.889511 4.769740 
1 1 1    3   18   13 o  331.633   3.0239  2275.38   41.090  2303.57   55.237  2240.45   61.485  333.971   4.0101  329.295   4.5271 4.675507 6.047768 
1 1 1    3   18   14 o   45.046   3.8630   42.227   6.7965   42.767   8.3911   41.197   11.589   45.491   4.4723   44.601   6.2999 0.8899727 7.725922 
1 1 1    3   18   15 o  112.544   2.9914  264.077   13.579  273.937   17.648  249.768   21.260  115.167   3.7153  109.920   4.6894 5.247093 5.982812 
1 1 1    3   18   16 o   84.034   2.9635  149.286   9.7222  157.294   12.136  134.941   16.243   87.281   3.3713   80.787   4.8748 6.493858 5.927030 
1 1 1    3   18   17 o  129.451   2.8020  344.520   14.918  324.720   20.184  368.354   22.145  125.375   3.9033  133.526   4.0211 -8.151161 5.604043 
1 1 1    3   18   18 o  246.831   2.7534  1257.03   27.601  1248.47   35.961  1269.30   43.058  245.851   3.5464  247.812   4.2128 -1.961075 5.506795 
1 1 1    3   18   19 o  134.280   2.6029  370.529   13.785  365.842   17.096  379.238   23.306  133.107   3.1141  135.453   4.1716 -2.346222 5.205752 
1 1 1    3   18   20 o   54.967   5.1950   66.525   10.907   48.105   16.375   81.218   14.624   47.319   8.7112   62.615   5.6628 -15.29593 10.38996 
1 1 1    3   18   21 o   45.870   6.5594   47.279   11.913   33.035   18.405   57.549   15.628   39.118   10.966   52.621   7.2010 -13.50304 13.11887 
1 1 1    3   18   22 o   62.691   4.7679   81.138   12.241   85.534   18.636   77.802   16.234   64.156   7.0428   61.226   6.4288 2.929520 9.535780 
1 1 1    3   18   23 o   92.733   4.4521  186.093   16.238  213.036   21.095  146.919   25.437  101.428   5.0426   84.037   7.3387 17.39137 8.904210 
1 1 1    3   18   24 f  113.806   4.6156  271.192   21.274  256.712   32.888  281.609   27.896  111.087   7.1781  116.525   5.8043 -5.437225 9.231231 
1 1 1    3   18   25 o   36.111   7.4729   24.080   12.993   46.301   19.793   7.2529   17.224   46.016   10.641   26.206   10.495 19.81008 14.94588 
1 1 1    3   18   26 f  111.210   3.5694  255.496   16.342  270.312   24.012  242.711   22.305  114.198   5.0980  108.222   4.9972 5.976593 7.138725 
1 1 1    3   18   27 o   67.961   5.9586   91.049   16.195  127.888   26.870   70.033   20.295   78.127   8.3388   57.795   8.5139 20.33190 11.91730 
1 1 1    3   18   28 o  172.346   3.4246  609.677   23.828  585.329   30.440  648.206   38.291  168.045   4.3919  176.646   5.2557 -8.601685 6.849115 
1 1 1    3   18   29 o   64.024   6.1798   86.649   16.245   77.185   22.926   96.193   23.024   60.428   9.1985   67.620   8.2553 -7.192390 12.35970 
1 1 1    3   18   30 o   46.288   8.1727   47.908   15.719   58.661   22.601   37.833   21.878   51.308   11.010   41.268   12.081 10.03987 16.34548 
1 1 1    3   18   31 o   31.604   8.6754  -0.8357   17.744 -23.1863   22.160   39.090   29.618   20.830   9.8370   42.377   14.293 -21.54731 17.35071 
1 1 1    3   18   32 o   45.441   11.941   10.325   23.190  109.543   63.373  -5.0149   24.919   64.680   20.870   26.201   11.612 38.47968 23.88295 
1 1 1    3   18   33 o   28.523   8.3073   6.0392   16.159   17.416   23.565  -4.0584   22.201   32.204   12.462   24.843   10.988 7.361366 16.61455 
1 1 1    3   18   34 o   28.089   7.7642   3.3667   15.303 -23.1255   22.069   27.905   21.239   20.523   9.7289   35.655   12.103 -15.13203 15.52840 
1 1 1    3   18   35 o   55.156   7.0877   68.706   15.777   73.692   22.565   63.937   22.068   57.702   9.4818   52.610   10.538 5.091835 14.17547 
1 1 1    3   18   36 o   47.763   9.5253   56.591   20.092   69.947   27.843   42.080   29.022   53.711   12.758   41.814   14.148 11.89686 19.05061 
1 1 1    3   18   37 o   44.511   8.8559   48.293   16.977   52.893   24.321   43.921   23.709   46.561   12.431   42.461   12.616 4.099892 17.71182 
1 1 1    3   18   38 o   68.358   6.5558  108.940   16.827   68.406   23.746  149.820   23.847   53.538   11.117   83.178   6.9513 -29.63938 13.11162 
1 1 1    3   18   39 o   30.484   8.7444   15.355   17.572   2.2915   28.542   23.328   22.298   28.273   12.484   32.695   12.247 -4.422102 17.48880 
1 1 1    3   18   40 o   37.253   8.7772   34.278   15.997   43.228   23.355   26.367   21.957   40.966   12.597   33.539   12.225 7.427574 17.55447 
1 1 1    3   18   41 f   36.992   9.1641   35.572   17.116   37.013   26.542   34.546   22.394   37.434   13.471   36.550   12.427 0.8843460 18.32815 
1 1 1    3   18   42 o   20.114   6.7336 -20.2360   15.395 -38.3506   22.570  -4.4746   21.053   17.669   8.7059   22.560   10.275 -4.890852 13.46716 
1 1 1    3   18   43 o   18.641   6.5482 -43.7939   17.687 -36.9750   29.682 -47.5482   22.025   21.042   10.289   16.239   8.1027 4.802420 13.09630 
1 1 1    3   18   44 o   33.582   7.5560   19.488   16.581 -26.7824   23.909   62.367   23.016   19.506   9.4695   47.658   11.777 -28.15201 15.11191 
1 1 1    3   18   45 o   28.461   8.8978   12.278   21.232  -4.0793   30.341   27.975   29.722   25.099   11.744   31.823   13.370 -6.724192 17.79563 
1 1 1    3   18   46 o   33.808   9.7186   38.738   21.367   34.197   31.306   42.698   29.235   32.480   13.688   35.137   13.800 -2.656612 19.43713 
1 1 1    3   18   47 o   24.548   8.1580  -4.8638   21.308   19.226   31.526 -25.1260   28.913   28.301   12.763   20.794   10.165 7.506308 16.31608 
1 1 1    3   19    0 o  244.229   2.2638  1231.10   32.237  1231.10   32.237  1231.10   32.237  244.229   3.2015  244.229   3.2015 0.000000 0.000000 
1 1 1    3   19    1 o  367.450   3.1013  2788.92   46.570  2796.30   61.859  2779.26   70.753  368.041   4.0751  366.858   4.6760 1.183411 6.202583 
1 1 1    3   19    2 o  315.560   3.4200  2047.07   43.111  2019.10   54.379  2094.40   70.731  312.728   4.2160  318.393   5.3862 -5.665131 6.839989 
1 1 1    3   19    3 o  404.992   3.3477  3393.02   55.567  3440.84   74.805  3334.14   83.001  408.216   4.4430  401.768   5.0089 6.448029 6.695438 
1 1 1    3   19    4 o  442.138   3.8455  4023.07   69.819  4203.74  104.591  3877.84   93.771  451.026   5.6225  433.249   5.2477 17.77795 7.690921 
1 1 1    3   19    5 o  166.794   2.7655  576.667   18.706  560.949   29.041  587.813   24.455  164.826   4.2719  168.761   3.5134 -3.934235 5.531089 
1 1 1    3   19    6 o  230.927   3.7942  1099.20   27.746  1097.65   30.627  1106.30   65.533  230.624   3.2198  231.230   6.8714 -0.6062317 7.588424 
1 1 1    3   19    7 o  305.962   3.2617  1941.81   38.622  1957.72   47.187  1909.53   67.227  307.953   3.7151  303.971   5.3622 3.982727 6.523439 
1 1 1    3   19    8 f  131.780   3.0015  353.469   14.054  348.589   16.133  368.823   28.619  129.967   3.0097  133.592   5.1941 -3.625015 6.003097 
1 1 1    3   19    9 o   78.308   3.8594  114.690   10.706  104.632   12.097  151.049   23.000   71.181   4.1204   85.435   6.5271 -14.25439 7.718831 
1 1 1    3   19   10 o  164.865   2.3566  563.763   15.839  580.270   21.044  542.190   24.058  167.676   3.0429  162.055   3.5994 5.621445 4.713229 
1 1 1    3   19   11 o   86.316   5.3287  154.074   18.971  154.074   18.971   0.0000   0.0000   86.316   5.3287  ?   ?       ?      ? 
1 1 1    3   19   12 o  153.534   2.2971  485.569   13.976  482.707   17.466  490.664   23.305  152.930   2.7691  154.138   3.6658 -1.207306 4.594122 
1 1 1    3   19   13 o   84.614   2.7637  148.624   9.5065  152.513   12.525  143.340   14.600   85.939   3.5338   83.289   4.2502 2.649849 5.527336 
1 1 1    3   19   14 o  136.123   2.5755  382.310   14.371  379.458   19.251  385.900   21.598  135.560   3.4431  136.685   3.8312 -1.124802 5.151003 
1 1 1    3   19   15 o  217.707   3.0860  972.016   27.155  943.444   34.840  1016.24   43.346  213.704   3.9527  221.711   4.7402 -8.007172 6.171982 
1 1 1    3   19   16 o   62.874   3.2810   81.867   8.1627   82.196   10.207   81.284   13.596   63.073   3.9236   62.675   5.2597 0.3984108 6.561929 
1 1 1    3   19   17 o  117.438   2.8449  284.324   13.734  276.951   18.577  293.212   20.395  115.771   3.8905  119.105   4.1518 -3.333771 5.689727 
1 1 1    3   19   18 o   33.883   5.6627   25.456   7.4883   27.193   9.1486   21.929   13.035   35.672   6.4558   32.095   9.3052 3.577347 11.32542 
1 1 1    3   19   19 o   48.918   6.8802   60.840   9.6013   65.104   10.414   36.676   24.792   56.104   4.5005   41.732   13.004 14.37136 13.76035 
1 1 1    3   19   20 o  264.672   3.0431  1453.36   30.428  1460.44   36.404  1436.93   55.430  265.897   3.3194  263.448   5.1014 2.448090 6.086273 
1 1 1    3   19   21 o   75.406   5.1821  125.161   14.517  101.385   25.663  136.350   17.604   69.677   8.9300   81.135   5.2606 -11.45808 10.36429 
1 1 1    3   19   22 o   75.572   4.0617  119.948   12.451  108.272   18.844  128.994   16.587   72.222   6.3262   78.921   5.0959 -6.699249 8.123340 
1 1 1    3   19   23 o   95.529   3.6314  187.780   14.246  202.543   21.399  176.030   19.091   98.869   5.2478   92.190   5.0210 6.679321 7.262898 
1 1 1    3   19   24 o   38.429   8.6404   30.973   15.455   26.799   23.141   34.334   20.765   36.910   12.633   39.948   11.791 -3.038612 17.28078 
1 1 1    3   19   25 o  208.552   3.1825  899.715   27.357  855.490   38.093  946.814   39.312  203.257   4.5440  213.847   4.4571 -10.59052 6.365057 
1 1 1    3   19   26 o  201.319   3.0303  836.624   25.012  815.386   33.408  863.708   37.728  198.461   4.0815  204.177   4.4801 -5.715500 6.060515 
1 1 1    3   19   27 o   69.012   5.3669  100.079   15.208   95.051   22.225  104.505   20.854   67.318   8.0048   70.707   7.1509 -3.388397 10.73371 
1 1 1    3   19   28 o   64.908   7.0958   85.935   18.029   63.704   22.898  122.200   29.245   53.808   10.694   76.007   9.3290 -22.19930 14.19159 
1 1 1    3   19   29 o  103.666   5.8018  222.822   22.272  236.823   42.581  217.549   26.131  105.337   9.8010  101.996   6.2116 3.341225 11.60362 
1 1 1    3   19   30 o  117.006   3.9324  285.217   18.942  270.827   25.843  301.923   27.845  113.843   5.5039  120.168   5.6181 -6.324928 7.864852 
1 1 1    3   19   31 o   31.417   8.2739   16.743   14.896   6.1994   21.591   26.321   20.579   27.627   11.485   35.206   11.913 -7.578392 16.54787 
1 1 1    3   19   32 o  101.785   5.0500  220.067   21.106  220.867   31.366  219.405   28.532  101.813   7.4694  101.756   6.7984 0.5647278E-01 10.10002 
1 1 1    3   19   33 o   48.839   7.7544   55.066   15.840   36.040   22.641   73.308   22.170   39.652   12.438   58.027   9.2633 -18.37500 15.50878 
1 1 1    3   19   34 o   38.623   7.7649   33.627   14.794   9.2779   21.378   56.003   20.493   28.018   11.517   49.228   10.418 -21.20995 15.52971 
1 1 1    3   19   35 o   36.083   8.1659   28.069   15.077   9.8419   21.367   46.145   21.279   28.121   11.531   44.044   11.565 -15.92307 16.33178 
1 1 1    3   19   36 o   57.795   7.8540   75.395   18.199   98.187   28.093   58.915   23.889   65.974   10.324   49.617   11.839 16.35762 15.70807 
1 1 1    3   19   37 o   38.955   8.2516   33.242   16.062   60.256   23.693   10.267   21.849   49.795   11.729   28.114   11.609 21.68067 16.50316 
1 1 1    3   19   38 o   56.695   7.3240   75.809   16.614   65.145   23.806   85.934   23.197   51.698   11.465   61.691   9.1168 -9.993061 14.64801 
1 1 1    3   19   39 f   63.266   8.0390   96.896   20.452   92.794   29.701  100.595   28.204   60.992   12.233   65.540   10.434 -4.548172 16.07799 
1 1 1    3   19   40 o   25.116   7.7910   2.5427   15.497   5.7533   22.321  -0.4447   21.531   26.125   11.296   24.106   10.733 2.019020 15.58199 
1 1 1    3   19   41 o   65.725   6.8994  102.288   18.085  124.119   26.962   84.430   24.385   72.963   8.9594   58.487   10.494 14.47543 13.79872 
1 1 1    3   19   42 o   31.283   8.5224   24.149   15.569   21.724   22.192   26.499   21.846   30.393   11.996   32.172   12.109 -1.778378 17.04490 
1 1 1    3   19   43 o   19.860   6.7166 -24.6348   15.836  -3.6306   22.965 -43.6792   21.867   23.228   10.637   16.493   8.2039 6.734970 13.43318 
1 1 1    3   19   44 f   26.433   8.3665   4.8901   18.307  -5.7089   23.287   22.039   29.621   22.471   10.439   30.395   13.077 -7.923965 16.73297 
1 1 1    3   19   45 f   20.518   7.1356 -36.3343   20.868 -20.9725   30.621 -49.6557   28.515   22.455   10.857   18.580   9.2623 3.875315 14.27117 
1 1 1    3   19   46 o   20.962   7.2026 -21.3670   19.554 -17.0944   28.879 -24.9846   26.573   21.868   10.566   20.055   9.7910 1.813540 14.40514 
1 1 1    3   20    0 o  391.839   3.0187  3169.65   68.976  3169.65   68.976  3169.65   68.976  391.839   4.2691  391.839   4.2691 0.000000 0.000000 
1 1 1    3   20    1 o   89.200   2.1606  164.251   7.9435  171.902   11.264  156.681   11.204   91.269   2.9923   87.132   3.1177 4.137077 4.321281 
1 1 1    3   20    2 f  106.302   2.1567  232.403   9.1682  229.983   11.592  236.445   14.982  105.575   2.6622  107.029   3.3939 -1.454330 4.313428 
1 1 1    3   20    3 o  397.932   3.5491  3271.93   58.246  3258.36   81.943  3285.78   82.810  397.101   5.0032  398.763   5.0350 -1.662018 7.098113 
1 1 1    3   20    4 o  232.564   2.6573  1116.51   25.488  1131.20   36.275  1102.18   35.819  234.075   3.7574  231.053   3.7587 3.021530 5.314688 
1 1 1    3   20    5 o  418.374   5.5525  3648.75   91.249  3697.61  113.389  3558.95  153.715  422.704   6.5038  414.043   9.0013 8.660675 11.10508 
1 1 1    3   20    6 o  405.692   3.8420  3418.71   60.974  3453.94   75.353  3351.89  103.777  408.900   4.4680  402.485   6.2515 6.415497 7.684048 
1 1 1    3   20    7 o  380.267   3.6930  3001.73   54.712  3027.27   67.292  2951.91   93.976  382.822   4.2619  377.713   6.0324 5.109650 7.386021 
1 1 1    3   20    8 o  335.976   3.4448  2338.63   44.742  2348.62   54.555  2318.10   78.198  337.214   3.9225  334.738   5.6640 2.475555 6.889619 
1 1 1    3   20    9 o   67.627   3.8763   78.304   8.3123   70.600   9.0123  122.199   21.512   58.467   3.7373   76.788   6.7924 -18.32106 7.752685 
1 1 1    3   20   10 o  168.367   2.8887  583.833   17.888  581.635   20.972  589.700   34.265  167.857   3.0293  168.877   4.9194 -1.020340 5.777324 
1 1 1    3   20   11 o  399.100   5.1037  3330.06   73.003  3357.94   84.652  3249.16  144.200  402.953   5.0935  395.247   8.8457 7.705353 10.20735 
1 1 1    3   20   12 o  274.192   2.7463  1552.70   30.696  1551.25   40.437  1554.67   47.156  274.075   3.5772  274.309   4.1681 -0.2333679 5.492628 
1 1 1    3   20   13 o  199.493   2.4875  818.726   20.156  804.344   26.206  839.558   31.540  197.378   3.2191  201.607   3.7931 -4.228638 4.974931 
1 1 1    3   20   14 f  117.194   2.7858  284.111   13.449  272.018   19.189  295.788   18.856  114.733   4.0551  119.655   3.8208 -4.921501 5.571561 
1 1 1    3   20   15 o  288.777   3.2414  1696.24   35.764  1651.42   42.845  1799.24   64.946  282.732   3.6742  294.823   5.3410 -12.09103 6.482787 
1 1 1    3   20   16 o   92.984   3.2299  177.524   12.300  189.089   18.750  168.789   16.296   95.612   4.7548   90.355   4.3728 5.257225 6.459794 
1 1 1    3   20   17 o  208.747   2.8296  896.946   24.311  835.890   33.160  967.902   35.748  201.099   3.9980  216.396   4.0053 -15.29707 5.659167 
1 1 1    3   20   18 o  307.846   3.2027  1960.41   40.664  1945.39   57.486  1975.45   57.530  306.663   4.5450  309.029   4.5136 -2.366699 6.405494 
1 1 1    3   20   19 f   55.414   4.0800   65.882   8.7531   70.991   10.919   56.696   14.641   58.580   4.5194   52.248   6.7942 6.332066 8.160062 
1 1 1    3   20   20 f  109.154   3.5064  247.653   15.722  267.437   21.938  226.763   22.542  113.677   4.6791  104.631   5.2237 9.046410 7.012872 
1 1 1    3   20   21 o  150.384   2.9279  466.745   18.090  457.313   24.419  478.217   26.930  148.720   3.9810  152.049   4.2943 -3.328491 5.855710 
1 1 1    3   20   22 o   99.739   3.1504  208.582   12.263  214.620   15.193  197.297   20.770  101.897   3.6152   97.581   5.1606 4.316391 6.300861 
1 1 1    3   20   23 o  101.105   4.0291  208.484   16.596  234.813   26.054  190.507   21.529  106.359   5.9393   95.850   5.4459 10.50879 8.058105 
1 1 1    3   20   24 o   23.679   6.8122 -11.5559   12.611   19.216   18.786 -36.8024   17.016   32.097   11.356   15.261   7.5271 16.83603 13.62439 
1 1 1    3   20   25 o   84.887   6.0014  141.467   20.188  118.256   24.704  188.123   35.025   75.162   7.9690   94.612   8.9757 -19.44955 12.00284 
1 1 1    3   20   26 o  102.198   4.6890  209.641   18.315  240.192   33.762  196.902   21.801  107.073   7.6451   97.324   5.4312 9.749199 9.377912 
1 1 1    3   20   27 o  151.620   3.3058  477.006   20.625  474.997   28.194  479.319   30.249  151.309   4.5179  151.931   4.8272 -0.6218262 6.611602 
1 1 1    3   20   28 o   55.678   7.3817   61.000   16.056  102.183   27.481   39.657   19.784   69.219   9.6260   42.138   11.194 27.08096 14.76342 
1 1 1    3   20   29 o   66.389   5.9413   93.199   16.148   97.894   24.597   89.643   21.408   67.753   8.8022   65.025   7.9822 2.727509 11.88252 
1 1 1    3   20   30 o  137.208   3.3756  392.948   19.088  390.517   27.489  395.210   26.526  136.764   4.8734  137.652   4.6722 -0.8876038 6.751218 
1 1 1    3   20   31 o   27.339   7.9257   5.6741   14.488   16.102   21.795  -2.5830   19.394   31.075   11.996   23.603   10.361 7.472275 15.85133 
1 1 1    3   20   32 o   34.591   8.1629   24.998   14.571   10.741   21.332   37.468   19.950   28.834   11.633   40.349   11.455 -11.51518 16.32576 
1 1 1    3   20   33 o   42.122   7.6773   40.025   15.103   68.596   21.816   13.735   20.928   54.827   10.017   29.418   11.637 25.40933 15.35451 
1 1 1    3   20   34 o   26.894   8.0289   5.8184   15.206   3.2062   23.291   7.7589   20.075   26.945   11.595   26.842   11.109 0.1030846 16.05786 
1 1 1    3   20   35 o   29.293   8.2690   13.088   15.040   16.089   22.223   10.552   20.428   30.635   12.032   27.950   11.346 2.684477 16.53804 
1 1 1    3   20   36 o   32.971   9.1549   17.560   18.127   34.609   29.215   6.8869   23.114   38.356   14.084   27.586   11.700 10.77048 18.30984 
1 1 1    3   20   37 o   78.806   6.2211  138.232   19.725  135.478   25.212  142.576   31.668   78.469   7.7901   79.142   9.7017 -0.6732635 12.44226 
1 1 1    3   20   38 o   44.966   8.3999   50.358   15.800   54.504   23.108   46.717   21.652   46.675   11.952   43.257   11.806 3.417309 16.79977 
1 1 1    3   20   39 o   25.986   7.5996   2.7937   14.955 -19.9569   21.657   23.528   20.675   20.070   9.5501   31.903   11.824 -11.83284 15.19920 
1 1 1    3   20   40 o   29.172   7.8238   9.0097   15.081   38.801   22.585 -14.9629   20.260   38.275   12.468   20.069   9.4554 18.20615 15.64755 
1 1 1    3   20   41 o   29.681   8.0111   14.529   15.628  -8.7541   21.855   38.890   22.355   21.826   10.131   37.535   12.413 -15.70911 16.02220 
1 1 1    3   20   42 o   25.237   7.7000   4.0138   15.535   18.676   21.301 -12.6457   22.706   29.084   11.663   21.389   10.057 7.694862 15.40007 
1 1 1    3   20   43 o   26.182   8.0463   9.8724   16.244   13.958   23.024   5.8232   22.921   27.305   11.632   25.059   11.120 2.245707 16.09267 
1 1 1    3   20   44 o   28.594   8.9359   10.934   21.640 -10.4753   30.077   33.912   31.160   23.906   11.340   33.283   13.813 -9.376591 17.87187 
1 1 1    3   20   45 o   39.035   8.6546   45.084   20.825  -5.8318   30.221   91.123   28.738   24.011   11.383   54.060   13.040 -30.04913 17.30915 
1 1 1    3   20   46 o   26.715   8.5264   11.861   20.563  -3.6235   30.068   25.465   28.183   23.991   11.368   29.438   12.711 -5.447090 17.05273 
1 1 1    3   21    0 o  224.944   2.4940  1044.89   32.705  1044.89   32.705  1044.89   32.705  224.944   3.5270  224.944   3.5270 0.000000 0.000000 
1 1 1    3   21    1 o  218.146   2.8650  973.304   24.831  948.086   30.995  1018.50   41.492  214.284   3.5070  222.008   4.5314 -7.723648 5.729926 
1 1 1    3   21    2 o  285.273   2.6642  1679.30   30.907  1672.55   40.421  1688.80   47.956  284.617   3.4433  285.928   4.0665 -1.310974 5.328492 
1 1 1    3   21    3 o  134.476   2.3911  373.374   13.262  372.864   18.807  373.879   18.703  134.384   3.3931  134.568   3.3698 -0.1839447 4.782135 
1 1 1    3   21    4 o  178.345   3.1163  657.314   22.886  657.690   31.493  656.893   33.315  178.409   4.2799  178.280   4.5308 0.1291809 6.232634 
1 1 1    3   21    5 o   73.740   5.3122  105.207   14.586   96.226   16.954  130.788   28.613   68.174   6.0295   79.306   8.7477 -11.13277 10.62436 
1 1 1    3   21    6 o  101.653   3.1723  208.532   12.207  201.306   14.489  226.200   22.657   98.732   3.5581  104.573   5.2530 -5.840996 6.344624 
1 1 1    3   21    7 o   76.027   3.7815  118.628   10.240  117.711   11.787  121.450   20.675   75.492   3.7855   76.562   6.5475 -1.070213 7.563056 
1 1 1    3   21    8 o   87.104   3.7942  165.883   11.754  175.916   13.777  139.045   22.534   92.294   3.6193   81.914   6.6697 10.38026 7.588463 
1 1 1    3   21    9 o  265.231   3.2677  1456.88   34.828  1466.57   44.577  1441.70   55.800  266.436   4.0565  264.027   5.1242 2.409607 6.535454 
1 1 1    3   21   10 o  250.898   3.9197  1314.69   31.840  1322.24   35.441  1283.07   72.491  253.052   3.3957  248.745   7.0658 4.306488 7.839451 
1 1 1    3   21   11 o  291.345   3.3930  1751.35   39.153  1741.45   48.900  1769.04   65.354  290.309   4.0840  292.381   5.4195 -2.072021 6.786016 
1 1 1    3   21   12 o  237.027   3.0333  1179.50   27.671  1213.97   33.829  1109.80   48.104  242.448   3.3830  231.607   5.0357 10.84123 6.066565 
1 1 1    3   21   13 o  206.627   2.3586  885.615   19.395  896.770   24.492  866.856   31.761  208.420   2.8492  204.833   3.7595 3.586945 4.717157 
1 1 1    3   21   14 o  430.169   4.0729  3810.36   67.154  3772.28   80.980  3894.21  120.163  427.092   4.5972  433.246   6.7247 -6.153168 8.145883 
1 1 1    3   21   15 o  149.698   2.5467  465.797   15.589  488.438   21.036  438.218   23.217  153.779   3.3166  145.617   3.8656 8.160995 5.093442 
1 1 1    3   21   16 o  233.737   2.6418  1123.04   25.015  1098.23   32.295  1160.25   39.549  230.570   3.3960  236.905   4.0476 -6.334457 5.283575 
1 1 1    3   21   17 o  112.705   3.0600  262.404   14.199  267.504   20.787  257.941   19.442  113.723   4.4319  111.687   4.2206 2.035652 6.120033 
1 1 1    3   21   18 o   18.915   5.0697   4.6003   5.9321   9.5478   7.0238  -7.7077   11.078   21.691   6.9426   16.139   7.3896 5.552427 10.13935 
1 1 1    3   21   19 o   43.963   4.7964   42.052   7.9045   44.761   9.7974   36.999   13.379   46.490   5.1096   41.436   8.1187 5.053387 9.592757 
1 1 1    3   21   20 o  129.271   4.7003  290.093   19.955  258.709   21.835  449.126   49.152  111.791   4.7357  146.752   8.1207 -34.96060 9.400689 
1 1 1    3   21   21 f  126.444   3.6994  315.892   15.248  306.665   16.869  357.077   35.641  121.820   3.3575  131.068   6.5931 -9.247955 7.398742 
1 1 1    3   21   22 o   59.500   6.5094   81.050   14.196   58.890   23.533   93.727   17.799   51.847   11.322   67.152   6.4265 -15.30490 13.01883 
1 1 1    3   21   23 o   72.990   4.2080  107.862   12.042  101.993   14.706  119.809   20.981   70.129   5.0842   75.851   6.7067 -5.721405 8.415952 
1 1 1    3   21   24 o   68.071   4.1220   94.521   10.889   91.126   13.205  101.736   19.249   66.285   4.8300   69.857   6.6809 -3.571640 8.243983 
1 1 1    3   21   25 o   33.641   8.0024   22.961   13.207   18.569   19.985   26.366   17.598   32.091   11.669   35.190   10.954 -3.099121 16.00485 
1 1 1    3   21   26 o   70.011   5.3070  102.171   15.012  105.944   23.932   99.723   19.275   70.960   8.1772   69.062   6.7668 1.898422 10.61399 
1 1 1    3   21   27 f   87.733   4.2940  160.332   15.506  171.798   22.822  150.500   21.133   90.628   6.1056   84.837   6.0395 5.790649 8.588036 
1 1 1    3   21   28 o  124.704   4.5703  329.064   23.073  313.168   35.741  340.422   30.212  121.863   7.1110  127.546   5.7432 -5.682716 9.140609 
1 1 1    3   21   29 o   35.225   8.4207   12.863   16.369  -9.3394   20.343   53.635   27.567   22.485   10.186   47.964   13.412 -25.47892 16.84140 
1 1 1    3   21   30 o   89.002   4.3326  167.542   15.845  158.620   23.010  175.588   21.850   86.640   6.4392   91.364   5.7985 -4.724472 8.665240 
1 1 1    3   21   31 o   61.285   7.2307   80.445   17.427  112.863   27.480   58.635   22.539   72.045   9.2479   50.524   11.118 21.52100 14.46132 
1 1 1    3   21   32 f   32.583   8.3225   22.065   14.338   21.751   20.792   22.349   19.799   32.573   11.893   32.593   11.645 -0.2066040E-01 16.64496 
1 1 1    3   21   33 o   17.411   5.9971 -31.9674   13.891 -36.9294   20.472 -27.7332   18.911   17.246   8.4562   17.576   8.5061 -0.3295994 11.99424 
1 1 1    3   21   34 o   54.220   7.7180   68.923   16.625   63.338   24.202   73.913   22.877   51.670   11.636   56.771   10.142 -5.100441 15.43607 
1 1 1    3   21   35 o   57.601   6.5410   74.271   15.525   77.996   22.551   70.914   21.404   58.959   9.2737   56.242   9.2270 2.717564 13.08207 
1 1 1    3   21   36 o   22.853   7.2970 -18.3489   15.417   11.317   23.838 -39.6803   20.214   29.126   12.085   16.579   8.1822 12.54698 14.59402 
1 1 1    3   21   37 o   56.850   9.1085   82.041   20.866   84.485   29.307   79.527   29.715   57.957   12.618   55.743   13.139 2.214642 18.21695 
1 1 1    3   21   38 o   29.224   8.7211   11.843   18.174   5.3523   26.893   17.300   24.656   27.898   12.225   30.550   12.441 -2.652567 17.44211 
1 1 1    3   21   39 o   66.640   6.0089  102.384   16.379   90.777   23.520  113.310   22.821   62.430   9.1345   70.850   7.8096 -8.419888 12.01782 
1 1 1    3   21   40 o   52.598   7.4464   69.518   15.830   58.973   22.401   80.034   22.372   47.310   11.575   57.885   9.3707 -10.57479 14.89271 
1 1 1    3   21   41 o   37.231   8.3358   37.314   14.883   25.959   20.947   48.888   21.149   31.904   11.886   42.558   11.690 -10.65407 16.67166 
1 1 1    3   21   42 o   27.931   8.4401   13.268   17.128   22.301   26.224   6.5491   22.618   30.554   12.676   25.309   11.148 5.244713 16.88027 
1 1 1    3   21   43 o   22.311   7.2463  -8.8839   16.140 -30.1656   23.114   11.366   22.547   18.430   9.0260   26.192   11.339 -7.761602 14.49259 
1 1 1    3   21   44 o   24.571   8.5154 -19.0007   25.361 -13.5516   49.799 -20.9088   29.469   27.298   13.344   21.843   10.583 5.454746 17.03079 
1 1 1    3   21   45 o   33.778   9.1343   36.044   20.772   2.8333   30.620   64.357   28.272   25.182   11.788   42.375   13.956 -17.19286 18.26852 
1 1 1    3   22    0 o   18.160   5.0906   9.3978   5.1981   9.3978   5.1981   9.3978   5.1981   18.160   7.1992   18.160   7.1992 0.000000 0.000000 
1 1 1    3   22    1 o  372.814   2.9093  2871.14   44.729  2896.94   63.900  2846.36   62.631  374.452   4.1375  371.177   4.0911 3.275574 5.818626 
1 1 1    3   22    2 o  268.876   2.5840  1494.47   28.302  1502.24   37.270  1483.88   43.499  269.734   3.3501  268.019   3.9350 1.715363 5.167962 
1 1 1    3   22    3 o  286.147   2.6983  1682.71   31.262  1735.12   49.490  1647.92   40.325  289.795   4.1406  282.498   3.4609 7.296265 5.396538 
1 1 1    3   22    4 o  155.022   3.0859  494.455   19.668  470.965   26.563  522.964   29.263  150.971   4.2659  159.073   4.4602 -8.101578 6.171836 
1 1 1    3   22    5 o  309.603   4.3861  1981.29   47.737  1977.82   54.695  1992.36   97.805  309.377   4.2864  309.830   7.6537 -0.4526978 8.772242 
1 1 1    3   22    6 o  233.686   3.3902  1128.37   32.656  1110.20   45.278  1148.06   47.145  231.734   4.7373  235.637   4.8509 -3.903519 6.780389 
1 1 1    3   22    7 o  320.773   3.9001  2129.40   51.597  2129.86   72.730  2128.93   73.212  320.812   5.4967  320.734   5.5344 0.7788086E-01 7.800178 
1 1 1    3   22    8 o  235.683   3.4772  1148.38   33.787  1131.85   46.995  1166.06   48.609  233.935   4.8707  237.431   4.9638 -3.495422 6.954381 
1 1 1    3   22    9 o   84.192   4.4464  145.552   15.367  129.998   20.645  164.877   23.012   79.193   6.3205   89.191   6.2555 -9.998032 8.892722 
1 1 1    3   22   10 o  164.199   4.2149  566.538   27.028  584.515   33.543  533.255   45.640  168.097   4.8381  160.301   6.9031 7.795578 8.429728 
1 1 1    3   22   11 o  204.648   2.9536  860.317   22.444  853.460   26.445  877.977   42.437  203.300   3.1539  205.996   4.9948 -2.695343 5.907229 
1 1 1    3   22   12 o   78.355   3.9778  125.550   9.6414  124.734   10.564  129.618   23.592   77.714   3.2958   78.996   7.2409 -1.282143 7.955654 
1 1 1    3   22   13 o   54.334   5.6937   61.815   8.1116   61.594   8.6655   63.378   23.058   54.592   3.8485   54.075   10.717 0.5178528 11.38738 
1 1 1    3   22   14 o  274.336   3.2748  1549.95   36.060  1526.78   45.824  1587.64   58.441  271.752   4.0884  276.919   5.1168 -5.166443 6.549567 
1 1 1    3   22   15 o   28.893   4.3000   16.819   5.1342   9.0899   6.7082   27.750   7.9774   21.180   6.7854   36.605   5.2840 -15.42453 8.600099 
1 1 1    3   22   16 o   66.797   3.4743   92.873   9.4724   77.049   13.320  109.063   13.473   60.989   5.2953   72.606   4.4992 -11.61735 6.948584 
1 1 1    3   22   17 o  187.618   2.5729  729.815   19.609  741.441   25.711  713.652   30.316  189.446   3.2905  185.789   3.9563 3.657333 5.145855 
1 1 1    3   22   18 o  106.793   3.8232  226.746   13.527  220.559   15.052  252.726   30.844  103.309   3.5326  110.277   6.7814 -6.968040 7.646327 
1 1 1    3   22   19 o   90.201   4.8340  179.446   16.220  143.856   28.513  196.472   19.722   83.005   8.3286   97.397   4.9094 -14.39140 9.667934 
1 1 1    3   22   20 o  119.044   3.0099  280.354   14.053  254.667   17.062  334.545   24.781  110.984   3.7273  127.104   4.7272 -16.12051 6.019877 
1 1 1    3   22   21 o   86.089   4.8245  149.711   11.984  147.928   12.911  160.802   32.195   84.577   3.7013   87.600   8.9108 -3.022888 9.648941 
1 1 1    3   22   22 o   99.634   3.5523  205.580   14.586  196.828   20.164  215.188   21.126   97.413   5.0186  101.854   5.0289 -4.441063 7.104665 
1 1 1    3   22   23 o   44.153   7.1455   43.688   12.837   32.729   18.862   53.144   17.520   38.756   11.181   49.549   8.9001 -10.79288 14.29100 
1 1 1    3   22   24 o  112.365   3.8741  266.611   17.668  231.756   26.272  295.388   23.873  105.454   6.0405  119.275   4.8527 -13.82153 7.748291 
1 1 1    3   22   25 o   44.545   6.7828   42.283   12.771   68.590   18.973   20.490   17.268   57.086   8.0583   32.004   10.913 25.08178 13.56566 
1 1 1    3   22   26 o  140.554   3.4286  410.564   19.833  421.748   29.168  400.947   27.049  142.298   4.9699  138.811   4.7245 3.487427 6.857162 
1 1 1    3   22   27 o   36.813   8.1382   29.774   13.741   27.608   20.032   31.699   18.885   35.861   11.745   37.765   11.269 -1.904106 16.27640 
1 1 1    3   22   28 o   84.343   4.7537  149.264   16.458  160.780   24.790  140.187   22.008   87.179   6.8944   81.506   6.5467 5.673363 9.507468 
1 1 1    3   22   29 o   75.710   5.5414  124.629   16.510  114.800   27.153  130.393   20.795   72.861   9.0355   78.559   6.4179 -5.698425 11.08289 
1 1 1    3   22   30 o   47.848   7.3716   52.325   14.123   49.994   20.525   54.422   19.462   46.640   10.871   49.055   9.9594 -2.414997 14.74324 
1 1 1    3   22   31 o   40.779   8.1521   37.485   15.262   19.796   20.794   58.142   22.470   31.750   11.840   49.807   11.209 -18.05676 16.30414 
1 1 1    3   22   32 o   48.130   7.7229   54.466   14.999   49.334   21.467   59.362   20.966   45.616   11.433   50.645   10.386 -5.028984 15.44589 
1 1 1    3   22   33 o   30.417   8.2897   16.362   14.917   10.022   21.756   21.986   20.493   28.344   11.630   32.490   11.816 -4.145819 16.57949 
1 1 1    3   22   34 o   24.461   7.6224  -1.5487   15.082   3.7370   21.276  -6.8876   21.383   25.851   11.102   23.071   10.448 2.779167 15.24486 
1 1 1    3   22   35 f   20.405   6.8861 -24.1946   15.845 -18.3730   24.427 -28.4238   20.820   22.287   10.463   18.523   8.9549 3.764235 13.77215 
1 1 1    3   22   36 o   51.165   7.6213   63.010   15.562   64.573   22.560   61.592   21.495   51.686   10.925   50.643   10.630 1.043495 15.24267 
1 1 1    3   22   37 o   23.632   7.6444 -11.3545   16.429   6.1260   26.285 -22.5618   21.047   27.924   12.165   19.341   9.2606 8.583330 15.28873 
1 1 1    3   22   38 o   27.788   8.2474   9.3600   16.690   21.222   22.679  -4.6544   24.651   31.133   12.176   24.444   11.127 6.689157 16.49471 
1 1 1    3   22   39 o   46.985   8.0141   57.392   15.428   65.209   21.954   49.764   21.686   50.697   10.828   43.274   11.817 7.422947 16.02820 
1 1 1    3   22   40 o   36.067   8.5060   34.989   15.284   24.886   21.503   45.303   21.727   31.526   11.978   40.608   12.080 -9.082775 17.01208 
1 1 1    3   22   41 o   22.177   7.1247  -2.4997   14.240  -5.6616   20.197   0.6261   20.081   21.446   9.8776   22.908   10.270 -1.461960 14.24947 
1 1 1    3   22   42 o   23.841   7.5661 -15.7157   17.888   25.944   25.274 -57.5280   25.320   31.029   12.611   16.652   8.3631 14.37712 15.13218 
1 1 1    3   22   43 o   25.666   7.9503   10.477   16.132   6.3997   22.819   14.551   22.808   24.587   10.991   26.746   11.490 -2.159290 15.90066 
1 1 1    3   22   44 o   26.356   8.3356   7.0774   20.368 -23.3220   30.804   30.692   27.150   21.681   10.575   31.031   12.888 -9.350035 16.67117 
1 1 1    3   23    0 o  194.999   2.3456  785.369   26.662  785.369   26.662  785.369   26.662  194.999   3.3172  194.999   3.3172 0.000000 0.000000 
1 1 1    3   23    1 o   95.071   1.9103  186.659   7.4866  190.360   10.484  182.807   10.695   96.035   2.6468   94.107   2.7554 1.927925 3.820677 
1 1 1    3   23    2 f  153.762   2.2944  488.398   14.531  491.806   20.066  484.642   21.069  154.332   3.1524  153.193   3.3346 1.139526 4.588843 
1 1 1    3   23    3 o   40.692   3.4326   32.139   5.1101   38.873   10.273   29.924   5.8906   43.325   5.7488   38.059   3.7527 5.266514 6.865228 
1 1 1    3   23    4 o  122.195   3.1764  308.027   15.923  302.181   21.348  315.358   23.906  120.906   4.2810  123.485   4.6938 -2.578362 6.352814 
1 1 1    3   23    5 o  200.279   4.0446  816.220   30.604  795.365   36.351  866.980   56.712  196.127   4.4937  204.430   6.7261 -8.303040 8.089123 
1 1 1    3   23    6 o  437.591   4.7443  3971.60   85.611  4008.68  122.481  3936.18  119.710  439.570   6.7558  435.612   6.6629 3.957886 9.488683 
1 1 1    3   23    7 o  188.666   3.3237  735.227   25.838  715.797   35.597  756.861   37.562  186.042   4.6392  191.290   4.7610 -5.247559 6.647455 
1 1 1    3   23    8 o  143.880   4.9888  428.335   29.605   0.0000   0.0000  428.335   29.605  ?   ?   143.880   4.9888      ?      ? 
1 1 1    3   23    9 o  146.329   3.5342  443.926   21.289  462.126   29.620  424.478   30.618  149.456   4.8051  143.201   5.1840 6.254852 7.068460 
1 1 1    3   23   10 o  129.028   4.8519  345.838   25.669  347.086   34.521  344.296   38.388  129.337   6.4714  128.719   7.2309 0.6182404 9.703856 
1 1 1    3   23   11 o   85.487   4.7328  150.533   16.621  136.171   22.404  168.116   24.789   80.986   6.7072   89.988   6.6790 -9.001945 9.465532 
1 1 1    3   23   12 o  125.757   3.5752  335.592   17.356  352.465   21.408  303.229   29.647  130.578   3.9749  120.937   5.9438 9.641655 7.150441 
1 1 1    3   23   13 o  146.987   3.2617  458.510   17.892  475.300   21.404  419.569   32.597  151.677   3.4214  142.297   5.5541 9.380630 6.523357 
1 1 1    3   23   14 o   97.992   5.1484  172.919   11.884  167.686   12.377  234.767   42.552   90.093   3.3308  105.890   9.7432 -15.79692 10.29681 
1 1 1    3   23   15 o  134.569   3.4187  374.470   17.686  376.000   31.337  373.754   21.423  134.678   5.6416  134.461   3.8630 0.2174988 6.837427 
1 1 1    3   23   16 o  177.330   3.4248  656.316   23.879  669.051   29.753  633.267   40.029  179.876   4.0105  174.784   5.5527 5.092819 6.849547 
1 1 1    3   23   17 o  220.055   2.5128  986.350   21.588  957.252   26.369  1045.49   37.595  215.280   2.9698  224.830   4.0542 -9.550690 5.025578 
1 1 1    3   23   18 o  140.476   2.6085  407.259   14.821  404.369   19.138  411.590   23.427  139.888   3.3171  141.064   4.0266 -1.175842 5.216964 
1 1 1    3   23   19 o  114.799   2.8619  269.462   12.698  263.711   15.384  281.752   22.491  112.962   3.3020  116.637   4.6753 -3.674797 5.723810 
1 1 1    3   23   20 o   55.258   4.3544   68.613   9.1193   82.575   11.685   46.861   14.585   63.138   4.4872   47.378   7.4639 15.76025 8.708874 
1 1 1    3   23   21 o  133.826   2.7091  364.405   14.175  351.712   17.323  390.129   24.662  130.429   3.2202  137.223   4.3574 -6.794220 5.418182 
1 1 1    3   23   22 o   58.497   3.9835   65.983   9.0346   57.124   10.785   86.828   16.543   52.450   4.9855   64.543   6.2144 -12.09242 7.967057 
1 1 1    3   23   23 o   54.518   5.4021   62.498   12.113   59.943   17.569   64.813   16.722   53.412   7.9751   55.625   7.2889 -2.212399 10.80416 
1 1 1    3   23   24 o  112.094   3.4370  260.612   15.849  235.450   21.872  288.431   22.998  106.388   4.9847  117.801   4.7335 -11.41293 6.874083 
1 1 1    3   23   25 o   71.206   3.7778  105.749   10.427  105.600   12.734  106.053   18.163   71.276   4.3317   71.136   6.1905 0.1393433 7.555533 
1 1 1    3   23   26 o  119.934   3.4309  300.296   16.955  311.386   23.787  288.843   24.173  122.224   4.7186  117.645   4.9820 4.579185 6.861885 
1 1 1    3   23   27 o   71.937   4.4541  113.555   11.846  120.105   14.194   98.524   21.503   75.876   4.5358   67.999   7.6670 7.876228 8.908162 
1 1 1    3   23   28 f   93.302   4.1482  183.338   15.946  178.503   22.880  187.904   22.236   92.053   6.0263   94.550   5.7019 -2.497177 8.296323 
1 1 1    3   23   29 o   86.743   5.2156  166.484   17.880  135.966   27.906  187.736   23.288   79.232   8.5395   94.254   5.9906 -15.02235 10.43120 
1 1 1    3   23   30 o   81.308   6.0671  143.762   20.288  135.229   27.456  154.026   30.112   78.730   8.4553   83.887   8.7032 -5.157173 12.13417 
1 1 1    3   23   31 o   40.795   7.9303   39.629   13.964   31.623   20.467   46.603   19.101   36.909   11.855   44.681   10.536 -7.771595 15.86061 
1 1 1    3   23   32 o   25.639   7.6148   5.2817   13.681   1.4388   20.325   8.4655   18.500   24.939   10.781   26.339   10.757 -1.400599 15.22952 
1 1 1    3   23   33 o   65.724   5.6323   95.206   15.198   89.094   22.032  100.753   20.991   63.471   8.4163   67.977   7.4871 -4.505703 11.26455 
1 1 1    3   23   34 o   27.154   7.8446   7.1860   14.417   20.444   21.355  -3.9182   19.543   31.586   11.952   22.721   10.163 8.865395 15.68920 
1 1 1    3   23   35 o   45.162   8.0299   49.374   18.198   10.812   26.168   85.489   25.325   29.540   12.485   60.785   10.102 -31.24498 16.05971 
1 1 1    3   23   36 o   22.771   7.2348  -4.5612   14.254   2.9429   20.895 -11.0935   19.495   24.902   10.848   20.640   9.5761 4.262356 14.46962 
1 1 1    3   23   37 o   55.103   7.8692   78.515   17.019   61.306   26.954   89.927   21.948   47.522   13.252   62.683   8.4895 -15.16138 15.73842 
1 1 1    3   23   38 o   20.747   6.8768 -18.5620   15.877   0.2150   20.311 -48.0669   25.460   23.397   10.421   18.096   8.9761 5.300644 13.75354 
1 1 1    3   23   39 f   26.544   7.8399   11.880   14.324   11.332   20.099   12.446   20.418   26.309   11.021   26.779   11.153 -0.4696579 15.67982 
1 1 1    3   23   40 o   24.941   7.6235   7.3862   14.370   8.1895   20.438   6.6008   20.208   25.217   10.856   24.665   10.706 0.5520821 15.24708 
1 1 1    3   23   41 o   23.380   7.4000  -3.3020   15.706 -23.5896   22.253   16.836   22.171   18.944   9.1827   27.815   11.607 -8.871027 14.80006 
1 1 1    3   23   42 o   32.565   8.9199   31.616   17.683   39.991   23.639   20.975   26.645   35.849   12.733   29.281   12.495 6.568590 17.83975 
1 1 1    3   23   43 o   28.436   9.0116   19.112   21.800   12.928   35.790   22.761   27.489   27.890   12.952   28.983   12.533 -1.093534 18.02323 
1 1 1    3   24    0 o  242.007   2.5680  1209.70   36.232  1209.70   36.232  1209.70   36.232  242.007   3.6317  242.007   3.6317 0.000000 0.000000 
1 1 1    3   24    1 o  226.256   2.1912  1057.10   20.447  1060.07   28.801  1054.09   29.034  226.577   3.0819  225.935   3.1157 0.6423645 4.382494 
1 1 1    3   24    2 o  293.481   3.2459  1783.08   38.609  1772.06   60.388  1790.71   50.212  292.633   5.0033  294.329   4.1363 -1.695923 6.491711 
1 1 1    3   24    3 o   91.587   2.8308  173.175   10.693   0.0000   0.0000  173.175   10.693  ?   ?    91.587   2.8308      ?      ? 
1 1 1    3   24    4 o  222.201   3.2666  1020.34   29.899  1003.65   41.114  1039.09   43.558  220.287   4.5252  224.115   4.7123 -3.828262 6.533240 
1 1 1    3   24    5 o   80.457   9.6612  135.311   32.060   0.0000   0.0000  135.311   32.060  ?   ?    80.457   9.6612      ?      ? 
1 1 1    3   24    6 o  124.294   3.4432  321.065   17.554  335.588   23.953  304.215   25.801  127.370   4.5596  121.217   5.1606 6.152206 6.886328 
1 1 1    3   24    7 o  132.614   3.5303  365.090   19.251  384.602   26.718  344.020   27.763  136.333   4.7516  128.895   5.2224 7.438568 7.060534 
1 1 1    3   24    8 o  148.269   3.4266  454.818   20.918  452.547   28.716  457.385   30.534  147.890   4.7078  148.649   4.9802 -0.7588501 6.853172 
1 1 1    3   24    9 o  212.788   3.5078  937.755   30.750  948.375   42.608  926.210   44.422  214.068   4.8258  211.509   5.0922 2.558899 7.015635 
1 1 1    3   24   10 o  225.505   4.2282  1037.35   37.452  1110.41   64.516  1000.22   45.995  231.221   6.7651  219.790   5.0738 11.43098 8.456374 
1 1 1    3   24   11 o  134.535   3.8140  376.259   21.086  406.707   29.525  344.562   30.125  140.141   5.1081  128.929   5.6651 11.21234 7.627964 
1 1 1    3   24   12 o   90.749   4.8958  172.402   18.186  186.362   24.954  156.589   26.559   94.748   6.3856   86.749   7.4230 7.998253 9.791634 
1 1 1    3   24   13 o  177.867   4.8040  623.203   31.859  738.071   61.783  581.594   37.185  188.199   7.9595  167.535   5.3814 20.66457 9.607932 
1 1 1    3   24   14 o   25.942   7.1683   2.0091   5.1680   0.8386   5.2808   28.543   25.142   13.656   5.6787   38.229   13.164 -24.57256 14.33655 
1 1 1    3   24   15 o   99.887   3.9672  207.907   12.266  208.417   13.473  205.441   29.652  100.435   3.2525   99.341   7.2370 1.093956 7.934323 
1 1 1    3   24   16 o   93.092   2.2701  177.864   8.6723  190.599   13.082  167.879   11.583   96.040   3.3025   90.145   3.1155 5.895851 4.540159 
1 1 1    3   24   17 o  114.659   2.9754  272.823   14.021  261.035   20.436  283.307   19.272  112.293   4.4125  117.026   3.9928 -4.733063 5.950848 
1 1 1    3   24   18 o   48.053   3.6120   47.338   6.9494   45.679   8.7576   50.157   11.420   46.959   4.5217   49.146   5.6339 -2.187115 7.224045 
1 1 1    3   24   19 o   83.118   3.0776  143.957   10.328  147.438   13.400  138.861   16.211   84.404   3.8491   81.831   4.8033 2.572960 6.155260 
1 1 1    3   24   20 o   62.106   3.3957   77.593   8.2805   72.533   10.108   87.918   14.438   59.170   4.1419   65.041   5.3823 -5.871357 6.791463 
1 1 1    3   24   21 o  155.648   2.9337  499.995   18.780  475.170   25.426  529.797   27.859  151.429   4.0711  159.867   4.2252 -8.437881 5.867337 
1 1 1    3   24   22 o   73.798   7.8675   77.948   18.263   60.707   19.594  192.042   50.405   53.591   8.8647   94.006   13.000 -40.41526 15.73499 
1 1 1    3   24   23 o   21.119   5.9050   3.8117   6.6309   1.6591   7.5579   11.008   13.818   16.485   6.8191   25.754   9.6425 -9.269590 11.81009 
1 1 1    3   24   24 o  102.199   3.4694  217.106   14.589  196.977   20.112  239.459   21.193   97.188   5.0174  107.209   4.7929 -10.02113 6.938731 
1 1 1    3   24   25 o   62.237   4.2188   85.181   9.7832   91.365   11.833   71.823   17.392   66.242   4.3311   58.233   7.2411 8.008621 8.437503 
1 1 1    3   24   26 o  144.680   3.0877  435.653   18.385  424.430   25.057  448.741   27.059  142.705   4.2572  146.654   4.4735 -3.949615 6.175451 
1 1 1    3   24   27 o   57.122   4.7625   71.339   10.174   74.891   12.257   63.472   18.241   59.825   4.9676   54.419   8.1269 5.406013 9.524936 
1 1 1    3   24   28 o   56.559   4.7466   69.200   9.9904   70.694   11.904   65.642   18.374   58.019   4.9744   55.098   8.0855 2.920921 9.493148 
1 1 1    3   24   29 o   96.417   4.1594  196.467   16.469  190.365   22.143  204.021   24.636   94.845   5.6607   97.988   6.0958 -3.143494 8.318769 
1 1 1    3   24   30 o   46.576   6.8671   61.929   11.773   75.050   13.611   22.958   23.457   59.549   5.5417   33.602   12.567 25.94683 13.73427 
1 1 1    3   24   31 o   45.719   7.4875   49.300   14.665   68.514   20.473   29.049   21.018   55.745   8.9043   35.693   12.040 20.05249 14.97495 
1 1 1    3   24   32 o   27.045   7.6772   6.9629   14.211  -9.5129   20.368   22.591   19.837   21.862   10.014   32.228   11.640 -10.36677 15.35432 
1 1 1    3   24   33 o   52.287   7.0837   65.874   14.661   42.908   21.290   86.586   20.218   41.811   11.820   62.762   7.8104 -20.95048 14.16743 
1 1 1    3   24   34 o   47.946   7.7589   56.189   15.234   41.183   21.351   71.751   21.743   40.635   11.946   55.258   9.9043 -14.62273 15.51789 
1 1 1    3   24   35 o   31.080   8.3399   20.640   14.809   15.754   20.421   26.060   21.508   28.918   11.478   33.241   12.103 -4.323034 16.67973 
1 1 1    3   24   36 o   45.653   7.5650   55.175   15.423   25.771   23.330   78.002   20.556   32.960   12.488   58.346   8.5421 -25.38657 15.12998 
1 1 1    3   24   37 o   41.410   8.4342   45.619   17.084   19.925   24.477   70.022   23.854   30.656   12.428   52.165   11.405 -21.50877 16.86838 
1 1 1    3   24   38 o   35.324   8.8285   33.981   15.877   35.086   25.103   33.245   20.498   35.525   13.053   35.123   11.890 0.4020500 17.65693 
1 1 1    3   24   39 o   20.457   6.7322  -9.1282   13.791 -12.1871   19.141  -5.8264   19.886   19.583   9.2156   21.332   9.8164 -1.749088 13.46439 
1 1 1    3   24   40 o   24.175   7.4736   5.8643   14.288  -0.4251   20.066   12.333   20.349   22.331   10.116   26.019   11.004 -3.688601 14.94729 
1 1 1    3   24   41 o   19.260   6.5420 -20.0619   15.296 -32.2297   21.654  -7.9422   21.611   17.372   8.5535   21.148   9.9011 -3.775930 13.08407 
1 1 1    3   24   42 o   23.403   7.4352   3.4622   15.278   13.549   21.634  -6.5731   21.578   25.809   11.140   20.997   9.8504 4.812149 14.87043 
1 1 1    3   24   43 o   25.256   8.2617  -7.6634   22.783 -56.9079   34.253   31.405   30.509   19.584   9.8203   30.928   13.289 -11.34458 16.52344 
1 1 1    3   25    0 o  236.210   2.5393  1152.55   34.968  1152.55   34.968  1152.55   34.968  236.210   3.5912  236.210   3.5912 0.000000 0.000000 
1 1 1    3   25    1 o  133.189   1.9180  366.287   10.531  367.895   14.679  364.582   15.116  133.493   2.6661  132.886   2.7580 0.6075287 3.835979 
1 1 1    3   25    2 o  242.407   2.9651  1207.88   28.884  1246.38   46.743  1184.11   36.737  245.443   4.6174  239.370   3.7211 6.073486 5.930199 
1 1 1    3   25    3 o  237.496   3.2719  1167.45   32.036  1186.81   44.894  1147.37   45.728  239.517   4.5445  235.476   4.7083 4.040436 6.543796 
1 1 1    3   25    4 f  140.067   3.7073  376.532   17.001  456.614   40.141  359.027   18.767  148.309   6.5623  131.825   3.4517 16.48439 7.414690 
1 1 1    3   25    5 o  230.233   3.3878  1083.07   31.853  1003.91   41.669  1194.35   49.406  220.275   4.5866  240.191   4.9872 -19.91545 6.775577 
1 1 1    3   25    6 o  244.811   4.9650  1240.78   50.132   0.0000   0.0000  1240.78   50.132  ?   ?   244.811   4.9650      ?      ? 
1 1 1    3   25    7 o  188.229   4.8313  733.400   37.507   0.0000   0.0000  733.400   37.507  ?   ?   188.229   4.8313      ?      ? 
1 1 1    3   25    8 o  195.697   3.4277  792.683   27.644  789.974   38.295  795.630   39.946  195.362   4.7526  196.031   4.9406 -0.6691284 6.855438 
1 1 1    3   25    9 o  183.172   6.8570  697.254   51.804   0.0000   0.0000  697.254   51.804  ?   ?   183.172   6.8570      ?      ? 
1 1 1    3   25   10 o  117.313   4.4568  281.829   21.381  315.372   32.967  257.477   28.090  123.234   6.4861  111.392   6.1141 11.84150 8.913541 
1 1 1    3   25   11 o   88.398   4.9175  165.083   17.620  182.393   23.702  143.697   26.345   93.742   6.1303   83.053   7.6908 10.68915 9.835073 
1 1 1    3   25   12 o   28.688   8.2615   6.7154   15.322   3.3544   20.500   10.969   23.063   26.709   11.155   30.667   12.189 -3.957352 16.52290 
1 1 1    3   25   13 o   99.630   7.9285  213.238   31.894  169.432   46.112  253.413   44.160   89.363   12.511  109.896   9.7427 -20.53339 15.85701 
1 1 1    3   25   14 o  237.575   3.7898  1170.23   37.133  1165.45   52.216  1175.11   52.818  237.090   5.3398  238.061   5.3793 -0.9711761 7.579641 
1 1 1    3   25   15 o  177.472   3.1758  645.496   20.009  639.130   22.985  665.413   40.658  175.867   3.1689  179.078   5.5047 -3.211441 6.351635 
1 1 1    3   25   16 o  144.764   3.4341  440.433   16.803  445.029   19.003  423.960   35.974  146.740   3.1398  142.787   6.1084 3.952637 6.868157 
1 1 1    3   25   17 o  127.357   2.6211  334.598   13.568  329.822   17.681  341.440   21.160  126.289   3.3945  128.425   3.9949 -2.136101 5.242279 
1 1 1    3   25   18 o   75.008   3.3595  122.087   9.0539  105.598   17.237  128.369   10.640   71.231   5.8672   78.784   3.2744 -7.553627 6.719060 
1 1 1    3   25   19 f   79.550   2.8542  132.627   8.8983  136.173   11.069  126.151   14.961   81.131   3.3080   77.968   4.6523 3.163284 5.708484 
1 1 1    3   25   20 o   47.478   3.8628   46.055   7.3732   43.302   9.3140   50.676   12.068   45.651   4.9467   49.304   5.9343 -3.652897 7.725700 
1 1 1    3   25   21 o  117.423   2.9792  285.165   14.384  273.395   19.452  299.366   21.367  114.778   4.1091  120.068   4.3147 -5.289291 5.958313 
1 1 1    3   25   22 f   41.319   5.0734   34.241   7.8911   30.442   9.4084   43.252   14.491   38.129   5.9827   44.510   8.1954 -6.381191 10.14684 
1 1 1    3   25   23 o   29.894   7.9822   8.9623   7.3935   7.4240   7.6352   32.116   29.622   20.196   7.2299   39.592   14.233 -19.39606 15.96430 
1 1 1    3   25   24 o   44.138   4.7898   36.344   7.9297   28.386   9.2992   57.549   15.180   36.170   6.4710   52.106   7.0636 -15.93599 9.579563 
1 1 1    3   25   25 o   61.978   4.6208   81.404   11.783   76.040   16.815   86.580   16.517   59.903   6.8058   64.054   6.2520 -4.151314 9.241537 
1 1 1    3   25   26 o   60.481   4.0541   73.721   9.3877   68.632   11.178   85.904   17.294   57.286   4.7310   63.676   6.5849 -6.389973 8.108203 
1 1 1    3   25   27 o  111.646   3.5496  261.788   16.324  243.942   22.652  281.070   23.546  107.658   5.1014  115.635   4.9370 -7.976791 7.099164 
1 1 1    3   25   28 o   69.032   4.0884  102.366   10.848  105.007   13.257   97.011   18.874   70.755   4.5428   67.309   6.7987 3.445839 8.176790 
1 1 1    3   25   29 o   60.693   4.6161   81.919   10.435   87.068   12.597   70.663   18.626   64.360   4.7456   57.027   7.9192 7.333366 9.232244 
1 1 1    3   25   30 o   30.261   6.8006   18.461   8.4299   16.401   9.6207   25.274   17.493   27.135   8.0308   33.388   10.977 -6.252192 13.60118 
1 1 1    3   25   31 o   51.480   8.0663   65.847   12.018   67.063   12.883   57.700   33.348   56.132   5.5648   46.827   15.142 9.305305 16.13258 
1 1 1    3   25   32 o   25.627   6.7483   12.736   8.4548   13.843   9.4230   8.1650   19.150   25.104   8.0420   26.150   10.839 -1.045683 13.49651 
1 1 1    3   25   33 o   66.614   4.7037   98.924   11.193  101.900   13.077   90.776   21.642   69.428   4.5668   63.800   8.2247 5.628155 9.407494 
1 1 1    3   25   34 o   50.880   7.7406   64.171   16.101   76.890   22.315   50.359   23.254   57.642   9.3862   44.119   12.311 13.52308 15.48128 
1 1 1    3   25   35 o   70.051   5.4321  110.062   15.668  105.800   21.417  114.970   22.982   68.687   7.5599   71.415   7.8025 -2.728096 10.86417 
1 1 1    3   25   36 o   53.998   7.3758   72.348   16.029   66.552   23.295   77.559   22.089   50.796   11.399   57.200   9.3630 -6.403660 14.75151 
1 1 1    3   25   37 o   42.039   7.9760   46.793   14.155   52.225   20.473   41.818   19.592   44.536   11.166   39.542   11.392 4.994125 15.95207 
1 1 1    3   25   38 f   23.824   7.3404   4.2202   13.704  -2.0295   19.309   10.563   19.452   21.967   9.9397   25.681   10.804 -3.714699 14.68088 
1 1 1    3   25   39 o   21.993   7.1080  -4.8829   15.099   7.1585   19.342 -23.6695   24.160   24.124   10.473   19.863   9.6133 4.261278 14.21595 
1 1 1    3   25   40 o   23.240   7.4343   1.3487   15.290   5.4609   21.978  -2.5084   21.286   24.311   10.833   22.168   10.184 2.143467 14.86862 
1 1 1    3   25   41 o   29.680   8.3206   25.061   15.308   30.354   21.583   19.703   21.716   31.595   12.002   27.764   11.528 3.831390 16.64126 
1 1 1    3   25   42 o   26.432   8.1235   14.670   17.222   0.0158   27.345   24.303   22.171   23.895   11.171   28.969   11.797 -5.074093 16.24698 
1 1 1    3   26    0 o   13.627   4.8394   5.6475   4.7273   5.6475   4.7273   5.6475   4.7273   13.627   6.8439   13.627   6.8439 0.000000 0.000000 
1 1 1    3   26    1 o  118.803   2.9584  298.082   12.001  280.869   25.208  303.126   13.647  116.441   5.2489  121.165   2.7309 -4.724472 5.916852 
1 1 1    3   26    2 o  131.979   4.4146  360.357   24.030   0.0000   0.0000  360.357   24.030  ?   ?   131.979   4.4146      ?      ? 
1 1 1    3   26    3 o   90.085   3.3168  167.141   11.966  164.604   15.148  171.353   19.514   89.217   4.1165   90.952   5.2019 -1.735283 6.633630 
1 1 1    3   26    4 o  202.013   4.6383  844.574   38.646   0.0000   0.0000  844.574   38.646  ?   ?   202.013   4.6383      ?      ? 
1 1 1    3   26    5 o   35.056   7.2634   25.072   10.823   21.659   13.452   31.337   18.225   31.953   9.5050   38.159   10.986 -6.205267 14.52684 
1 1 1    3   26    6 o  283.994   3.7035  1670.35   43.354  1653.03   60.148  1689.08   62.547  282.482   5.1626  285.507   5.3116 -3.025665 7.407097 
1 1 1    3   26    7 o   60.215   5.5290   76.683   13.356   81.006   17.303   70.311   21.008   62.429   6.7201   58.001   8.7818 4.427673 11.05804 
1 1 1    3   26    8 o  124.279   3.7276  320.154   19.032  320.681   25.809  319.526   28.177  124.419   5.0294  124.139   5.5033 0.2795944 7.455284 
1 1 1    3   26    9 o   71.245   6.0518   93.170   16.659   68.139   19.870  152.400   30.565   57.111   8.4357   85.380   8.6798 -28.26839 12.10368 
1 1 1    3   26   10 o   60.374   6.4145   75.756   15.885   71.304   21.169   81.494   24.032   58.386   8.7910   62.361   9.3434 -3.975857 12.82890 
1 1 1    3   26   11 o  167.561   3.6866  580.895   25.406  568.116   34.492  596.051   37.563  165.577   5.0507  169.546   5.3717 -3.968384 7.373203 
1 1 1    3   26   12 o  171.725   3.7699  611.825   26.689  619.778   37.349  603.526   38.152  172.883   5.2380  170.567   5.4232 2.315506 7.539731 
1 1 1    3   26   13 o  165.005   5.0016  577.149   30.883  591.164   36.907  544.413   56.404  168.794   5.3014  161.215   8.4828 7.578156 10.00314 
1 1 1    3   26   14 o   78.330   5.9898  131.492   18.899  148.759   25.363  109.935   28.339   84.409   7.2852   72.251   9.5099 12.15808 11.97970 
1 1 1    3   26   15 o   32.365   8.9256   14.156   17.552   22.188   22.738   2.3145   27.610   34.651   12.469   30.080   12.775 4.571222 17.85125 
1 1 1    3   26   16 o  130.676   3.7812  349.402   17.855  343.595   20.668  366.487   35.451  128.810   3.8903  132.542   6.4851 -3.732315 7.562459 
1 1 1    3   26   17 o  201.838   3.2952  844.424   23.797  843.374   27.504  847.549   47.460  201.906   3.3027  201.770   5.7030 0.1361389 6.590337 
1 1 1    3   26   18 o   48.238   3.0186   48.531   5.9062   59.897   8.4882   37.863   8.2233   53.771   3.8274   42.704   4.6689 11.06655 6.037137 
1 1 1    3   26   19 o   41.069   4.6492   33.885   5.8119   39.232   14.245   32.817   6.3658   42.357   8.4503   39.781   3.8798 2.575977 9.298392 
1 1 1    3   26   20 f  104.470   2.6905  223.632   11.318  214.065   14.380  239.208   18.348  101.630   3.4306  107.310   4.1456 -5.679901 5.380993 
1 1 1    3   26   21 o   78.198   3.1568  128.084   9.9829  131.621   13.009  123.017   15.570   79.597   3.9626   76.800   4.9153 2.797188 6.313679 
1 1 1    3   26   22 o  106.618   3.3815  237.863   14.782  231.604   21.970  243.041   19.980  105.256   5.0608  107.980   4.4864 -2.724060 6.763064 
1 1 1    3   26   23 f  146.250   3.9110  458.016   21.728  425.129   38.449  473.445   26.337  141.779   6.5753  150.721   4.2366 -8.942581 7.821971 
1 1 1    3   26   24 o   81.027   6.2431  161.765   15.902  177.422   18.101  108.825   33.285   92.134   4.7635   69.921   11.542 22.21300 12.48625 
1 1 1    3   26   25 o   54.728   3.9824   59.719   8.2137   55.108   9.6462   71.877   15.664   51.309   4.5582   58.146   6.5315 -6.837036 7.964816 
1 1 1    3   26   26 o   24.124   5.8431   12.399   7.1069   15.968   8.1388   0.9401   14.583   26.803   7.2063   21.444   9.1998 5.359030 11.68619 
1 1 1    3   26   27 o   40.741   5.5840   37.163   8.2146   37.819   9.6652   35.457   15.590   42.277   5.5430   39.205   9.6954 3.072037 11.16801 
1 1 1    3   26   28 o   30.741   6.4579   18.440   7.8672   15.082   9.0496   28.829   15.919   26.143   7.8006   35.339   10.294 -9.195583 12.91582 
1 1 1    3   26   29 f   46.127   6.2428   51.238   9.9931   54.805   11.623   41.128   19.567   50.799   5.5477   41.455   11.185 9.343861 12.48562 
1 1 1    3   26   30 o   41.175   6.0511   46.735   9.4314   58.013   11.179   18.883   17.567   52.317   5.1809   30.033   10.937 22.28453 12.10220 
1 1 1    3   26   31 o   34.964   6.1797   31.694   9.2241   38.774   10.891   13.728   17.348   42.431   6.2233   27.497   10.678 14.93449 12.35939 
1 1 1    3   26   32 o   37.143   8.1400   15.278   9.0604   10.066   9.4714   71.447   31.093   22.464   8.0513   51.822   14.150 -29.35790 16.27991 
1 1 1    3   26   33 o   33.995   5.8926   33.362   9.2767   43.117   10.539  -0.1864   19.545   44.699   5.7168   23.292   10.306 21.40683 11.78511 
1 1 1    3   26   34 o   75.001   4.2285  118.186   11.832  112.672   13.899  132.698   22.549   72.719   4.6342   77.284   7.0742 -4.564331 8.456980 
1 1 1    3   26   35 o   18.377   6.0553 -14.3139   8.3102 -19.6262   9.1917   9.4675   19.448   11.011   5.4497   25.743   10.815 -14.73177 12.11065 
1 1 1    3   26   36 o   58.658   7.5106   85.755   17.700   74.065   23.671  100.581   26.657   53.441   11.102   63.875   10.119 -10.43382 15.02129 
1 1 1    3   26   37 o   24.236   6.9304   10.450   9.1381   10.466   10.151   10.384   20.987   22.380   8.2870   26.092   11.111 -3.711399 13.86071 
1 1 1    3   26   38 o   26.837   7.6215   12.133   14.541   29.360   19.550  -9.1978   21.755   32.509   11.576   21.164   9.9165 11.34537 15.24296 
1 1 1    3   26   39 o   21.186   7.0643 -10.5010   16.092 -14.8234   23.620  -6.7569   21.983   20.805   9.9203   21.566   10.060 -0.7604885 14.12867 
1 1 1    3   26   40 o   23.319   7.4057   3.8187   14.936  -3.0528   20.645   11.366   21.636   21.387   9.8984   25.252   11.018 -3.865582 14.81132 
1 1 1    3   26   41 o   28.364   8.2558   22.457   15.575   20.764   21.940   24.176   22.113   27.798   11.568   28.931   11.782 -1.133015 16.51156 
1 1 1    3   27    0 o  228.653   2.4914  1080.16   33.209  1080.16   33.209  1080.16   33.209  228.653   3.5233  228.653   3.5233 0.000000 0.000000 
1 1 1    3   27    1 o  193.296   2.5820  769.707   19.263  780.034   33.958  764.808   23.391  194.167   4.2404  192.426   2.9473 1.741104 5.164008 
1 1 1    3   27    2 o  191.458   2.7301  752.724   21.080  782.711   33.833  733.696   26.951  194.503   4.2174  188.413   3.4681 6.089310 5.460267 
1 1 1    3   27    3 o  264.555   4.1309  1468.38   44.062  1370.43   68.756  1536.64   57.397  256.792   6.4917  272.318   5.1103 -15.52621 8.261852 
1 1 1    3   27    4 o  198.134   5.7789  814.565   47.225   0.0000   0.0000  814.565   47.225  ?   ?   198.134   5.7789      ?      ? 
1 1 1    3   27    5 o   56.488   6.8876   66.384   16.047   66.384   16.047   0.0000   0.0000   56.488   6.8876  ?   ?       ?      ? 
1 1 1    3   27    6 o  163.710   3.8899  549.910   25.785  586.257   41.086  526.291   33.120  168.050   5.9277  159.370   5.0386 8.680557 7.779848 
1 1 1    3   27    7 o   73.785   5.2459  114.038   15.882  123.756   22.079  103.620   22.862   77.107   6.9425   70.463   7.8665 6.643791 10.49189 
1 1 1    3   27    8 o  273.301   5.3422  1549.27   60.218   0.0000   0.0000  1549.27   60.218  ?   ?   273.301   5.3422      ?      ? 
1 1 1    3   27    9 o   73.951   6.4928  112.765   19.482  104.155   25.023  126.017   31.044   70.511   8.6045   77.391   9.7256 -6.880219 12.98552 
1 1 1    3   27   10 o  171.709   3.6704  610.393   25.958  587.499   35.575  636.459   37.959  168.286   5.1255  175.132   5.2552 -6.845428 7.340820 
1 1 1    3   27   11 o   65.581   6.4278   91.974   17.075  103.748   23.172   77.986   25.258   70.397   7.9810   60.765   10.078 9.632011 12.85550 
1 1 1    3   27   12 f  111.104   6.2642  254.550   26.231  272.207   48.797  247.374   31.107  113.341   10.439  108.867   6.9279 4.475052 12.52837 
1 1 1    3   27   13 o  251.040   4.8868  1313.33   46.532  1308.41   55.751  1324.62   84.482  250.898   5.3875  251.182   8.1547 -0.2839966 9.773656 
1 1 1    3   27   14 o   56.131   8.3172   68.992   18.531   62.141   24.573   78.024   28.215   52.923   11.580   59.340   11.942 -6.417187 16.63438 
1 1 1    3   27   15 o  137.409   4.3251  393.810   24.467  395.301   33.644  392.137   35.647  137.733   5.9225  137.086   6.3047 0.6468658 8.650172 
1 1 1    3   27   16 o   31.164   8.7140   0.4869   18.291 -22.3162   23.924   32.574   28.379   22.236   10.413   40.091   13.975 -17.85471 17.42795 
1 1 1    3   27   17 o   31.049   8.8459   7.4989   18.666   24.158   25.176 -12.8388   27.817   35.822   13.086   26.276   11.906 9.545998 17.69174 
1 1 1    3   27   18 o   76.672   5.3185  132.872   10.580  135.680   11.300  112.911   30.123   80.914   3.3859   72.429   10.084 8.484894 10.63709 
1 1 1    3   27   19 o  115.515   3.9727  281.221   14.295  282.278   15.741  276.245   34.146  116.701   3.2703  114.330   7.2412 2.371361 7.945417 
1 1 1    3   27   20 o   46.046   3.8004   38.379   5.7656   55.076   13.937   34.931   6.3330   51.088   6.6143   41.004   3.7447 10.08392 7.600810 
1 1 1    3   27   21 o   50.262   2.9391   52.180   5.9482   54.655   9.6010   50.639   7.5778   51.171   4.5491   49.353   3.7227 1.817970 5.878186 
1 1 1    3   27   22 o   20.679   5.2862   7.8150   5.7011   8.9135   7.0940   5.8116   9.5802   20.993   6.9948   20.365   7.9278 0.6285534 10.57244 
1 1 1    3   27   23 o   29.012   5.0958   20.278   6.3765   25.778   7.7683   8.9170   11.164   35.017   5.3788   23.007   8.6567 12.00963 10.19164 
1 1 1    3   27   24 o   94.954   3.6854  193.907   14.021  143.714   20.006  242.362   19.656   82.342   5.8906  107.565   4.4305 -25.22323 7.370832 
1 1 1    3   27   25 o   38.475   7.6960   13.495   7.3427   9.7823   7.5615   74.874   30.746   21.744   7.2204   55.206   13.593 -33.46200 15.39207 
1 1 1    3   27   26 o   86.888   3.4415  157.171   11.632  153.867   14.194  163.928   20.298   85.790   4.0114   87.987   5.5933 -2.197594 6.883012 
1 1 1    3   27   27 o   53.019   4.2484   56.714   8.4939   52.535   9.9891   67.624   16.139   49.960   4.8478   56.077   6.9781 -6.117489 8.496716 
1 1 1    3   27   28 o   49.554   5.9841   54.757   11.956   59.945   17.531   50.244   16.348   52.168   8.1477   46.940   8.7666 5.227535 11.96824 
1 1 1    3   27   29 f   35.592   6.4001   27.582   8.3561   25.977   9.5476   32.837   17.274   34.059   7.0297   37.125   10.697 -3.065517 12.80016 
1 1 1    3   27   30 o   17.578   5.6285  -3.5847   7.2767  -4.3197   8.2495  -1.0078   15.446   14.157   6.4417   20.998   9.2316 -6.841049 11.25690 
1 1 1    3   27   31 o   35.220   6.4165   29.763   8.7358   30.949   10.180   26.449   17.016   37.141   6.8994   33.300   10.821 3.840969 12.83298 
1 1 1    3   27   32 o   49.288   5.2457   51.796   10.007   47.640   12.030   61.129   18.029   46.754   6.2383   51.821   8.4352 -5.066158 10.49140 
1 1 1    3   27   33 o   20.362   6.1133   4.1475   7.9479   5.9962   8.9233  -2.9491   17.483   19.465   7.6308   21.258   9.5532 -1.792894 12.22668 
1 1 1    3   27   34 o   25.211   6.4726   14.330   8.4871   17.094   9.6539   4.9258   17.809   26.912   8.0629   23.510   10.128 3.401398 12.94524 
1 1 1    3   27   35 o   37.902   6.7894   32.041   9.1769   28.680   10.343   44.474   19.892   34.987   7.3990   40.817   11.386 -5.829605 13.57872 
1 1 1    3   27   36 o   22.692   7.0508  -5.8217   13.684 -24.5249   18.279   18.017   20.637   16.881   8.2146   28.502   11.462 -11.62162 14.10165 
1 1 1    3   27   37 o   25.781   6.8226   15.798   9.3093   17.964   10.459   7.5406   20.424   26.993   8.4518   24.568   10.713 2.424490 13.64525 
1 1 1    3   27   38 o   21.943   6.7614   2.2492   9.1282  -1.2100   10.138   17.065   20.981   16.465   7.3456   27.421   11.354 -10.95527 13.52284 
1 1 1    3   27   39 o   23.519   7.0779   9.1074   9.8113   7.9945   10.822   14.246   23.254   20.678   8.3055   26.360   11.463 -5.682257 14.15585 
1 1 1    3   27   40 f   32.380   8.1326   31.400   11.891   32.198   12.420   22.610   41.203   35.181   8.6256   29.579   13.790 5.601847 16.26513 
1 1 1    3   28    0 o   56.979   2.0295   67.519   6.7058   67.519   6.7058   67.519   6.7058   56.979   2.8701   56.979   2.8701 0.000000 0.000000 
1 1 1    3   28    1 o   67.934   2.9580   98.891   7.7747   85.159   13.027  106.488   9.6897   64.092   4.9280   71.776   3.2732 -7.683853 5.915969 
1 1 1    3   28    2 o  317.140   5.4176  2087.49   70.864   0.0000   0.0000  2087.49   70.864  ?   ?   317.140   5.4176      ?      ? 
1 1 1    3   28    3 o   92.619   3.4070  182.205   11.885  166.789   21.310  189.165   14.319   89.602   5.7664   95.635   3.6302 -6.033318 6.813930 
1 1 1    3   28    4 o  177.928   3.4329  659.513   22.522  649.244   42.665  663.480   26.518  176.749   5.8525  179.107   3.5897 -2.358047 6.865727 
1 1 1    3   28    5 o   95.972   3.5635  192.453   12.739  187.784   23.679  194.354   15.112   95.024   6.0418   96.919   3.7804 -1.895775 7.127077 
1 1 1    3   28    6 o  145.290   3.4535  439.120   20.609  455.555   28.233  420.371   30.154  148.253   4.6172  142.328   5.1368 5.925552 6.906941 
1 1 1    3   28    7 f   88.614   5.7465  163.245   21.002  163.245   21.002   0.0000   0.0000   88.614   5.7465  ?   ?       ?      ? 
1 1 1    3   28    8 o   79.964   4.9365  131.408   16.115  119.530   21.039  148.269   25.067   75.694   6.7391   84.234   7.2152 -8.539436 9.872955 
1 1 1    3   28    9 o   69.619   6.4979  104.954   17.620   75.980   24.736  134.803   25.106   59.006   10.551   80.231   7.5870 -21.22562 12.99582 
1 1 1    3   28   10 o   73.598   8.1925  103.302   22.721  149.170   44.495   87.121   26.427   83.096   12.983   64.099   9.9960 18.99641 16.38501 
1 1 1    3   28   11 o   45.791   16.959   39.583   42.515   39.583   42.515   0.0000   0.0000   45.791   16.959  ?   ?       ?      ? 
1 1 1    3   28   12 o   29.300   13.797 -41.3155   43.025 -41.3155   43.025   0.0000   0.0000   29.300   13.797  ?   ?       ?      ? 
1 1 1    3   28   13 o  144.316   6.9377  436.206   41.295  436.206   41.295   0.0000   0.0000  144.316   6.9377  ?   ?       ?      ? 
1 1 1    3   28   14 o   21.818   7.3292 -29.4290   17.929 -24.0934   24.403 -35.6882   26.430   22.147   10.417   21.489   10.313 0.6583309 14.65836 
1 1 1    3   28   15 o   34.211   9.0238   20.783   17.308   26.810   23.199   13.216   25.994   36.279   12.636   32.143   12.886 4.136539 18.04758 
1 1 1    3   28   16 o   24.544   7.8944 -14.7680   17.226 -22.8771   22.257  -2.6548   27.203   20.945   9.8814   28.142   12.315 -7.196589 15.78889 
1 1 1    3   28   17 o   37.080   9.9035   25.066   19.687   25.094   23.733   25.004   35.252   35.497   12.742   38.663   15.164 -3.165997 19.80702 
1 1 1    3   28   18 o   44.419   9.6502   45.303   19.287   42.877   25.799   48.376   29.041   43.207   13.232   45.631   14.050 -2.423443 19.30037 
1 1 1    3   28   19 o   47.210   7.2704   49.851   7.1973   49.954   7.4287   48.268   29.065   49.022   3.6741   45.397   14.069 3.624996 14.54073 
1 1 1    3   28   20 o   54.923   7.4532   95.007   10.154  102.711   10.763   32.609   30.631   70.288   3.7126   39.558   14.437 30.72936 14.90643 
1 1 1    3   28   21 o   67.939   2.6726   98.949   7.2564   75.146   10.658  119.514   9.9070   60.000   4.3070   75.878   3.1657 -15.87805 5.345260 
1 1 1    3   28   22 o   38.050   3.2737   29.842   5.0171   32.739   8.1618   28.082   6.3608   39.454   5.0157   36.646   4.2084 2.807449 6.547374 
1 1 1    3   28   23 o   27.699   5.2776   16.544   6.0352   14.447   7.6479   20.004   9.8257   25.543   7.0354   29.855   7.8686 -4.311937 10.55522 
1 1 1    3   28   24 o   18.586   5.2342   3.1183   5.7475   0.6730   6.9748   8.2918   10.145   15.213   6.4386   21.959   8.2541 -6.745620 10.46834 
1 1 1    3   28   25 o   62.991   3.5962   77.565   8.8959   65.103   10.755  104.552   15.828   55.668   4.6844   70.315   5.4576 -14.64730 7.192353 
1 1 1    3   28   26 o   89.306   4.7723  145.433   11.618  137.556   12.298  210.742   35.413   81.140   3.6749   97.472   8.8087 -16.33258 9.544535 
1 1 1    3   28   27 o   14.508   4.7028  -4.2300   5.9647  -0.1490   6.7046 -19.7187   13.062   14.443   6.2178   14.574   7.0573 -0.1315441 9.405682 
1 1 1    3   28   28 o   62.023   3.9408   77.817   9.4985   70.146   11.416   95.071   17.122   57.583   4.8069   66.464   6.2459 -8.880669 7.881514 
1 1 1    3   28   29 o   20.420   6.3946  -2.1998   10.607   0.0956   15.883  -4.0478   14.251   21.603   9.4327   19.237   8.6364 2.366518 12.78915 
1 1 1    3   28   30 o   41.801   5.6163   38.625   8.2737   37.507   9.5544   41.978   16.544   41.791   5.5431   41.810   9.7697 -0.1936722E-01 11.23267 
1 1 1    3   28   31 o   30.226   6.7431   16.751   12.580 -16.1187   19.238   41.303   16.627   19.326   9.1387   41.125   9.9176 -21.79896 13.48613 
1 1 1    3   28   32 o   31.274   6.5607   23.888   8.5677   25.019   9.9181   20.562   17.007   32.815   7.4927   29.733   10.772 3.082039 13.12132 
1 1 1    3   28   33 o   25.810   6.4043   16.104   9.7259   23.282   10.330 -39.8993   28.854   31.216   7.9900   20.403   10.011 10.81379 12.80868 
1 1 1    3   28   34 o   18.130   5.7176  -0.3430   8.0259   3.1657   9.0659 -13.0574   17.258   17.850   7.4331   18.409   8.6899 -0.5590267 11.43530 
1 1 1    3   28   35 o   29.021   7.0511   21.113   9.5356   22.454   10.726   16.057   20.823   30.294   8.3271   27.748   11.381 2.545261 14.10227 
1 1 1    3   28   36 o   29.177   7.0766   20.382   9.2260   18.640   10.573   25.940   18.887   27.423   8.4835   30.931   11.329 -3.508717 14.15324 
1 1 1    3   28   37 o   21.284   6.8939  -3.4485   13.696  -9.8668   18.736   3.9171   20.071   19.382   9.1201   23.186   10.340 -3.803974 13.78772 
1 1 1    3   28   38 o   37.412   6.9302   46.890   12.721   56.044   14.140   8.0043   29.143   48.782   7.0276   26.042   11.947 22.73984 13.86048 
1 1 1    3   28   39 o   25.375   8.5810  -3.1196   24.990  -9.0413   32.937   4.9141   38.364   23.933   11.493   26.817   12.746 -2.883986 17.16207 
1 1 1    3   29    0 o   55.142   2.0536   63.296   6.5631   63.296   6.5631   63.296   6.5631   55.142   2.9042   55.142   2.9042 0.000000 0.000000 
1 1 1    3   29    1 o  104.808   2.7058  226.984   11.697   0.0000   0.0000  226.984   11.697  ?   ?   104.808   2.7058      ?      ? 
1 1 1    3   29    2 o  109.761   2.9847  248.763   13.312  244.505   17.327  254.898   20.796  108.662   3.8661  110.860   4.5482 -2.197655 5.969365 
1 1 1    3   29    3 o  106.830   3.2906  241.456   13.177  225.371   23.949  248.439   15.780  104.087   5.5785  109.572   3.4917 -5.485535 6.581171 
1 1 1    3   29    4 o  191.688   3.7965  760.417   29.157  778.887   47.467  749.226   36.949  193.370   5.9517  190.006   4.7149 3.363953 7.592942 
1 1 1    3   29    5 o  129.911   3.3211  352.571   16.125  344.736   29.818  355.810   19.171  128.707   5.6171  131.115   3.5450 -2.407898 6.642169 
1 1 1    3   29    6 o  107.797   3.7402  244.440   16.430  271.718   22.488  213.207   24.063  114.407   4.7657  101.188   5.7658 13.21875 7.480453 
1 1 1    3   29    7 o   74.496   4.7773  118.969   14.219  131.545   18.619  101.368   22.026   79.488   5.6791   69.504   7.6836 9.983612 9.554531 
1 1 1    3   29    8 o   46.004   7.8649   43.048   14.019   35.165   16.881   60.564   25.163   39.913   10.213   52.094   11.964 -12.18111 15.72989 
1 1 1    3   29    9 o   88.033   5.1075  163.155   18.463  148.143   26.398  177.530   25.831   83.970   7.6222   92.096   6.8004 -8.125694 10.21491 
1 1 1    3   29   10 o   45.670   8.1444   46.374   15.179   44.443   19.852   49.091   23.550   44.630   10.883   46.711   12.120 -2.080265 16.28882 
1 1 1    3   29   11 o   83.229   5.4048  148.622   18.191  163.791   24.339  129.424   27.381   88.345   6.6798   78.114   8.4987 10.23109 10.80958 
1 1 1    3   29   12 o   34.360   10.527  -1.5389   28.191   15.695   39.409 -19.6006   40.344   37.763   15.592   30.958   14.148 6.804621 21.05402 
1 1 1    3   29   13 o  112.307   4.5501  264.515   21.027  259.275   28.655  270.628   30.951  111.162   6.2499  113.453   6.6145 -2.290825 9.100212 
1 1 1    3   29   14 o   73.937   6.1625  118.399   18.474  128.091   24.697  106.084   27.838   77.704   7.7060   70.170   9.6188 7.534042 12.32493 
1 1 1    3   29   15 o  109.548   4.6452  251.859   20.915  238.734   28.182  267.950   31.204  106.442   6.4194  112.654   6.7158 -6.211792 9.290374 
1 1 1    3   29   16 o   63.666   7.4149   87.565   18.728   68.633   24.526  114.039   29.003   54.903   11.210   72.430   9.7086 -17.52628 14.82979 
1 1 1    3   29   17 o   57.034   10.237   76.942   24.006   67.670   31.843   89.150   36.539   53.189   14.235   60.878   14.715 -7.689182 20.47353 
1 1 1    3   29   18 o   41.757   11.175   31.630   23.550   49.009   47.144   25.852   27.184   47.156   17.780   36.358   13.542 10.79871 22.34935 
1 1 1    3   29   19 o   73.641   9.6973  121.631   26.688  145.529   49.018  111.563   31.817   76.570   16.035   70.712   10.909 5.858368 19.39458 
1 1 1    3   29   20 o   43.722   12.330   38.113   35.263   61.768   47.010   7.6788   53.322   49.197   17.895   38.247   16.967 10.94928 24.66053 
1 1 1    3   29   21 o   85.988   3.3626  153.897   11.926  153.897   11.926   0.0000   0.0000   85.988   3.3626  ?   ?       ?      ? 
1 1 1    3   29   22 o   45.581   4.4481   43.568   8.3623   43.568   8.3623   0.0000   0.0000   45.581   4.4481  ?   ?       ?      ? 
1 1 1    3   29   23 o   26.220   4.0995   14.107   4.1790   19.378   7.1495   11.371   5.1506   29.696   6.0428   22.745   5.5415 6.951365 8.199009 
1 1 1    3   29   24 o   98.003   2.9333  199.803   11.567  194.823   14.734  207.803   18.673   96.582   3.6987   99.425   4.5536 -2.842590 5.866507 
1 1 1    3   29   25 o   75.969   3.3454  118.915   10.094  111.704   12.515  132.337   17.073   72.947   4.1597   78.991   5.2405 -6.043953 6.690732 
1 1 1    3   29   26 o   47.241   3.3279   47.270   6.3618   46.252   9.9451   47.975   8.2767   46.697   5.1636   47.784   4.1996 -1.086575 6.655807 
1 1 1    3   29   27 o   45.804   7.7180   45.234   9.6825   43.918   10.209   57.016   30.551   45.358   5.4571   46.250   14.439 -0.8923683 15.43592 
1 1 1    3   29   28 o   49.433   4.5169   46.880   8.4662   38.571   9.8822   69.802   16.414   42.411   5.6495   56.454   7.0493 -14.04346 9.033765 
1 1 1    3   29   29 o   31.759   5.7859   25.908   7.7355   30.481   8.9981   12.956   15.143   37.546   5.8106   25.973   10.007 11.57331 11.57171 
1 1 1    3   29   30 f   27.631   6.9511   15.237   10.909   2.7364   15.597   27.210   15.264   21.976   9.4721   33.285   10.176 -11.30884 13.90215 
1 1 1    3   29   31 o   38.310   6.0021   31.399   8.2806   27.387   9.5382   43.676   16.685   34.561   6.9326   42.060   9.7999 -7.499359 12.00416 
1 1 1    3   29   32 o   17.770   5.5735   0.4122   7.3017   3.3860   8.1227 -12.1075   16.666   17.290   7.1020   18.250   8.5917 -0.9599628 11.14701 
1 1 1    3   29   33 o   30.030   6.7014   17.250   8.8197   9.8359   10.317   37.382   17.000   22.127   8.3224   37.933   10.506 -15.80549 13.40277 
1 1 1    3   29   34 o   36.094   8.0939   13.255   9.1332   6.6264   9.5486   84.511   31.307   19.810   7.8529   52.378   14.155 -32.56799 16.18776 
1 1 1    3   29   35 o   24.661   7.6128   10.637   9.8456   12.733   10.048 -39.8179   49.293   23.474   8.3055   25.849   12.761 -2.374554 15.22559 
1 1 1    3   29   36 o   24.445   8.0886  -3.5333   20.262  -9.6568   27.518   3.7185   29.946   22.956   10.877   25.935   11.975 -2.979589 16.17715 
1 1 1    3   29   37 f   24.256   7.9966   0.3522   19.637   3.9943   27.410  -3.4882   28.146   24.822   11.459   23.690   11.156 1.132912 15.99315 
1 1 1    3   29   38 o   30.889   9.6242   28.908   23.054   18.345   29.019   46.983   37.959   27.819   12.418   33.960   14.707 -6.140867 19.24832 
1 1 1    3   30    0 f   55.607   3.3671   65.396   10.737   65.396   10.737   65.396   10.737   55.607   4.7618   55.607   4.7618 0.000000 0.000000 
1 1 1    3   30    1 o  170.742   3.1272  603.210   22.022   0.0000   0.0000  603.210   22.022  ?   ?   170.742   3.1272      ?      ? 
1 1 1    3   30    2 f   60.841   3.4273   76.174   7.9375   79.019   14.427   74.939   9.5053   61.555   5.6828   60.128   3.8329 1.427494 6.854552 
1 1 1    3   30    3 o   82.246   3.8995  139.710   13.158  160.916   19.637  122.427   17.727   87.873   5.4180   76.618   5.6097 11.25492 7.798977 
1 1 1    3   30    4 o   44.723   4.8846   44.542   7.7783   38.262   14.244   47.210   9.2850   41.796   8.5509   47.650   4.7245 -5.854324 9.769289 
1 1 1    3   30    5 o  102.011   3.9219  217.215   16.457  216.268   24.137  218.039   22.497  101.758   5.7511  102.264   5.3338 -0.5061493 7.843755 
1 1 1    3   30    6 o  115.455   3.4312  272.125   14.756  290.119   28.019  265.220   17.357  117.820   5.7659  113.090   3.7213 4.730690 6.862469 
1 1 1    3   30    7 o   57.440   5.8968   74.008   12.854   83.967   16.559   58.904   20.391   63.277   6.3447   51.603   9.9416 11.67402 11.79363 
1 1 1    3   30    8 o  145.717   4.1451  448.092   23.704  456.940   29.493  431.948   39.838  148.109   4.8280  143.325   6.7392 4.784332 8.290111 
1 1 1    3   30    9 o  156.865   4.0939  511.010   26.009  536.338   41.268  494.319   33.500  159.868   6.2588  153.862   5.2790 6.005325 8.187804 
1 1 1    3   30   10 o   65.805   6.0200   92.740   16.137   94.930   21.385   89.843   24.591   66.898   7.7505   64.711   9.2136 2.187386 12.03998 
1 1 1    3   30   11 o  101.499   4.4836  214.527   18.672  192.420   24.968  242.583   28.127   95.631   6.3301  107.368   6.3515 -11.73698 8.967293 
1 1 1    3   30   12 o   82.264   7.1909  125.063   20.690  107.907   23.124  193.951   46.336   71.147   7.8802   93.381   12.031 -22.23343 14.38183 
1 1 1    3   30   13 o   77.873   5.5476  126.739   17.624  109.616   23.005  151.068   27.422   71.663   7.7832   84.083   7.9072 -12.41990 11.09514 
1 1 1    3   30   14 o   69.744   6.2508  104.445   17.890   99.933   23.929  110.162   26.936   68.158   8.5124   71.330   9.1557 -3.172432 12.50155 
1 1 1    3   30   15 o   35.854   8.7818   24.344   16.280   12.173   21.382   41.134   25.113   29.454   11.727   42.255   13.075 -12.80105 17.56355 
1 1 1    3   30   16 f   35.057   8.8636   24.830   16.920   34.974   22.478   11.565   25.704   39.179   12.407   30.935   12.662 8.244089 17.72711 
1 1 1    3   30   17 o   23.317   7.6578 -19.8820   17.971 -32.5356   25.039  -6.4387   25.808   20.703   9.9615   25.931   11.633 -5.228714 15.31557 
1 1 1    3   30   18 o   75.421   6.3524  123.673   19.554  101.363   26.391  150.827   29.115   67.708   9.4504   83.133   8.4914 -15.42495 12.70486 
1 1 1    3   30   19 o   48.932   8.8979   56.410   18.651   36.806   25.136   80.420   27.819   39.580   13.166   58.283   11.973 -18.70236 17.79588 
1 1 1    3   30   20 f   47.638   12.385   53.927   34.243   20.379   48.642   86.889   48.216   39.104   16.789   56.173   18.212 -17.06872 24.77025 
1 1 1    3   30   21 o   31.934   8.7313   9.3712   19.088   38.597   26.427 -22.5079   27.601   40.325   13.501   23.542   11.075 16.78284 17.46267 
1 1 1    3   30   22 o   92.675   4.8870  203.037   12.121  209.960   13.071  160.501   32.397  100.439   3.1552   84.911   9.2507 15.52791 9.773957 
1 1 1    3   30   23 o   28.497   6.1464   20.859   6.7131   23.387   6.9037 -23.0372   28.770   33.243   5.0352   23.752   11.214 9.490589 12.29288 
1 1 1    3   30   24 o   77.051   3.2221  130.387   9.0275  113.391   16.840  137.240   10.694   72.960   5.5963   81.143   3.1953 -8.183815 6.444279 
1 1 1    3   30   25 o   51.865   2.9465   56.278   6.2039   58.349   9.7417   54.866   8.0467   52.580   4.4921   51.150   3.8142 1.429829 5.892937 
1 1 1    3   30   26 o   18.080   4.6979   5.9285   4.4938   5.5319   7.4503   6.1553   5.6341   18.420   7.0383   17.739   6.2246 0.6805000 9.395857 
1 1 1    3   30   27 o   40.766   3.9574   35.276   6.3452   37.334   10.841   34.203   7.8258   41.418   6.3459   40.113   4.7302 1.304966 7.914855 
1 1 1    3   30   28 o   31.757   4.6085   22.638   6.0813   36.383   8.9360   10.781   8.2997   41.157   5.2643   22.358   7.5659 18.79882 9.217086 
1 1 1    3   30   29 o   35.299   4.3521   27.255   6.1373   29.956   9.5275   25.339   8.0238   36.418   6.5855   34.180   5.6917 2.237801 8.704253 
1 1 1    3   30   30 o   33.043   6.0407   27.332   7.9689   29.271   9.4762   22.648   14.726   35.794   6.6641   30.292   10.077 5.501959 12.08143 
1 1 1    3   30   31 o   20.157   6.3062  -0.2459   10.334  -2.0966   14.166   1.8599   15.110   19.249   8.6283   21.066   9.1990 -1.816582 12.61230 
1 1 1    3   30   32 o   42.451   5.9470   45.187   8.9896   47.848   10.549   38.124   17.183   46.772   5.4681   38.131   10.563 8.641182 11.89399 
1 1 1    3   30   33 o   25.746   8.2268  -8.3571   20.301 -41.6902   28.145   27.791   29.309   19.452   9.6101   32.040   13.355 -12.58812 16.45353 
1 1 1    3   30   34 o   22.699   7.9226 -34.2767   24.240 -39.7005   44.654 -32.0107   28.863   24.735   12.199   20.663   10.113 4.071217 15.84519 
1 1 1    3   30   35 o   24.409   8.0346  -2.9680   19.871 -16.2251   27.546   11.415   28.692   21.843   10.494   26.975   12.169 -5.132011 16.06922 
1 1 1    3   30   36 o   17.315   6.1612 -58.0524   19.421 -71.1886   26.581 -43.0091   28.445   15.822   8.0197   18.808   9.3556 -2.986441 12.32250 
1 1 1    3   31    0 o   26.609   5.4290   17.961   7.3093   17.961   7.3093   17.961   7.3093   26.609   7.6778   26.609   7.6778 0.000000 0.000000 
1 1 1    3   31    1 o   65.379   2.7318   88.123   7.2807   92.862   11.306   84.766   9.5164   66.841   4.1012   63.918   3.6098 2.923679 5.463564 
1 1 1    3   31    2 o   83.340   3.5834  143.838   12.266  157.980   18.398  132.524   16.456   86.986   5.1282   79.693   5.0066 7.292999 7.166848 
1 1 1    3   31    3 o   79.782   3.8945  131.684   12.714  157.392   19.031  110.960   17.087   86.775   5.3174   72.789   5.6915 13.98669 7.788975 
1 1 1    3   31    4 o  175.299   3.7587  625.114   25.935  700.191   44.860  587.423   31.785  182.686   5.9537  167.911   4.5896 14.77475 7.517347 
1 1 1    3   31    5 o   30.645   5.2269   13.766   6.5974   40.185   13.084   4.7590   7.6397   42.918   7.6732   18.372   7.0996 24.54605 10.45383 
1 1 1    3   31    6 o   22.276   5.8178   8.7424   6.4697   5.5513   13.325   9.7266   7.4005   22.749   9.1885   21.803   7.1385 0.9456158 11.63556 
1 1 1    3   31    7 o   83.192   3.3166  138.308   10.880  165.217   18.948  125.073   13.289   88.868   5.1695   77.516   4.1564 11.35128 6.633199 
1 1 1    3   31    8 o   58.190   6.4038   74.107   13.956   74.331   17.012   73.646   24.406   59.231   6.9639   57.148   10.749 2.083515 12.80766 
1 1 1    3   31    9 o   36.000   8.2371   28.328   13.850   26.398   18.330   30.894   21.143   34.710   11.226   37.290   12.057 -2.579735 16.47418 
1 1 1    3   31   10 o   86.457   4.7903  157.388   16.926  151.501   22.304  165.382   25.990   84.690   6.3854   88.223   7.1425 -3.532562 9.580651 
1 1 1    3   31   11 o   75.837   7.5977  114.342   21.389  157.099   42.704  100.022   24.713   83.571   12.389   68.103   8.7982 15.46852 15.19545 
1 1 1    3   31   12 o   40.789   8.5683   42.727   18.288   59.588   20.638 -18.9106   39.459   51.443   10.088   30.136   13.853 21.30655 17.13663 
1 1 1    3   31   13 o   28.378   7.4801   2.9244   15.010   32.088   20.191 -33.1007   22.442   37.588   11.739   19.167   9.2738 18.42130 14.96017 
1 1 1    3   31   14 o   39.192   8.8552   34.506   16.108   27.565   21.120   44.160   24.907   35.321   12.068   43.063   12.962 -7.742264 17.71039 
1 1 1    3   31   15 o   72.281   6.0704  112.884   17.997  100.248   24.063  128.924   27.111   67.727   8.6145   76.835   8.5550 -9.108261 12.14071 
1 1 1    3   31   16 o   48.588   9.4319   55.533   18.765   49.800   23.162   66.481   32.009   45.630   12.107   51.546   14.466 -5.915958 18.86372 
1 1 1    3   31   17 o   81.965   6.3345  148.353   21.317  133.637   30.240  162.890   30.055   77.621   9.4456   86.308   8.4429 -8.687111 12.66896 
1 1 1    3   31   18 o   37.832   9.2533   29.557   18.337   13.904   24.410   49.835   27.782   30.660   12.418   45.003   13.722 -14.34334 18.50667 
1 1 1    3   31   19 o   37.255   9.7102   30.367   19.695   32.603   27.456   27.997   28.267   38.021   13.699   36.489   13.765 1.532383 19.42033 
1 1 1    3   31   20 o   62.265   10.313   95.843   23.412   93.844   26.804  102.276   48.077   64.376   10.095   60.154   17.987 4.222340 20.62610 
1 1 1    3   31   21 o   40.458   8.8155   32.649   18.894   2.0982   25.128   72.394   28.660   27.127   11.854   53.790   13.051 -26.66329 17.63098 
1 1 1    3   31   22 f   52.825   9.0968   70.493   19.710   78.074   26.697   61.409   29.223   56.774   11.787   48.875   13.859 7.898663 18.19358 
1 1 1    3   31   23 o   29.635   8.8346   10.209   18.747   17.847   25.469   1.1779   27.695   31.542   12.716   27.728   12.268 3.814089 17.66929 
1 1 1    3   31   24 o   84.085   6.4453  174.214   11.972  177.628   12.579  141.330   39.038   92.201   3.3077   75.969   12.459 16.23215 12.89051 
1 1 1    3   31   25 o   51.851   7.6645   64.972   12.601   65.000   13.905   64.841   29.809   54.774   6.1549   48.928   14.039 5.846516 15.32900 
1 1 1    3   31   26 o   42.867   3.0870   37.720   5.3441   45.199   8.7079   33.202   6.7686   46.108   4.5790   39.626   4.1414 6.481827 6.174058 
1 1 1    3   31   27 o   17.448   4.5280   3.6580   4.3362   10.601   7.4223   0.0606   5.3428   21.952   7.1472   12.944   5.5613 9.007630 9.055909 
1 1 1    3   31   28 o   74.333   3.0741  120.392   9.0418  106.542   14.508  129.189   11.562   70.377   4.9980   78.288   3.5807 -7.910538 6.148294 
1 1 1    3   31   29 o   57.975   3.4332   72.370   8.1789   71.651   11.082   73.231   12.121   57.761   4.6517   58.188   5.0507 -0.4268341 6.866423 
1 1 1    3   31   30 o   40.018   9.8696   47.897   20.198   40.389   28.317   55.673   28.817   37.167   13.825   42.869   14.089 -5.701862 19.73930 
1 1 1    3   31   31 o   28.979   9.1384   12.262   22.201   18.447   27.848   1.4770   36.772   29.759   12.738   28.199   13.106 1.559755 18.27680 
1 1 1    3   31   32 o   28.699   8.7820   14.423   19.816  -1.4532   28.047   30.245   28.000   24.920   11.535   32.479   13.245 -7.559263 17.56400 
1 1 1    3   31   33 o   25.650   8.2704   2.9597   19.802   14.510   27.047 -10.3831   29.070   27.787   12.216   23.513   11.152 4.273840 16.54082 
1 1 1    3   31   34 o   39.328   11.600   67.337   33.478   26.516   45.619  114.976   49.282   31.036   14.483   47.620   18.124 -16.58444 23.19979 
1 1 1    3   31   35 o   24.075   7.9288   1.1611   19.174   1.7566   26.425   0.4989   27.866   24.003   11.141   24.146   11.285 -0.1428890 15.85758 
1 1 1    3   32    0 o   96.723   2.7745  194.757   15.594  194.757   15.594  194.757   15.594   96.723   3.9237   96.723   3.9237 0.000000 0.000000 
1 1 1    3   32    1 o  104.931   3.0111  230.332   12.196  227.133   21.326  231.887   14.867  104.187   4.9629  105.675   3.4110 -1.487915 6.022120 
1 1 1    3   32    2 o   77.357   3.1197  124.693   9.0813  125.180   16.700  124.489   10.821   77.282   5.2392   77.432   3.3884 -0.1493683 6.239362 
1 1 1    3   32    3 f   34.522   5.9255   26.626   8.3264   27.294   11.217   25.805   12.427   35.074   7.9390   33.971   8.7987 1.102634 11.85093 
1 1 1    3   32    4 f  124.881   3.4185  323.841   17.607   0.0000   0.0000  323.841   17.607  ?   ?   124.881   3.4185      ?      ? 
1 1 1    3   32    5 o   49.888   4.4281   51.385   8.7195   56.409   14.922   48.780   10.745   51.556   7.0176   48.221   5.4025 3.334415 8.856248 
1 1 1    3   32    6 o  148.221   3.7654  456.509   22.552  481.133   36.068  440.702   28.898  151.254   5.7816  145.188   4.8258 6.066483 7.530893 
1 1 1    3   32    7 o   72.387   3.9288  108.774   10.534  113.067   20.040  107.135   12.382   73.075   6.6490   71.698   4.1873 1.377266 7.857649 
1 1 1    3   32    8 o   34.471   6.0134   23.900   7.8053   33.943   15.040   20.198   9.1311   38.746   9.4874   30.195   7.3916 8.550972 12.02689 
1 1 1    3   32    9 o   93.188   4.6943  183.648   17.980  206.284   26.384  164.020   24.569   98.584   6.4889   87.791   6.7854 10.79369 9.388688 
1 1 1    3   32   10 o   42.985   7.6385   41.386   14.392   21.289   19.409   65.937   21.452   32.127   11.524   53.842   10.029 -21.71528 15.27700 
1 1 1    3   32   11 o   43.158   10.483   39.041   19.899   60.373   41.014   32.474   22.756   48.710   16.811   37.605   12.528 11.10550 20.96558 
1 1 1    3   32   12 o   32.551   8.8820   20.091   17.101   29.506   18.854 -23.6089   40.620   35.856   11.364   29.247   13.654 6.609478 17.76402 
1 1 1    3   32   13 o   26.952   7.9471   6.8514   14.770   11.054   19.678   1.4288   22.354   27.875   11.199   26.030   11.279 1.845592 15.89426 
1 1 1    3   32   14 o   93.420   4.9692  186.643   19.101  173.575   25.981  202.014   28.178   89.888   7.0080   96.951   7.0469 -7.062958 9.938350 
1 1 1    3   32   15 o   56.425   7.6261   73.307   17.013   67.876   22.688   80.283   25.715   54.138   10.540   58.711   11.024 -4.572548 15.25213 
1 1 1    3   32   16 f  103.420   5.5723  232.597   22.813  233.626   28.620  230.803   37.781  104.488   6.6410  102.351   8.9498 2.137550 11.14457 
1 1 1    3   32   17 o   21.780   7.2132 -25.7630   16.362 -43.6309   21.515  -1.2548   25.198   17.005   8.4016   26.554   11.728 -9.548723 14.42649 
1 1 1    3   32   18 o   43.162   8.8433   42.658   17.903   20.698   23.770   71.448   27.217   32.424   12.525   53.901   12.488 -21.47694 17.68662 
1 1 1    3   32   19 o   34.468   10.181   19.315   22.703   12.032   43.538   22.035   26.607   35.393   15.531   33.544   13.169 1.848148 20.36217 
1 1 1    3   32   20 o   60.311   8.3462   87.570   19.955   81.199   26.915   95.347   29.737   57.931   11.668   62.691   11.937 -4.759525 16.69241 
1 1 1    3   32   21 o   33.219   9.1545   18.685   18.874   2.5869   25.279   38.963   28.372   27.051   11.853   39.387   13.954 -12.33561 18.30899 
1 1 1    3   32   22 o   81.163   6.5565  152.553   21.292  187.311   29.715  115.877   30.523   91.940   7.8361   70.386   10.514 21.55357 13.11308 
1 1 1    3   32   23 o   49.467   9.1424   65.577   19.888   86.616   27.331   41.898   28.995   59.073   11.632   39.861   14.108 19.21179 18.28485 
1 1 1    3   32   24 o   33.494   9.9378   21.736   23.401   28.322   31.082   13.118   35.556   34.968   14.065   32.019   14.043 2.948685 19.87556 
1 1 1    3   32   25 o   30.009   8.7261   12.707   18.745   31.426   25.789  -8.2613   27.294   35.213   13.175   24.805   11.445 10.40837 17.45220 
1 1 1    3   32   26 o   32.549   6.8969   25.293   7.2112   25.903   7.4836   17.369   26.975   34.652   5.2363   30.446   12.761 4.205812 13.79377 
1 1 1    3   32   27 o   24.452   8.3484 -20.8666   22.565 -17.3634   26.218 -30.8765   44.318   22.237   10.560   26.667   12.934 -4.430054 16.69688 
1 1 1    3   32   28 o   26.135   8.2426   1.4746   18.737   15.856   25.702 -14.8352   27.372   29.174   12.354   23.096   10.915 6.078505 16.48513 
1 1 1    3   32   29 o   24.809   8.0481  -4.0155   19.117   7.6801   26.171 -17.3942   27.991   26.880   11.908   22.739   10.830 4.140535 16.09621 
1 1 1    3   32   30 o   28.334   8.7802   13.542   19.826   22.165   28.059   4.9443   28.018   30.375   12.888   26.292   11.928 4.083448 17.56039 
1 1 1    3   32   31 o   29.562   9.3590   12.142   24.788 -14.3342   35.855   36.382   34.308   25.118   12.043   34.005   14.330 -8.887003 18.71810 
1 1 1    3   32   32 o   35.017   9.6685   41.207   20.527   48.547   28.283   33.037   29.839   37.594   13.849   32.441   13.495 5.152344 19.33698 
1 1 1    3   32   33 o   27.885   8.2955  -7.6143   20.273   56.235   29.825 -62.4509   27.640   38.872   14.237   16.899   8.5193 21.97316 16.59094 
1 1 1    3   32   34 o   19.737   6.8832 -34.0393   20.163 -22.2627   28.299 -46.1807   28.734   20.909   10.185   18.566   9.2619 2.343307 13.76646 
1 1 1    3   33    0 o  162.756   4.2737  556.012   40.444  556.012   40.444  556.012   40.444  162.756   6.0439  162.756   6.0439 0.000000 0.000000 
1 1 1    3   33    1 o   32.184   6.6135   24.483   7.8757   26.428   8.3909   10.088   22.827   35.357   5.7539   29.011   11.910 6.346191 13.22696 
1 1 1    3   33    2 o  100.320   3.0080  214.804   11.231  199.971   20.614  221.066   13.394   97.495   5.1264  103.145   3.1484 -5.649742 6.016027 
1 1 1    3   33    3 o   38.776   5.2140   34.095   8.2240   12.875   11.338   57.657   11.947   25.297   8.8326   52.255   5.5432 -26.95815 10.42796 
1 1 1    3   33    4 o   39.118   5.0883   32.204   8.2094   0.0000   0.0000   32.204   8.2094  ?   ?    39.118   5.0883      ?      ? 
1 1 1    3   33    5 o   91.039   3.6596  177.479   13.251  162.678   21.279  186.854   16.935   87.604   5.8891   94.474   4.3462 -6.869354 7.319230 
1 1 1    3   33    6 o   43.213   5.2624   44.309   7.8521   33.769   14.825   48.419   9.2572   38.392   9.4307   48.033   4.6728 -9.640285 10.52484 
1 1 1    3   33    7 o   37.947   5.4409   42.458   8.3173   5.6849   15.786   56.588   9.7856   23.951   9.8767   51.944   4.5676 -27.99301 10.88178 
1 1 1    3   33    8 o   52.262   5.2510   63.335   9.5337   51.299   17.633   68.307   11.333   47.516   9.3306   57.009   4.8199 -9.492825 10.50196 
1 1 1    3   33    9 o   26.619   7.4655   10.256   12.404   15.093   16.571   4.0933   18.705   28.296   10.566   24.942   10.549 3.353842 14.93092 
1 1 1    3   33   10 o  107.629   4.0427  245.379   17.922  242.565   24.652  248.534   26.099  107.042   5.5839  108.216   5.8475 -1.173920 8.085344 
1 1 1    3   33   11 o   48.620   10.023   56.646   19.301   62.458   39.721   54.850   22.083   49.070   16.552   48.170   11.309 0.8999367 20.04623 
1 1 1    3   33   12 f   29.857   8.7770   11.563   16.890   18.173   19.054 -12.6839   36.495   30.464   11.339   29.250   13.400 1.213560 17.55392 
1 1 1    3   33   13 o   59.318   6.6071   76.956   16.043   69.040   21.169   87.636   24.588   55.853   9.1894   62.783   9.4957 -6.929314 13.21412 
1 1 1    3   33   14 o   30.270   8.3921   14.222   15.349   6.2304   20.164   25.231   23.668   26.226   11.015   34.313   12.664 -8.087059 16.78427 
1 1 1    3   33   15 f   45.804   8.3727   49.562   15.989   38.112   20.978   65.434   24.698   39.648   11.887   51.961   11.794 -12.31318 16.74537 
1 1 1    3   33   16 o   41.565   9.7349   43.283   19.375   44.927   25.326   40.963   30.087   42.417   13.131   40.713   14.375 1.703743 19.46975 
1 1 1    3   33   17 o   53.098   8.3027   68.015   17.659   62.021   23.877   75.252   26.238   50.496   11.695   55.699   11.789 -5.202621 16.60546 
1 1 1    3   33   18 f   63.198   7.5314   92.293   18.712   66.006   24.954  126.063   28.283   51.721   11.940   74.675   9.1832 -22.95366 15.06279 
1 1 1    3   33   19 o   35.280   10.756   15.685   29.108  -2.7367   40.761   34.855   41.582   31.362   14.289   39.197   16.081 -7.835007 21.51218 
1 1 1    3   33   20 o   35.631   8.7764   28.629   17.569   47.529   23.955   6.6258   25.847   43.086   12.650   28.175   12.169 14.91080 17.55274 
1 1 1    3   33   21 o   71.668   7.2272  124.357   19.804  161.051   27.838   86.754   28.180   84.733   7.9656   58.602   12.061 26.13131 14.45431 
1 1 1    3   33   22 o   33.619   8.3208   14.914   18.747   56.971   26.106 -29.8665   26.939   46.016   13.117   21.221   10.242 24.79486 16.64169 
1 1 1    3   33   23 o   27.665   8.4618   6.5806   18.259   17.538   24.883  -6.2001   26.875   30.308   12.438   25.022   11.476 5.285885 16.92353 
1 1 1    3   33   24 o   27.923   8.7472   4.3789   20.558 -10.7752   30.841   16.497   27.579   25.504   11.903   30.343   12.820 -4.839460 17.49433 
1 1 1    3   33   25 o   40.640   9.4311   46.303   19.184   28.560   26.195   66.827   28.172   33.269   13.064   48.011   13.605 -14.74238 18.86221 
1 1 1    3   33   26 o   24.157   8.3483 -42.4184   22.603   9.0090   41.866 -63.5738   26.852   31.131   14.295   17.182   8.6269 13.94924 16.69665 
1 1 1    3   33   27 o   24.428   7.9679  -7.5997   19.028 -22.2405   26.416   8.1883   27.432   21.418   10.287   27.437   12.171 -6.018463 15.93584 
1 1 1    3   33   28 o   23.842   7.8865  -9.3037   19.586   3.1459   27.608 -21.9177   27.790   25.935   11.794   21.750   10.473 4.185560 15.77292 
1 1 1    3   33   29 o   24.207   7.9475  -5.0309   19.296 -16.9431   27.245   6.9586   27.333   22.048   10.552   26.367   11.888 -4.318584 15.89509 
1 1 1    3   33   30 o   49.724   9.4942   78.193   20.280   89.655   28.149   65.823   29.243   55.143   12.646   44.305   14.164 10.83792 18.98841 
1 1 1    3   33   31 f   25.019   8.1695  -6.3237   20.103   27.984   30.936 -31.4001   26.449   30.674   13.280   19.364   9.5181 11.31018 16.33898 
1 1 1    3   33   32 o   35.251   9.1878   38.411   19.662   11.434   26.594   70.935   29.200   26.014   11.728   44.487   14.147 -18.47360 18.37569 
1 1 1    3   34    1 o  124.967   4.4199  345.048   21.714  444.575   30.037  236.089   31.428  145.277   5.0129  104.656   7.2809 40.62150 8.839750 
1 1 1    3   34    2 o   86.157   2.9613  152.460   9.5541  162.384   17.963  148.545   11.282   87.819   4.9593   84.494   3.2375 3.325127 5.922501 
1 1 1    3   34    3 o   66.672   3.2729   91.333   8.2820   98.546   15.254   88.318   9.8621   68.276   5.4169   65.067   3.6749 3.208870 6.545812 
1 1 1    3   34    4 o   73.190   3.7414  111.791   11.294   0.0000   0.0000  111.791   11.294  ?   ?    73.190   3.7414      ?      ? 
1 1 1    3   34    5 o   41.570   4.9938   37.203   7.9672   39.392   13.562   36.049   9.8454   41.918   8.1375   41.223   5.7907 0.6955948 9.987580 
1 1 1    3   34    6 o   89.511   4.0936  167.708   15.002  198.209   22.640  143.833   20.031   96.720   5.6753   82.302   5.9009 14.41734 8.187128 
1 1 1    3   34    7 o   69.778   4.7123  104.193   13.558  107.400   19.288  101.060   19.063   70.864   6.5991   68.692   6.7287 2.172150 9.424582 
1 1 1    3   34    8 o   28.627   6.0983   19.096   7.5037   11.828   15.207   21.435   8.6270   26.215   10.046   31.038   6.9160 -4.823048 12.19665 
1 1 1    3   34    9 o   29.902   7.6053   18.018   12.443   25.239   16.575   8.6942   18.834   33.287   10.666   26.516   10.844 6.770870 15.21068 
1 1 1    3   34   10 o  141.128   3.6582  422.282   21.240  444.500   29.595  398.683   30.501  145.118   4.9446  137.137   5.3926 7.980331 7.316394 
1 1 1    3   34   11 o   51.264   9.5814   54.655   18.596   99.589   37.816   40.324   21.357   61.822   14.987   40.706   11.942 21.11658 19.16288 
1 1 1    3   34   12 o   50.870   9.4633   56.170   17.598   47.100   19.961   87.814   37.285   44.307   10.979   57.434   15.417 -13.12768 18.92658 
1 1 1    3   34   13 f   86.239   4.9846  160.769   17.616  156.797   23.505  165.860   26.607   85.240   6.6858   87.238   7.3949 -1.997505 9.969186 
1 1 1    3   34   14 o   53.271   7.6804   67.749   16.454   74.201   22.157   59.817   24.568   57.332   9.3700   49.210   12.172 8.121593 15.36090 
1 1 1    3   34   15 o   29.406   8.1123   10.153   15.122  -5.4052   19.810   31.877   23.409   22.392   10.106   36.420   12.693 -14.02718 16.22458 
1 1 1    3   34   16 o   36.513   8.9429   30.652   17.495   47.262   24.753   14.074   24.729   42.992   12.918   30.035   12.371 12.95774 17.88580 
1 1 1    3   34   17 o   94.816   5.1839  198.443   20.133  206.878   27.358  188.477   29.736   97.426   6.8082   92.205   7.8192 5.221779 10.36784 
1 1 1    3   34   18 o   23.006   7.4591 -18.8650   16.723 -40.7599   22.304   9.2444   25.272   17.522   8.6374   28.489   12.163 -10.96762 14.91815 
1 1 1    3   34   19 f   69.845   9.4761  132.158   23.065  138.055   26.934  115.945   44.661   77.960   8.3767   61.731   17.001 16.22929 18.95230 
1 1 1    3   34   20 o   23.281   7.5235 -11.5545   17.115   6.6321   23.078 -33.7806   25.513   26.601   11.494   19.960   9.7110 6.641685 15.04695 
1 1 1    3   34   21 o   25.524   8.0252  -0.3633   17.507   11.066   23.629 -14.2729   26.067   27.931   11.838   23.117   10.839 4.814207 16.05030 
1 1 1    3   34   22 o   29.475   8.7260   15.709   17.594   14.552   22.938   17.363   27.421   28.513   11.844   30.437   12.818 -1.923527 17.45204 
1 1 1    3   34   23 o   81.549   6.8759  150.696   22.264  121.236   27.345  208.633   38.348   71.028   9.3345   92.071   10.098 -21.04260 13.75171 
1 1 1    3   34   24 o   24.278   7.8030  -4.3710   17.526   9.0857   24.588 -18.2699   24.989   27.038   11.773   21.517   10.244 5.521030 15.60592 
1 1 1    3   34   25 o   35.998   9.0389   33.909   18.745   58.005   26.637   10.271   26.383   44.337   13.418   27.659   12.115 16.67806 18.07789 
1 1 1    3   34   26 o   42.575   11.773   70.092   29.990   70.092   41.737   70.092   43.122   42.743   16.573   42.406   16.727 0.3374176 23.54677 
1 1 1    3   34   27 o   25.255   8.1199   2.5867   18.612   9.4963   26.293  -4.3523   26.349   26.688   11.874   23.821   11.079 2.867136 16.23984 
1 1 1    3   34   28 f   39.684   9.9012   52.821   20.249   56.213   28.358   49.294   28.922   41.078   13.985   38.290   14.020 2.788029 19.80233 
1 1 1    3   34   29 f   22.480   7.5063  -8.0202   18.285  -3.9206   25.438 -12.4028   26.301   23.044   10.774   21.916   10.455 1.127672 15.01261 
1 1 1    3   34   30 o   23.283   7.9635 -15.8289   23.436  -8.0443   32.701 -24.0493   33.604   24.131   11.551   22.435   10.965 1.696453 15.92703 
1 1 1    3   35    2 o   34.865   6.5232   26.868   9.0354   26.868   9.0354   0.0000   0.0000   34.865   6.5232  ?   ?       ?      ? 
1 1 1    3   35    3 o   44.497   4.1655   46.990   6.3512   33.534   11.501   52.894   7.6181   38.688   7.4783   50.305   3.6717 -11.61708 8.331038 
1 1 1    3   35    4 o   75.693   3.3388  118.929   9.5003  125.532   17.691  116.252   11.262   76.812   5.5842   74.575   3.6615 2.237091 6.677522 
1 1 1    3   35    5 o   22.507   5.2937   5.9371   5.5595   20.863   11.182   1.0360   6.4076   30.222   8.5742   14.792   6.2109 15.42923 10.58735 
1 1 1    3   35    6 o   55.021   4.1712   64.376   8.3582   65.321   16.188   64.032   9.7597   54.843   7.1567   55.199   4.2869 -0.3561211 8.342404 
1 1 1    3   35    7 o   77.871   3.6520  119.878   10.676  149.904   20.634  108.900   12.476   83.727   5.9753   72.014   4.2005 11.71239 7.304043 
1 1 1    3   35    8 o   52.709   4.8583   60.666   9.4538   58.699   17.662   61.456   11.192   51.534   8.3099   53.884   5.0359 -2.350639 9.716681 
1 1 1    3   35    9 f   62.037   5.8260   86.363   14.585  102.687   20.272   68.846   21.000   68.726   7.1518   55.349   9.1990 13.37649 11.65201 
1 1 1    3   35   10 o   43.817   5.6702   44.319   8.8987   40.040   16.644   46.032   10.530   41.155   9.9212   46.479   5.4931 -5.323738 11.34039 
1 1 1    3   35   11 o   57.785   8.8281   93.014   19.166   58.288   36.176  106.564   22.598   46.135   15.795   69.434   7.8909 -23.29911 17.65626 
1 1 1    3   35   12 o   47.933   7.3365   59.766   14.620   80.394   19.025   30.015   22.847   60.380   7.6394   35.485   12.527 24.89566 14.67293 
1 1 1    3   35   13 o   25.312   7.6785   4.0737   14.047   1.3757   17.989   8.2883   22.484   23.203   10.086   27.421   11.580 -4.218256 15.35692 
1 1 1    3   35   14 o   44.439   8.1098   50.595   15.413   62.085   20.553   35.831   23.298   51.058   10.118   37.820   12.677 13.23735 16.21954 
1 1 1    3   35   15 o   30.974   8.7982   18.060   16.078   16.731   19.166   21.216   29.540   28.952   11.229   32.997   13.548 -4.044855 17.59632 
1 1 1    3   35   16 o   39.372   9.2116   41.046   17.623   34.415   25.721   46.913   24.194   36.654   13.252   42.091   12.799 -5.437538 18.42329 
1 1 1    3   35   17 o   81.723   5.4978  148.530   18.422  132.641   24.541  169.040   27.883   76.799   7.7477   86.647   7.8023 -9.848541 10.99558 
1 1 1    3   35   18 o   36.669   9.2118   34.354   21.897 -24.6807   41.221   57.560   25.844   27.272   13.032   46.066   13.023 -18.79383 18.42354 
1 1 1    3   35   19 o   24.300   8.2382 -17.5224   19.856 -17.0688   22.676 -19.0134   41.112   20.894   9.8924   27.706   13.176 -6.812181 16.47643 
1 1 1    3   35   20 o   31.056   8.8097   20.444   17.476   10.076   23.652   32.911   25.936   27.177   11.689   34.935   13.184 -7.757219 17.61946 
1 1 1    3   35   21 o   67.968   7.1366  112.134   19.022   83.807   25.398  148.324   28.708   56.782   11.243   79.153   8.7936 -22.37106 14.27320 
1 1 1    3   35   22 o   20.985   7.0251 -19.6474   16.305 -34.8412   22.148  -1.6686   24.093   17.724   8.7119   24.247   11.023 -6.522045 14.05017 
1 1 1    3   35   23 o   23.340   7.8968 -26.2288   21.489 -48.5244   28.799   1.7824   32.279   19.291   9.5651   27.389   12.568 -8.097782 15.79361 
1 1 1    3   35   24 o   80.020   6.3500  155.382   20.910  142.504   28.715  169.919   30.509   76.305   9.1241   83.735   8.8340 -7.430389 12.69993 
1 1 1    3   35   25 o   36.783   9.6390   43.203   19.430   43.529   27.497   42.878   27.458   36.897   13.644   36.670   13.619 0.2269859 19.27796 
1 1 1    3   35   26 o   38.776   10.247   53.842   22.627   57.704   26.544   43.577   43.277   42.491   13.486   35.061   15.432 7.430286 20.49438 
1 1 1    3   35   27 o   34.912   9.3988   40.386   18.724   38.018   25.803   43.020   27.214   34.162   13.088   35.662   13.493 -1.499939 18.79770 
1 1 1    3   35   28 o   20.388   6.9873 -20.0444   18.197 -17.5373   24.814 -22.9615   26.766   20.387   9.8367   20.390   9.9262 -0.2754211E-02 13.97458 
1 1 1    3   35   29 f   18.983   9.3557 -31.9287   26.122 -31.9287   26.122   0.0000   0.0000   18.983   9.3557  ?   ?       ?      ? 
1 1 1    3   36    2 o   42.545   6.3170   55.714   7.2169   59.863   7.6268   20.203   22.313   53.516   3.4554   31.575   12.152 21.94085 12.63410 
1 1 1    3   36    3 o   33.675   4.3145   26.106   5.1608   21.876   9.6497   27.801   6.1077   30.977   7.6080   36.372   4.0714 -5.394855 8.628922 
1 1 1    3   36    4 o   23.903   5.8418   11.774   6.9666   10.258   9.2611   13.749   10.573   22.546   7.9740   25.259   8.5395 -2.712191 11.68370 
1 1 1    3   36    5 o   40.390   4.7107   35.840   6.7975   36.015   12.896   35.772   7.9989   39.665   8.1554   41.115   4.7170 -1.449772 9.421304 
1 1 1    3   36    6 f   22.226   5.7658   9.0934   6.1631   9.7313   12.807   8.9012   7.0307   23.781   9.1917   20.670   6.9637 3.110783 11.53168 
1 1 1    3   36    7 o   82.027   3.7097  143.248   11.205  143.430   21.270  143.178   13.182   81.466   6.3302   82.587   3.8700 -1.120750 7.419486 
1 1 1    3   36    8 o   34.269   6.1499   27.763   8.1151   25.180   15.602   28.722   9.5016   32.665   10.336   35.872   6.6674 -3.207085 12.29979 
1 1 1    3   36    9 o   57.688   4.5420   69.657   9.5328   77.624   18.880   66.931   11.044   59.194   7.7334   56.183   4.7659 3.010536 9.084014 
1 1 1    3   36   10 o   21.983   6.2222   3.2366   7.1881   16.958   16.080  -0.1901   8.0356   28.320   10.441   15.646   6.7711 12.67465 12.44442 
1 1 1    3   36   11 o   60.073   7.9719  100.096   12.446   71.311   34.351  104.446   13.354   50.000   15.261   70.145   4.6157 -20.14495 15.94388 
1 1 1    3   36   12 o   87.225   4.6091  166.386   16.513  165.122   22.343  167.909   24.512   87.084   6.2208   87.365   6.8027 -0.2808609 9.218139 
1 1 1    3   36   13 o   40.063   8.3758   41.129   14.648   39.380   19.098   43.628   22.830   39.405   11.214   40.721   12.444 -1.315765 16.75154 
1 1 1    3   36   14 o   58.298   7.0220   77.977   15.797   45.043   20.452  126.684   24.872   41.864   11.494   74.732   8.0693 -32.86826 14.04405 
1 1 1    3   36   15 o   32.652   8.5717   25.753   16.438   35.473   20.256   7.0063   28.132   36.999   11.784   28.304   12.451 8.694462 17.14343 
1 1 1    3   36   16 o   24.744   7.7631  -1.4140   16.437 -16.2531   23.563   12.652   22.941   21.468   10.140   28.019   11.758 -6.550726 15.52619 
1 1 1    3   36   17 o   87.253   5.3464  175.711   18.812  208.527   26.157  140.553   27.075   96.847   6.5486   77.659   8.4529 19.18785 10.69278 
1 1 1    3   36   18 o   28.830   9.0866   9.6861   20.066   12.891   38.178   8.4629   23.586   31.098   14.033   26.561   11.548 4.536783 18.17318 
1 1 1    3   36   19 o   23.485   7.5676  -3.1632   16.230   0.6146   22.551  -7.2230   23.377   24.178   10.859   22.793   10.543 1.385080 15.13524 
1 1 1    3   36   20 o   32.849   8.6927   27.377   16.780   40.492   23.232   13.071   24.264   37.790   12.659   27.907   11.917 9.882658 17.38538 
1 1 1    3   36   21 o   34.292   8.7795   29.679   17.522   8.8694   24.112   52.963   25.505   26.438   11.581   42.146   13.199 -15.70814 17.55895 
1 1 1    3   36   22 o   34.397   9.2550   35.235   18.120   34.801   24.355   35.773   27.120   34.339   12.812   34.455   13.359 -0.1156960 18.51002 
1 1 1    3   36   23 o   28.813   8.3280   8.9282   19.974 -46.5130   32.384   42.971   25.376   20.521   10.169   37.106   13.191 -16.58503 16.65598 
1 1 1    3   36   24 o   30.661   8.9362   25.213   18.434   18.100   25.829   32.598   26.318   28.477   12.231   32.845   13.032 -4.367790 17.87244 
1 1 1    3   36   25 o   32.377   9.2774   32.881   22.298  -7.0034   40.609   50.095   26.679   26.370   12.688   38.383   13.539 -12.01261 18.55483 
1 1 1    3   36   26 f   22.619   7.5345  -5.3738   18.175  -5.2550   25.397  -5.4985   26.020   22.540   10.610   22.698   10.701 -0.1579094 15.06897 
1 1 1    3   36   27 o   29.524   8.5773   18.635   18.820  -9.6206   25.963   49.925   27.321   21.883   10.425   37.165   13.624 -15.28104 17.15466 
1 1 1    3   37    3 o   37.664   4.0865   29.928   6.3481   29.928   6.3481   0.0000   0.0000   37.664   4.0865  ?   ?       ?      ? 
1 1 1    3   37    4 o   24.993   5.0496   13.249   5.0842   16.884   9.4774   11.781   6.0244   27.087   7.9580   22.900   6.2182 4.186790 10.09925 
1 1 1    3   37    5 o   39.837   4.7199   33.768   7.7551   0.0000   0.0000   33.768   7.7551  ?   ?    39.837   4.7199      ?      ? 
1 1 1    3   37    6 o   59.443   4.2806   77.928   9.9959   72.354   16.506   81.156   12.561   57.236   6.9923   61.650   4.9400 -4.413635 8.561295 
1 1 1    3   37    7 o   43.217   5.2566   42.719   7.8831   41.066   15.465   43.300   9.1629   41.415   9.2831   45.019   4.9348 -3.604156 10.51326 
1 1 1    3   37    8 o   26.052   5.4898   17.134   7.2689  -1.8074   14.462   23.537   8.4081   19.841   8.8175   32.264   6.5424 -12.42349 10.97955 
1 1 1    3   37    9 o   40.557   6.0074   42.028   8.6021   30.407   17.206   45.901   9.9326   34.885   10.827   46.228   5.2094 -11.34301 12.01479 
1 1 1    3   37   10 o   30.070   6.5122   21.546   8.1160   18.969   17.174   22.288   9.2092   29.095   10.778   31.046   7.3126 -1.951170 13.02442 
1 1 1    3   37   11 o   58.074   4.9537   72.282   11.865   0.0000   0.0000   72.282   11.865  ?   ?    58.074   4.9537      ?      ? 
1 1 1    3   37   12 o   27.288   6.1867   18.786   8.2663   2.8982   17.637   23.258   9.3578   22.934   9.9783   31.642   7.3166 -8.707329 12.37333 
1 1 1    3   37   13 o   24.472   7.5722   4.1726   14.512   6.3443   19.254   1.3163   22.082   24.593   10.561   24.351   10.854 0.2419109 15.14435 
1 1 1    3   37   14 o   32.282   8.3935   26.873   15.045   32.409   19.392   18.503   23.844   34.922   11.562   29.643   12.171 5.278898 16.78706 
1 1 1    3   37   15 o   57.351   8.0154   80.882   17.495   69.654   21.341  103.891   30.549   52.637   10.198   62.064   12.369 -9.426834 16.03073 
1 1 1    3   37   16 o   27.098   7.9548   13.266   14.558   14.664   19.134   11.345   22.433   27.183   11.000   27.013   11.495 0.1695404 15.90965 
1 1 1    3   37   17 o   34.775   8.5272   32.719   15.432   42.179   21.500   22.667   22.162   38.968   12.104   30.582   12.014 8.386105 17.05442 
1 1 1    3   37   18 o   40.960   10.307   49.739   20.770   71.385   36.731   39.565   25.183   45.239   15.892   36.681   13.130 8.557804 20.61469 
1 1 1    3   37   19 o   32.322   8.6375   26.716   16.307   13.670   21.910   42.918   24.416   26.941   11.407   37.702   12.973 -10.76155 17.27509 
1 1 1    3   37   20 o   40.079   9.1436   49.039   17.183   46.435   23.588   51.983   25.081   39.137   12.741   41.022   13.118 -1.884567 18.28717 
1 1 1    3   37   21 o   25.545   7.9580   3.9240   17.200 -14.5176   24.046   23.246   24.613   21.088   10.042   30.002   12.348 -8.914183 15.91599 
1 1 1    3   37   22 o   25.470   8.1650   5.5966   18.810   13.847   23.291  -9.8752   31.895   26.678   11.537   24.263   11.557 2.415848 16.33004 
1 1 1    3   37   23 o   18.651   6.4917 -32.2703   17.546 -25.8756   25.240 -38.2512   24.409   19.546   9.5426   17.755   8.8040 1.790966 12.98348 
1 1 1    3   37   24 o   34.795   8.8216   35.318   19.247   69.755   27.409   1.8156   27.034   45.349   13.586   24.240   11.257 21.10920 17.64326 
1 1 1    3   37   25 o   36.783   11.281   63.965   31.751   45.030   42.739   87.285   47.431   33.140   14.910   40.426   16.932 -7.286663 22.56134 
1 1 1    3   38    3 o   17.384   5.2099   6.6022   4.0302   6.6022   4.0302   0.0000   0.0000   17.384   5.2099  ?   ?       ?      ? 
1 1 1    3   38    4 o   22.645   4.6455   12.152   4.4807   8.0649   8.6292   13.661   5.2429   20.540   7.6337   24.750   5.2961 -4.209745 9.290956 
1 1 1    3   38    5 o   51.569   4.3326   58.755   9.1200   51.490   13.211   65.370   12.606   48.232   6.6409   54.906   5.5665 -6.673859 8.665290 
1 1 1    3   38    6 o   42.307   4.9931   39.913   8.2315   42.916   13.579   38.169   10.350   42.858   7.9756   41.756   6.0096 1.102222 9.986276 
1 1 1    3   38    7 o   28.549   5.7833   20.667   7.0215   12.534   14.170   23.313   8.0837   25.058   9.6731   32.039   6.3417 -6.981647 11.56660 
1 1 1    3   38    8 o   17.537   5.4834  -4.3552   6.4108   9.0280   14.158  -7.8072   7.1902   23.391   9.4628   11.684   5.5430 11.70693 10.96680 
1 1 1    3   38    9 o   32.695   5.9037   29.480   8.1427   11.878   17.065   34.669   9.2655   25.565   10.373   39.824   5.6410 -14.25929 11.80748 
1 1 1    3   38   10 o   39.532   6.2357   35.649   8.5709   41.536   18.535   34.047   9.6664   39.747   10.955   39.318   5.9609 0.4285545 12.47148 
1 1 1    3   38   11 o   21.837   7.6132   10.351   8.4219   0.0000   0.0000   10.351   8.4219  ?   ?    21.837   7.6132      ?      ? 
1 1 1    3   38   12 o   34.560   6.7937   22.681   8.5633   47.702   19.374   16.606   9.5464   42.660   10.955   26.461   8.0383 16.19973 13.58734 
1 1 1    3   38   13 o   27.579   6.7503   16.833   8.1787   20.817   17.758   15.760   9.2141   29.342   10.942   25.816   7.9083 3.525846 13.50051 
1 1 1    3   38   14 o   28.622   8.0700   18.444   14.180   18.158   18.395   18.864   22.261   28.147   10.978   29.097   11.832 -0.9498367 16.14001 
1 1 1    3   38   15 o   31.992   8.9354   23.305   15.988   15.738   18.873   42.534   30.088   27.098   10.939   36.886   14.132 -9.787533 17.87089 
1 1 1    3   38   16 o   24.698   7.4572  -3.1451   14.706 -25.3860   19.093   29.294   23.059   17.064   8.3238   32.333   12.376 -15.26915 14.91441 
1 1 1    3   38   17 o   22.782   7.3283  -0.9578   15.279   5.6892   19.838 -10.6505   23.956   23.790   10.461   21.774   10.266 2.016235 14.65660 
1 1 1    3   38   18 o   34.944   10.665   41.192   27.992   37.909   38.401   44.913   40.888   34.237   14.810   35.651   15.352 -1.414017 21.33058 
1 1 1    3   38   19 o   31.382   8.7446   28.422   16.597   29.000   21.800   27.624   25.598   31.657   12.053   31.107   12.673 0.5499172 17.48921 
1 1 1    3   38   20 o   22.071   7.2949  -5.0658   16.430  -4.5465   22.228  -5.6913   24.395   21.783   10.146   22.359   10.484 -0.5762558 14.58978 
1 1 1    3   38   21 o   34.609   8.9459   37.888   17.094   25.027   23.049   53.608   25.483   29.451   12.015   39.767   13.257 -10.31583 17.89181 
1 1 1    3   38   22 o   38.384   10.077   54.391   22.408   32.448   30.466   80.253   33.074   31.252   13.349   45.516   15.100 -14.26424 20.15487 
1 1 1    3   39    7 o   35.978   7.5400   37.848   13.287   46.601   15.353   11.721   26.525   43.801   8.8038   28.155   12.243 15.64576 15.07994 
1 1 1    3   39    8 o   25.076   7.4539   10.177   12.642   15.079   14.251  -7.9313   27.392   26.015   9.7820   24.137   11.250 1.878229 14.90773 
1 1 1    3   39    9 o   31.999   7.6530   26.767   12.009   26.766   17.079   26.768   16.889   31.991   10.853   32.007   10.793 -0.1624489E-01 15.30602 
1 1 1    3   39   10 o   24.336   7.1438   9.1506   12.034   15.387   16.843   2.6488   17.198   26.555   10.461   22.118   9.7322 4.436798 14.28767 
1 1 1    3   39   11 o   14.342   6.4602  -2.4803   8.0492   0.0000   0.0000  -2.4803   8.0492  ?   ?    14.342   6.4602      ?      ? 
1 1 1    3   39   12 o   27.085   6.7199   18.659   9.1207   9.0251   19.638   21.308   10.299   24.785   10.655   29.385   8.1908 -4.600508 13.43977 
1 1 1    3   39   13 o   22.471   6.5131   9.0920   8.5682   2.6751   19.787   10.573   9.5055   22.951   10.249   21.990   8.0397 0.9612789 13.02610 
1 1 1    3   39   14 o   34.595   6.6511   23.902   8.8542   50.978   18.410   15.755   10.099   43.741   10.363   25.448   8.3394 18.29313 13.30212 
1 1 1    3   39   15 o   21.721   7.1635  -5.7166   15.429   1.6887   18.238 -24.3577   28.935   21.918   9.8098   21.524   10.442 0.3939648 14.32710 
1 1 1    3   39   16 o   24.951   7.7012   9.5309   14.688   8.1952   18.885   11.576   23.367   23.867   10.355   26.034   11.402 -2.167004 15.40236 
1 1 1    3   39   17 o   32.370   8.5703   32.266   15.565   34.977   20.176   28.280   24.464   33.951   11.787   30.789   12.445 3.161753 17.14060 
1 1 1    3   39   18 o   24.996   8.2914   2.5360   17.775  -0.1466   19.928   12.979   39.319   21.668   9.9177   28.323   13.290 -6.654480 16.58279 
1 1 1    3   39   19 o   20.937   6.9684  -6.9767   15.532  -2.0608   20.379 -13.7903   23.992   21.317   9.8549   20.557   9.8546 0.7599354 13.93671 
1 1 1    4    0    0 o  253.162   3.1810  1323.29   46.940  1323.29   46.940  1323.29   46.940  253.162   4.4987  253.162   4.4987 0.000000 0.000000 
1 1 1    4    0    1 o  151.121   1.8211  471.452   16.042  471.452   16.042  471.452   16.042  151.121   2.5755  151.121   2.5755 0.000000 0.000000 
1 1 1    4    0    2 o  166.777   1.8805  574.124   18.282  574.124   18.282  574.124   18.282  166.777   2.6594  166.777   2.6594 0.000000 0.000000 
1 1 1    4    0    3 o   45.298   2.0892   42.859   5.4660   42.859   5.4660   42.859   5.4660   45.298   2.9545   45.298   2.9545 0.000000 0.000000 
1 1 1    4    0    4 o  358.303   2.8049  2649.02   58.604  2649.02   58.604  2649.02   58.604  358.303   3.9667  358.303   3.9667 0.000000 0.000000 
1 1 1    4    0    5 o  177.752   1.9897  652.123   20.618  652.123   20.618  652.123   20.618  177.752   2.8139  177.752   2.8139 0.000000 0.000000 
1 1 1    4    0    7 o   93.427   1.9902  180.518   10.823  180.518   10.823  180.518   10.823   93.427   2.8145   93.427   2.8145 0.000000 0.000000 
1 1 1    4    0    8 o  113.853   1.9902  267.853   13.198  267.853   13.198  267.853   13.198  113.853   2.8146  113.853   2.8146 0.000000 0.000000 
1 1 1    4    0    9 o  141.514   2.0182  413.582   16.643  413.582   16.643  413.582   16.643  141.514   2.8541  141.514   2.8541 0.000000 0.000000 
1 1 1    4    0   10 o   39.303   3.9336   33.743   8.4967   33.743   8.4967   33.743   8.4967   39.303   5.5630   39.303   5.5630 0.000000 0.000000 
1 1 1    4    0   11 o   11.931   5.7000  -5.6033   11.605  -5.6033   11.605  -5.6033   11.605   11.931   8.0611   11.931   8.0611 0.000000 0.000000 
1 1 1    4    0   12 o  274.377   2.4920  1553.76   39.867  1553.76   39.867  1553.76   39.867  274.377   3.5242  274.377   3.5242 0.000000 0.000000 
1 1 1    4    0   13 f  124.081   2.3101  318.233   16.693  318.233   16.693  318.233   16.693  124.081   3.2669  124.081   3.2669 0.000000 0.000000 
1 1 1    4    0   14 o  632.561   4.4862  8259.31  165.487  8259.31  165.487  8259.31  165.487  632.561   6.3445  632.561   6.3445 0.000000 0.000000 
1 1 1    4    0   15 o  438.881   3.3664  3974.70   86.154  3974.70   86.154  3974.70   86.154  438.881   4.7608  438.881   4.7608 0.000000 0.000000 
1 1 1    4    0   16 o  482.822   3.6314  4810.87  102.241  4810.87  102.241  4810.87  102.241  482.822   5.1355  482.822   5.1355 0.000000 0.000000 
1 1 1    4    0   17 o  288.308   3.7788  1716.57   63.497  1716.57   63.497  1716.57   63.497  288.308   5.3440  288.308   5.3440 0.000000 0.000000 
1 1 1    4    0   18 o  130.937   2.7521  354.578   20.977  354.578   20.977  354.578   20.977  130.937   3.8920  130.937   3.8920 0.000000 0.000000 
1 1 1    4    0   19 o  487.164   3.6692  4898.02  104.236  4898.02  104.236  4898.02  104.236  487.164   5.1890  487.164   5.1890 0.000000 0.000000 
1 1 1    4    0   20 o  149.554   2.7188  462.287   23.682  462.287   23.682  462.287   23.682  149.554   3.8450  149.554   3.8450 0.000000 0.000000 
1 1 1    4    0   21 o  301.011   4.0264  1871.93   70.637  1871.93   70.637  1871.93   70.637  301.011   5.6942  301.011   5.6942 0.000000 0.000000 
1 1 1    4    0   22 o  142.344   2.8914  419.062   23.961  419.062   23.961  419.062   23.961  142.344   4.0890  142.344   4.0890 0.000000 0.000000 
1 1 1    4    0   23 o  555.825   4.0902  6379.69  132.574  6379.69  132.574  6379.69  132.574  555.825   5.7844  555.825   5.7844 0.000000 0.000000 
1 1 1    4    0   24 o  294.045   2.8923  1785.13   49.585  1785.13   49.585  1785.13   49.585  294.045   4.0904  294.045   4.0904 0.000000 0.000000 
1 1 1    4    0   25 o  235.262   2.7938  1143.10   38.314  1143.10   38.314  1143.10   38.314  235.262   3.9510  235.262   3.9510 0.000000 0.000000 
1 1 1    4    0   26 o   46.245   8.7386   52.790   20.368   52.790   20.368   52.790   20.368   46.245   12.358   46.245   12.358 0.000000 0.000000 
1 1 1    4    0   27 o  259.499   3.8662  1392.81   58.461  1392.81   58.461  1392.81   58.461  259.499   5.4676  259.499   5.4676 0.000000 0.000000 
1 1 1    4    0   28 o   15.436   7.4102 -10.7435   20.092 -10.7435   20.092 -10.7435   20.092   15.436   10.480   15.436   10.480 0.000000 0.000000 
1 1 1    4    0   29 o   16.230   7.6693  -6.8516   19.976  -6.8516   19.976  -6.8516   19.976   16.230   10.846   16.230   10.846 0.000000 0.000000 
1 1 1    4    0   30 o  114.807   5.9641  277.571   39.443  277.571   39.443  277.571   39.443  114.807   8.4345  114.807   8.4345 0.000000 0.000000 
1 1 1    4    0   31 o   12.930   6.4967 -28.4627   20.956 -28.4627   20.956 -28.4627   20.956   12.930   9.1877   12.930   9.1877 0.000000 0.000000 
1 1 1    4    0   32 o   92.910   4.4788  181.058   24.013  181.058   24.013  181.058   24.013   92.910   6.3340   92.910   6.3340 0.000000 0.000000 
1 1 1    4    0   33 o   28.692   10.579   25.223   23.126   25.223   23.126   25.223   23.126   28.692   14.961   28.692   14.961 0.000000 0.000000 
1 1 1    4    0   34 o   90.814   4.9064  173.805   25.640  173.805   25.640  173.805   25.640   90.814   6.9387   90.814   6.9387 0.000000 0.000000 
1 1 1    4    0   35 o   20.044   9.2583  -2.4306   26.579  -2.4306   26.579  -2.4306   26.579   20.044   13.093   20.044   13.093 0.000000 0.000000 
1 1 1    4    0   36 o   40.091   11.486   47.324   26.290   47.324   26.290   47.324   26.290   40.091   16.244   40.091   16.244 0.000000 0.000000 
1 1 1    4    0   37 f   33.200   12.801   34.309   35.182   34.309   35.182   34.309   35.182   33.200   18.103   33.200   18.103 0.000000 0.000000 
1 1 1    4    0   38 o   57.230   19.011  112.436   71.285  112.436   71.285  112.436   71.285   57.230   26.886   57.230   26.886 0.000000 0.000000 
1 1 1    4    0   39 o   14.572   7.3020 -31.6298   25.859 -31.6298   25.859 -31.6298   25.859   14.572   10.327   14.572   10.327 0.000000 0.000000 
1 1 1    4    0   40 o   21.456   9.6405   5.1194   26.328   5.1194   26.328   5.1194   26.328   21.456   13.634   21.456   13.634 0.000000 0.000000 
1 1 1    4    0   41 o   18.177   8.4961  -3.0561   23.422  -3.0561   23.422  -3.0561   23.422   18.177   12.015   18.177   12.015 0.000000 0.000000 
1 1 1    4    0   42 o   79.979   5.7568  139.519   26.218  139.519   26.218  139.519   26.218   79.979   8.1413   79.979   8.1413 0.000000 0.000000 
1 1 1    4    0   43 o   52.070   10.799   73.024   28.493   73.024   28.493   73.024   28.493   52.070   15.272   52.070   15.272 0.000000 0.000000 
1 1 1    4    0   44 o   17.558   8.3340  -6.1812   24.058  -6.1812   24.058  -6.1812   24.058   17.558   11.786   17.558   11.786 0.000000 0.000000 
1 1 1    4    0   45 o   32.605   13.402   39.017   41.906   39.017   41.906   39.017   41.906   32.605   18.953   32.605   18.953 0.000000 0.000000 
1 1 1    4    0   46 o   32.334   11.046   36.751   24.239   36.751   24.239   36.751   24.239   32.334   15.622   32.334   15.622 0.000000 0.000000 
1 1 1    4    0   47 o   23.567   9.8978   17.740   23.715   17.740   23.715   17.740   23.715   23.567   13.998   23.567   13.998 0.000000 0.000000 
1 1 1    4    0   48 o   21.594   9.3005   13.973   22.022   13.973   22.022   13.973   22.022   21.594   13.153   21.594   13.153 0.000000 0.000000 
1 1 1    4    0   49 o   27.593   11.013   29.770   27.125   29.770   27.125   29.770   27.125   27.593   15.575   27.593   15.575 0.000000 0.000000 
1 1 1    4    0   50 o   22.128   9.9594   13.992   28.247   13.992   28.247   13.992   28.247   22.128   14.085   22.128   14.085 0.000000 0.000000 
1 1 1    4    1    0 o  197.984   1.9973  808.994   23.055  808.994   23.055  808.994   23.055  197.984   2.8247  197.984   2.8247 0.000000 0.000000 
1 1 1    4    1    1 o  295.409   2.4593  1800.66   29.964  1796.31   42.264  1805.06   42.488  295.051   3.4730  295.768   3.4830 -0.7174683 4.918653 
1 1 1    4    1    2 o  153.210   1.8305  484.211   11.567  484.296   16.359  484.126   16.358  153.224   2.5886  153.197   2.5889 0.2690125E-01 3.661064 
1 1 1    4    1    3 o  358.023   2.8004  2644.76   41.351  2650.06   58.630  2639.52   58.330  358.379   3.9665  357.667   3.9541 0.7127075 5.600737 
1 1 1    4    1    4 o  482.348   3.5165  4800.59   69.954  4823.89   99.630  4777.94   98.244  483.500   4.9960  481.195   4.9501 2.305176 7.033082 
1 1 1    4    1    5 o   77.326   2.4274  112.882   7.3174  186.098   12.367   73.439   9.0769   94.985   3.1567   59.667   3.6884 35.31842 4.854843 
1 1 1    4    1    7 o  310.216   2.8048  1984.35   35.478  1994.05   54.500  1977.22   46.737  310.860   4.2507  309.571   3.6605 1.289398 5.609597 
1 1 1    4    1    8 o  275.055   2.4289  1560.76   27.551  1576.24   39.373  1545.91   38.564  276.390   3.4539  273.720   3.4160 2.670868 4.857843 
1 1 1    4    1    9 o  167.476   2.0525  578.575   14.176  587.690   20.223  569.768   19.878  168.773   2.9052  166.179   2.9003 2.593323 4.105082 
1 1 1    4    1   10 f  457.859   3.6747  4338.48   69.152  4443.77   94.618  4217.76  101.318  463.868   4.9455  451.850   5.4366 12.01810 7.349458 
1 1 1    4    1   11 o  232.633   2.9834  1116.77   28.069  1119.15   44.297  1115.17   36.284  232.817   4.6131  232.448   3.7846 0.3686218 5.966878 
1 1 1    4    1   12 o  161.913   2.1771  540.741   14.535  547.406   20.828  534.413   20.295  162.885   3.1003  160.941   3.0574 1.943649 4.354249 
1 1 1    4    1   13 o  524.985   3.8309  5690.46   82.944  5716.12  118.035  5665.42  116.581  526.152   5.4392  523.818   5.3961 2.333130 7.661772 
1 1 1    4    1   14 o  413.406   3.2136  3526.22   54.788  3552.90   78.194  3500.50   76.790  414.940   4.5690  411.872   4.5204 3.068604 6.427290 
1 1 1    4    1   15 o  581.904   4.1875  6987.81  100.480  7046.01  143.865  6932.38  140.398  584.266   5.9700  579.544   5.8737 4.722046 8.375051 
1 1 1    4    1   16 o  148.520   2.5609  455.060   15.687  458.915   22.219  451.228   22.151  149.148   3.6119  147.893   3.6315 1.254745 5.121878 
1 1 1    4    1   17 o  197.579   2.8571  803.435   23.245  772.494   31.792  838.977   34.073  193.503   3.9835  201.655   4.0967 -8.152390 5.714102 
1 1 1    4    1   18 o  321.926   3.2669  2138.20   43.370  2115.44   60.692  2161.94   61.998  320.177   4.5959  323.674   4.6441 -3.496979 6.533813 
1 1 1    4    1   19 o  180.320   2.5819  670.458   19.191  660.784   26.609  680.945   27.704  178.966   3.6049  181.674   3.6973 -2.707703 5.163797 
1 1 1    4    1   20 o   42.384   6.5024   39.009   11.884   14.853   16.839   62.980   16.774   29.562   10.717   55.206   7.3669 -25.64383 13.00474 
1 1 1    4    1   21 o  197.383   3.3809  803.035   26.783  809.744   43.264  798.866   34.103  198.026   5.2971  196.739   4.2027 1.287216 6.761796 
1 1 1    4    1   22 o  136.181   2.9629  382.420   16.633  366.227   23.136  399.739   23.928  133.200   4.2114  139.162   4.1688 -5.962097 5.925774 
1 1 1    4    1   23 o  457.878   3.5533  4330.21   67.104  4323.52   94.698  4336.95   95.101  457.524   5.0184  458.232   5.0319 -0.7077637 7.106633 
1 1 1    4    1   24 o  203.475   2.7877  854.618   23.394  843.637   32.860  865.904   33.312  202.150   3.9412  204.800   3.9437 -2.650192 5.575476 
1 1 1    4    1   25 o  184.630   2.8549  703.511   21.733  727.382   31.138  680.837   30.347  187.683   4.0226  181.577   4.0522 6.105927 5.709719 
1 1 1    4    1   26 o  109.682   4.2874  247.257   19.322  271.154   28.875  227.881   26.001  114.442   6.1175  104.921   6.0085 9.521179 8.574731 
1 1 1    4    1   27 o  162.795   3.7237  548.098   24.823  547.440   33.173  548.937   37.421  162.713   4.9431  162.877   5.5704 -0.1638947 7.447350 
1 1 1    4    1   28 o  155.865   3.2318  498.451   20.668  467.298   27.569  538.423   31.229  150.357   4.4456  161.374   4.6920 -11.01620 6.463613 
1 1 1    4    1   29 o   78.785   4.8340  129.415   15.612  144.646   21.960  113.850   22.199   83.527   6.3743   74.044   7.2689 9.482529 9.667943 
1 1 1    4    1   30 o  188.960   3.8311  731.942   29.562  689.355   38.722  791.443   45.770  182.479   5.1449  195.442   5.6780 -12.96326 7.662230 
1 1 1    4    1   31 o  122.629   3.6561  311.635   18.472  327.260   26.084  295.914   26.164  125.729   5.0301  119.529   5.3072 6.199265 7.312164 
1 1 1    4    1   32 f  173.734   3.1396  624.027   22.489  603.821   31.349  645.453   32.281  170.838   4.4491  176.631   4.4311 -5.793472 6.279239 
1 1 1    4    1   33 o  171.568   3.5975  600.633   24.836  570.278   31.470  650.763   40.442  165.980   4.5970  177.156   5.5349 -11.17613 7.194988 
1 1 1    4    1   34 o   29.236   8.6344   3.5137   17.636   11.055   23.956  -5.4103   26.059   31.086   12.402   27.386   12.017 3.699581 17.26871 
1 1 1    4    1   35 o   85.715   7.2282  156.095   24.008  152.694   41.512  157.805   29.429   84.645   11.891   86.786   8.2218 -2.140686 14.45634 
1 1 1    4    1   36 o   57.743   8.4121   74.427   19.846   43.561   27.833  106.352   28.306   44.613   13.758   70.872   9.6838 -26.25861 16.82417 
1 1 1    4    1   37 o   36.959   9.1463   25.928   17.787   37.886   25.103   13.872   25.206   41.673   13.101   32.245   12.766 9.428356 18.29270 
1 1 1    4    1   38 o   50.378   8.9931   57.887   22.581   8.1676   33.996   97.145   30.208   33.872   14.268   66.883   10.951 -33.01137 17.98614 
1 1 1    4    1   39 o   37.955   9.2727   30.742   17.664   27.699   24.483   34.045   25.509   36.554   12.961   39.356   13.264 -2.802090 18.54550 
1 1 1    4    1   40 f   99.330   5.5235  212.152   21.734  205.827   35.771  215.853   27.364   97.639   8.8827  101.021   6.5676 -3.381500 11.04694 
1 1 1    4    1   41 o   79.995   6.5082  135.589   21.031  169.730   34.212  114.850   26.664   87.636   9.4651   72.353   8.9352 15.28326 13.01643 
1 1 1    4    1   42 o   24.658   8.0799 -15.6024   18.906 -17.6596   24.044 -12.2695   30.603   22.494   10.502   26.822   12.282 -4.328735 16.15982 
1 1 1    4    1   43 o   73.545   7.2254  120.971   20.854  161.309   31.523   89.577   27.809   85.379   8.9518   61.711   11.344 23.66850 14.45073 
1 1 1    4    1   44 o   27.669   8.1195   0.3895   16.999 -23.9994   23.829   25.661   24.256   21.019   10.006   34.320   12.790 -13.30043 16.23895 
1 1 1    4    1   45 o   23.200   7.8240 -27.0785   20.822 -37.2449   31.846 -19.4874   27.519   22.924   11.081   23.476   11.049 -0.5520878 15.64798 
1 1 1    4    1   46 o   27.478   8.1159   1.7893   17.146 -23.2202   23.991   27.898   24.513   20.802   9.9405   34.154   12.832 -13.35254 16.23186 
1 1 1    4    1   47 o   51.487   7.7404   69.204   16.801   35.960   24.074  100.767   23.457   36.862   12.871   66.112   8.6026 -29.25064 15.48085 
1 1 1    4    1   48 o   23.346   7.5236  -3.3404   16.028  -7.1391   22.525   0.5553   22.811   22.427   10.365   24.266   10.908 -1.839186 15.04726 
1 1 1    4    1   49 o   28.657   8.7992   13.702   19.321   14.144   27.129   13.247   27.523   28.727   12.437   28.587   12.451 0.1399193 17.59838 
1 1 1    4    1   50 o   24.018   7.9877  -7.6977   20.290 -10.1793   28.552  -5.1657   28.840   23.558   11.138   24.478   11.453 -0.9192600 15.97545 
1 1 1    4    2    0 o   46.180   1.7602   44.367   4.7098   44.367   4.7098   44.367   4.7098   46.180   2.4893   46.180   2.4893 0.000000 0.000000 
1 1 1    4    2    1 o  216.837   2.0813  969.878   18.613  962.445   26.159  977.500   26.490  215.996   2.9363  217.678   2.9505 -1.682404 4.162650 
1 1 1    4    2    2 o  327.764   2.6329  2216.46   35.593  2224.01   50.512  2209.02   50.161  328.318   3.7302  327.210   3.7168 1.107269 5.265863 
1 1 1    4    2    3 o  589.140   4.1613  7162.84  101.087  7227.31  144.950  7101.80  141.047  591.715   5.9394  586.565   5.8302 5.150208 8.322689 
1 1 1    4    2    4 o  502.860   3.9257  5223.74   80.795  5173.89  121.748  5262.98  108.006  500.691   5.8956  505.029   5.1852 -4.337250 7.851386 
1 1 1    4    2    5 o  223.750   3.0278  1024.84   27.784  1106.21   42.096  962.034   36.984  231.556   4.4077  215.945   4.1525 15.61101 6.055664 
1 1 1    4    2    6 o  118.770   2.4441  291.179   11.732  291.884   15.159  290.127   18.526  118.954   3.0898  118.587   3.7877 0.3667831 4.888103 
1 1 1    4    2    7 o  252.193   2.6777  1312.27   27.851  1316.97   39.607  1307.67   39.172  252.639   3.8011  251.747   3.7727 0.8926086 5.355495 
1 1 1    4    2    8 o  297.342   2.7459  1823.38   33.283  1816.48   43.812  1832.79   51.180  296.695   3.5803  297.990   4.1642 -1.295807 5.491718 
1 1 1    4    2    9 o  233.489   2.2667  1124.84   21.828  1117.75   30.663  1132.13   31.080  232.743   3.1942  234.234   3.2171 -1.490494 4.533488 
1 1 1    4    2   10 o  105.089   2.5025  227.942   10.845  224.240   15.368  231.615   15.308  104.238   3.5746  105.940   3.5033 -1.702011 5.005095 
1 1 1    4    2   11 o  341.743   3.0170  2412.06   42.131  2402.06   64.020  2419.70   55.956  341.095   4.5507  342.392   3.9624 -1.297577 6.034006 
1 1 1    4    2   12 o  287.452   2.7628  1701.93   32.315  1685.10   42.273  1725.60   50.126  285.763   3.5866  289.141   4.2032 -3.378357 5.525504 
1 1 1    4    2   13 o  489.146   3.6224  4939.38   73.081  4939.46  103.391  4939.29  103.315  489.150   5.1247  489.142   5.1211 0.8026123E-02 7.244888 
1 1 1    4    2   14 o  157.060   2.3352  508.679   15.124  496.613   21.167  521.264   21.617  155.158   3.3077  158.962   3.2972 -3.804337 4.670371 
1 1 1    4    2   15 o  482.500   3.6103  4802.25   71.813  4745.74   99.795  4862.94  103.420  479.561   5.0454  485.439   5.1654 -5.877869 7.220669 
1 1 1    4    2   16 o   37.048   6.7461   29.462   10.377   30.887   14.611   28.012   14.742   37.908   9.3929   36.188   9.6857 1.719803 13.49217 
1 1 1    4    2   17 o  225.477   2.8984  1048.89   26.954  1057.68   38.226  1040.18   38.013  226.418   4.0933  224.537   4.1047 1.881180 5.796891 
1 1 1    4    2   18 o  462.889   4.0747  4419.71   77.722  4345.12  107.300  4502.06  112.733  458.790   5.6705  466.987   5.8530 -8.196381 8.149376 
1 1 1    4    2   19 o   64.884   4.4697   86.802   11.953   83.127   16.540   90.819   17.292   63.449   6.3203   66.319   6.3219 -2.870289 8.939399 
1 1 1    4    2   20 o  130.021   2.8291  348.709   15.168  339.158   21.228  358.671   21.681  128.203   4.0146  131.840   3.9872 -3.637024 5.658198 
1 1 1    4    2   21 o  261.290   2.6726  1408.65   28.799  1392.78   40.388  1425.07   41.078  259.793   3.7693  262.786   3.7900 -2.992981 5.345233 
1 1 1    4    2   22 o   71.204   5.3459  106.541   15.443  118.451   20.867   92.120   22.961   75.697   6.6838   66.711   8.3452 8.986481 10.69187 
1 1 1    4    2   23 f  191.884   2.7170  759.622   21.497  781.459   30.780  738.829   30.036  194.575   3.8355  189.193   3.8492 5.382233 5.433908 
1 1 1    4    2   24 o  214.033   2.7867  945.692   24.598  930.915   34.645  960.713   34.931  212.346   3.9558  215.719   3.9261 -3.373581 5.573346 
1 1 1    4    2   25 o  244.499   2.8058  1233.75   28.286  1261.48   40.612  1207.63   39.420  247.164   3.9838  241.833   3.9521 5.330246 5.611618 
1 1 1    4    2   26 o  109.101   4.0740  247.545   18.220  276.708   25.626  217.728   25.911  115.657   5.3720  102.546   6.1264 13.11140 8.148094 
1 1 1    4    2   27 o  201.888   3.0256  839.771   25.030  821.660   33.383  863.025   37.828  199.429   4.0586  204.346   4.4883 -4.917511 6.051208 
1 1 1    4    2   28 o   72.209   5.4659  106.460   16.108  130.767   24.494   87.936   21.383   79.365   7.4829   65.053   7.9695 14.31175 10.93186 
1 1 1    4    2   29 o  145.736   3.2743  439.453   19.664  461.141   27.839  417.858   27.779  149.336   4.5199  142.136   4.7386 7.199997 6.548563 
1 1 1    4    2   30 o   28.129   8.6175  -5.6692   18.932   6.9858   26.724 -18.4199   26.825   31.238   12.863   25.020   11.472 6.218616 17.23506 
1 1 1    4    2   31 o  183.381   4.0011  694.012   29.925  716.099   46.194  678.040   39.283  185.823   6.0272  180.938   5.2639 4.885361 8.002253 
1 1 1    4    2   32 o   22.391   7.2411 -20.9608   15.776 -40.1046   22.261  -1.6479   22.359   18.482   9.0094   26.300   11.339 -7.818342 14.48213 
1 1 1    4    2   33 o   64.821   6.6025   87.841   17.629   84.808   24.192   91.275   25.742   63.643   9.2163   65.998   9.4568 -2.355339 13.20495 
1 1 1    4    2   34 o   42.485   8.8349   39.102   16.503   39.845   22.720   38.272   24.012   42.789   12.250   42.181   12.734 0.6083908 17.66982 
1 1 1    4    2   35 o   41.618   9.5190   36.067   19.107   46.762   26.521   24.523   27.552   46.076   13.248   37.160   13.672 8.915539 19.03805 
1 1 1    4    2   36 o  129.207   4.3892  347.692   23.364  371.949   33.614  325.021   32.497  133.586   6.1010  124.828   6.3119 8.757713 8.778494 
1 1 1    4    2   37 o   35.701   9.2095   23.733   17.626   23.634   24.922   23.833   24.932   35.660   13.021   35.741   13.028 -0.8064651E-01 18.41908 
1 1 1    4    2   38 o   65.035   8.1778   94.547   20.581   90.802   33.680   96.780   26.000   62.875   13.398   67.196   9.3814 -4.321594 16.35559 
1 1 1    4    2   39 o   72.161   7.5469  112.401   22.271   99.595   29.294  129.941   34.284   67.425   10.534   76.896   10.810 -9.470436 15.09373 
1 1 1    4    2   40 o   58.817   7.2999   76.908   17.304   82.640   24.602   71.294   24.344   61.599   9.6835   56.034   10.926 5.565022 14.59973 
1 1 1    4    2   41 o   31.202   8.5926   14.972   16.547   27.240   23.480   2.8651   23.324   35.454   12.680   26.950   11.600 8.504227 17.18520 
1 1 1    4    2   42 o   44.257   9.3660   47.528   18.579   39.748   25.870   55.814   26.699   40.775   13.347   47.738   13.144 -6.962666 18.73210 
1 1 1    4    2   43 o   52.790   8.7655   67.768   18.718   68.630   25.452   66.753   27.625   53.493   11.848   52.088   12.921 1.405624 17.53092 
1 1 1    4    2   44 o   32.425   9.0754   18.410   18.934   0.3535   30.184   30.124   24.311   28.779   12.767   36.071   12.902 -7.291811 18.15078 
1 1 1    4    2   45 o   54.762   9.9755   79.377   22.749   85.776   31.672   72.557   32.697   57.608   13.556   51.916   14.638 5.691391 19.95101 
1 1 1    4    2   46 o   40.151   9.1817   41.270   20.725   69.213   27.445   4.1935   31.614   51.168   12.984   29.133   12.986 22.03537 18.36341 
1 1 1    4    2   47 o   38.340   8.9535   38.435   17.044   52.340   24.598   25.593   23.639   43.957   12.794   32.723   12.529 11.23355 17.90696 
1 1 1    4    2   48 o   27.591   8.2775   12.418   16.323   15.177   24.109   10.083   22.181   28.611   12.032   26.571   11.371 2.040611 16.55503 
1 1 1    4    2   49 o   31.118   8.8617   23.112   17.849   13.510   25.359   32.540   25.127   28.112   12.097   34.125   12.953 -6.013039 17.72342 
1 1 1    4    2   50 o   22.540   7.5988 -16.6253   19.682 -28.7852   27.357  -3.5769   28.339   20.487   9.9870   24.593   11.455 -4.105953 15.19762 
1 1 1    4    2   51 o   35.526   10.688   40.430   28.492   88.489   44.379   6.7303   37.162   43.516   17.029   27.536   12.921 15.98053 21.37602 
1 1 1    4    3    0 o  470.216   3.4437  4562.66   94.429  4562.66   94.429  4562.66   94.429  470.216   4.8702  470.216   4.8702 0.000000 0.000000 
1 1 1    4    3    1 f  877.554   5.9755 15912.19  216.275 15873.22  304.714 15951.75  307.017  876.476   8.4292  878.632   8.4721 -2.156555 11.95106 
1 1 1    4    3    2 o  230.330   2.1450  1094.26   20.377  1089.51   28.704  1099.09   28.931  229.826   3.0282  230.834   3.0388 -1.007889 4.289955 
1 1 1    4    3    3 o  599.676   4.2261  7421.64  104.519  7449.43  148.660  7394.47  146.980  600.785   5.9994  598.568   5.9536 2.216797 8.452106 
1 1 1    4    3    4 o  376.798   3.1429  2928.82   48.324  2931.65   73.938  2926.71   63.849  376.945   4.7558  376.651   4.1101 0.2935791 6.285711 
1 1 1    4    3    5 o  313.467   3.2974  2036.07   42.186  2091.27   56.194  1964.78   63.859  318.370   4.2795  308.563   5.0178 9.806976 6.594888 
1 1 1    4    3    6 o   31.326   2.9901   18.776   3.7127   14.998   4.5516   26.288   6.4178   26.960   4.0933   35.692   4.3596 -8.731995 5.980108 
1 1 1    4    3    7 o  296.207   2.9138  1809.00   35.567  1850.29   51.591  1771.59   49.101  299.423   4.1776  292.992   4.0632 6.431061 5.827641 
1 1 1    4    3    8 o  430.344   3.2503  3821.31   57.652  3883.13   83.320  3764.52   79.856  433.674   4.6582  427.013   4.5342 6.660950 6.500600 
1 1 1    4    3    9 o  124.463   2.0410  319.598   10.477  317.600   14.736  321.640   14.898  124.070   2.8797  124.856   2.8931 -0.7864685 4.081979 
1 1 1    4    3   10 o  312.012   3.0391  2009.62   39.106  2019.96   55.703  1999.58   54.915  312.801   4.3176  311.223   4.2781 1.578278 6.078166 
1 1 1    4    3   11 o  201.901   2.2111  840.574   18.405  860.073   26.469  822.319   25.611  204.166   3.1433  199.636   3.1104 4.530289 4.422099 
1 1 1    4    3   12 o  167.632   2.5456  579.827   17.599  577.251   24.770  582.454   25.010  167.256   3.5906  168.008   3.6093 -0.7515717 5.091165 
1 1 1    4    3   13 o  261.552   2.4728  1410.53   26.663  1438.27   38.428  1384.78   37.026  264.029   3.5288  259.075   3.4651 4.954041 4.945617 
1 1 1    4    3   14 o  274.948   2.5655  1559.46   29.092  1554.91   40.926  1564.11   41.362  274.543   3.6143  275.354   3.6420 -0.8101501 5.131014 
1 1 1    4    3   15 o  441.948   3.3889  4030.14   61.768  4012.01   86.741  4048.78   87.977  440.940   4.7696  442.954   4.8155 -2.013916 6.777781 
1 1 1    4    3   16 o  146.067   2.9699  440.462   17.880  449.135   24.987  431.362   25.595  147.543   4.1060  144.591   4.2919 2.951843 5.939732 
1 1 1    4    3   17 o  258.421   2.5952  1376.99   27.649  1354.11   38.451  1401.49   39.788  256.200   3.6388  260.641   3.7012 -4.441498 5.190372 
1 1 1    4    3   18 o  110.919   3.3738  253.903   15.424  241.361   21.681  266.755   21.947  108.144   4.8608  113.694   4.6802 -5.549797 6.747674 
1 1 1    4    3   19 o  190.053   2.5499  744.512   19.976  726.092   27.674  764.549   28.863  187.601   3.5766  192.504   3.6353 -4.902588 5.099734 
1 1 1    4    3   20 o  177.840   3.0104  652.492   22.068  658.392   31.818  647.022   30.634  178.613   4.3191  177.067   4.1947 1.545120 6.020752 
1 1 1    4    3   21 o  315.690   2.8455  2056.82   37.049  2058.34   52.380  2055.30   52.412  315.807   4.0214  315.573   4.0268 0.2333069 5.690932 
1 1 1    4    3   22 o  285.238   3.2112  1679.81   37.777  1690.97   53.358  1668.60   53.492  286.189   4.5205  284.287   4.5621 1.901642 6.422448 
1 1 1    4    3   23 o  158.838   2.9293  520.657   19.187  508.151   26.853  533.702   27.424  156.889   4.1498  160.786   4.1354 -3.896622 5.858570 
1 1 1    4    3   24 o  106.262   3.7181  233.763   16.258  216.733   23.079  250.541   22.908  102.404   5.4642  110.119   5.0438 -7.715431 7.436228 
1 1 1    4    3   25 o  164.850   2.9516  561.283   20.065  562.517   28.137  560.006   28.621  165.037   4.1337  164.663   4.2142 0.3734894 5.903112 
1 1 1    4    3   26 o  185.201   3.7706  702.830   27.720  685.576   34.571  733.899   46.390  182.120   4.6024  188.281   5.9738 -6.160461 7.541137 
1 1 1    4    3   27 o  113.866   4.3528  262.919   19.263  284.965   34.015  252.510   23.373  117.235   7.0347  110.496   5.1285 6.738518 8.705683 
1 1 1    4    3   28 o  120.012   4.4403  295.688   21.207  308.925   35.279  288.199   26.537  122.024   7.0097  118.000   5.4525 4.023651 8.880676 
1 1 1    4    3   29 o  145.990   4.0556  439.029   24.327  415.191   32.718  468.505   36.381  141.597   5.6023  150.384   5.8656 -8.786667 8.111169 
1 1 1    4    3   30 o   62.692   5.9734   82.113   15.329   94.984   21.922   69.798   21.443   67.555   7.8679   57.829   8.9902 9.725872 11.94688 
1 1 1    4    3   31 o   97.755   5.2524  202.048   20.815  233.351   28.620  166.900   30.327  106.019   6.5451   89.490   8.2166 16.52899 10.50481 
1 1 1    4    3   32 o   33.208   8.5338   19.177   15.164   22.814   21.658   15.680   21.237   34.787   12.204   31.630   11.931 3.156168 17.06767 
1 1 1    4    3   33 o   38.937   8.9269   31.347   16.382   31.781   23.352   30.927   22.988   39.167   12.672   38.706   12.577 0.4606171 17.85372 
1 1 1    4    3   34 o  103.021   4.3840  220.619   18.514  253.736   26.641  189.684   25.748  110.545   5.8431   95.497   6.5371 15.04760 8.767916 
1 1 1    4    3   35 o  200.367   3.2348  831.865   26.727  854.215   38.159  810.341   37.447  203.012   4.5573  197.722   4.5920 5.289810 6.469602 
1 1 1    4    3   36 o  109.899   4.8038  252.904   21.722  234.627   30.872  270.825   30.570  105.898   7.0681  113.899   6.5074 -8.000328 9.607527 
1 1 1    4    3   37 o   80.958   6.3487  138.497   21.136  131.432   28.579  147.025   31.401   78.734   8.8007   83.181   9.1528 -4.446754 12.69747 
1 1 1    4    3   38 o   64.019   6.8851   88.153   18.176   90.793   25.912   85.596   25.502   64.982   9.6680   63.057   9.8055 1.924103 13.77017 
1 1 1    4    3   39 o   59.290   9.4083   79.921   22.526   58.572   29.638  109.122   34.662   49.758   13.904   68.822   12.678 -19.06385 18.81653 
1 1 1    4    3   40 o   37.988   9.1716   31.311   17.344   25.995   24.178   36.945   24.893   35.637   12.854   40.340   13.087 -4.702908 18.34329 
1 1 1    4    3   41 o   86.256   5.1311  159.753   18.226  172.580   26.237  147.793   25.336   89.676   7.0937   82.836   7.4158 6.839516 10.26225 
1 1 1    4    3   42 o   29.493   8.7620   8.3332   18.123   3.6483   25.343   13.236   25.926   27.994   12.070   30.993   12.704 -2.998652 17.52402 
1 1 1    4    3   43 o   38.361   8.8693   33.776   16.935   19.398   23.605   49.026   24.309   32.057   12.454   44.665   12.632 -12.60861 17.73863 
1 1 1    4    3   44 o   40.513   9.4394   38.911   18.679   26.007   24.965   55.320   28.153   34.540   12.955   46.485   13.732 -11.94540 18.87890 
1 1 1    4    3   45 o   28.117   8.4106   8.2121   17.028   0.9640   24.406   15.088   23.770   26.205   11.559   30.029   12.220 -3.824711 16.82120 
1 1 1    4    3   46 o   29.864   8.5533  -1.0099   20.695   41.630   27.848 -53.6042   30.928   39.379   13.837   20.350   10.058 19.02818 17.10650 
1 1 1    4    3   47 o   25.743   8.2376  -1.6376   18.201   3.9006   29.488  -5.0458   23.133   27.945   12.493   23.541   10.741 4.403250 16.47526 
1 1 1    4    3   48 o   39.691   9.4272   45.706   18.404   51.958   25.787   39.216   26.274   42.361   13.272   37.021   13.392 5.340054 18.85442 
1 1 1    4    3   49 o   27.489   8.5444   8.7157   19.429   20.323   25.248  -8.1379   30.424   29.971   12.436   25.008   11.720 4.963419 17.08876 
1 1 1    4    3   50 o   31.596   10.073   14.797   28.804   54.383   42.765 -18.0737   38.970   37.691   15.947   25.502   12.310 12.18922 20.14551 
1 1 1    4    3   51 o   34.167   10.385   36.893   27.876   75.334   41.230   4.5250   37.833   41.087   16.308   27.248   12.863 13.83911 20.77089 
1 1 1    4    4    0 o  360.103   2.8097  2675.61   58.999  2675.61   58.999  2675.61   58.999  360.103   3.9735  360.103   3.9735 0.000000 0.000000 
1 1 1    4    4    1 o  596.163   4.2034  7332.65  103.312  7255.94  143.750  7414.60  148.582  592.944   5.8780  599.382   6.0103 -6.437256 8.406801 
1 1 1    4    4    2 o  666.704   4.6411  9175.21  127.620  9181.84  180.671  9168.62  180.295  666.944   6.5680  666.464   6.5591 0.4794312 9.282219 
1 1 1    4    4    3 o  469.062   3.4378  4539.76   66.508  4549.34   94.340  4530.29   93.777  469.554   4.8713  468.571   4.8524 0.9831238 6.875681 
1 1 1    4    4    4 o  301.540   3.5816  1807.86   43.092  2144.24   72.813  1626.52   53.460  322.321   5.4771  280.759   4.6167 41.56226 7.163298 
1 1 1    4    4    5 o  185.769   2.5491  711.644   19.166  710.209   24.808  713.767   30.184  185.545   3.2418  185.993   3.9348 -0.4485474 5.098158 
1 1 1    4    4    6 o  475.439   4.4700  4687.39   87.064  4845.46  117.711  4496.46  129.368  484.375   5.8921  466.502   6.7237 17.87332 8.940072 
1 1 1    4    4    7 o  179.965   2.6098  671.557   19.088  688.135   25.120  648.906   29.363  182.618   3.3351  177.313   4.0151 5.304855 5.219563 
1 1 1    4    4    8 o  306.567   3.3599  1931.49   41.324  1979.88   67.079  1901.89   52.462  309.602   5.2531  303.531   4.1906 6.071167 6.719831 
1 1 1    4    4    9 f   55.906   3.0339   65.704   6.8023   58.884   10.639   70.420   8.8469   53.399   4.8305   58.413   3.6721 -5.013752 6.067801 
1 1 1    4    4   10 o  484.360   3.8532  4850.70   76.387  4883.98  102.103  4808.39  115.120  486.300   5.0906  482.420   5.7858 3.879761 7.706452 
1 1 1    4    4   11 o  169.350   2.1544  591.594   15.046  583.484   21.092  599.998   21.470  168.168   3.0409  170.531   3.0525 -2.362915 4.308708 
1 1 1    4    4   12 o  101.985   2.8560  214.627   12.012  213.841   16.825  215.443   17.153  101.795   4.0075  102.175   4.0704 -0.3795547 5.712085 
1 1 1    4    4   13 o  500.796   3.6959  5176.55   76.339  5181.72  108.133  5171.42  107.788  501.044   5.2326  500.547   5.2211 0.4976501 7.391865 
1 1 1    4    4   14 o  293.560   2.6395  1777.58   31.956  1794.04   45.535  1761.60   44.858  294.898   3.7438  292.221   3.7219 2.677795 5.279017 
1 1 1    4    4   15 o  382.045   3.0756  3010.87   48.452  2978.48   67.663  3044.96   69.413  379.938   4.3179  384.152   4.3810 -4.213837 6.151209 
1 1 1    4    4   16 o  160.618   2.8959  532.318   19.182  537.102   26.990  527.436   27.266  161.348   4.0558  159.888   4.1346 1.459930 5.791763 
1 1 1    4    4   17 o  218.085   2.4992  981.063   22.477  974.211   31.489  988.182   32.094  217.310   3.5132  218.861   3.5554 -1.551727 4.998380 
1 1 1    4    4   18 o  531.532   3.9166  5831.21   85.849  5791.82  120.196  5872.24  122.659  529.703   5.5016  533.361   5.5759 -3.657593 7.833146 
1 1 1    4    4   19 o  243.365   2.8221  1218.75   28.004  1243.68   43.172  1200.64   36.796  245.499   4.2637  241.232   3.6983 4.266464 5.644147 
1 1 1    4    4   20 o  332.496   3.3544  2282.07   46.000  2276.98   65.058  2287.16   65.050  332.125   4.7494  332.867   4.7382 -0.7420959 6.708699 
1 1 1    4    4   21 o  116.009   3.0342  277.654   14.513  272.447   20.223  283.185   20.841  114.889   4.2677  117.130   4.3141 -2.240929 6.068355 
1 1 1    4    4   22 o  220.640   3.1149  1005.13   28.339  1034.53   40.181  976.026   39.974  223.854   4.3520  217.426   4.4576 6.427841 6.229809 
1 1 1    4    4   23 o  282.389   3.0589  1643.80   35.166  1662.97   54.422  1630.06   46.077  283.774   4.6498  281.004   3.9757 2.769806 6.117720 
1 1 1    4    4   24 o   45.609   8.1981   35.289   16.096   79.484   28.324   14.210   19.561   60.760   11.727   30.457   11.459 30.30271 16.39622 
1 1 1    4    4   25 o   79.497   4.8948  131.897   15.906  140.764   21.591  121.373   23.522   82.468   6.3477   76.525   7.4527 5.943047 9.789583 
1 1 1    4    4   26 o  100.678   4.3817  210.196   18.170  219.744   25.471  200.303   25.926  103.023   5.9944   98.333   6.3925 4.689369 8.763414 
1 1 1    4    4   27 o  152.745   3.0279  482.103   19.075  482.181   26.989  482.024   26.964  152.757   4.2837  152.732   4.2804 0.2467346E-01 6.055746 
1 1 1    4    4   28 o  200.560   3.2060  831.202   26.494  842.390   38.425  821.063   36.581  201.836   4.6158  199.284   4.4506 2.552261 6.411966 
1 1 1    4    4   29 o  209.466   3.3446  906.844   28.883  932.417   41.579  882.996   40.153  212.315   4.7482  206.616   4.7118 5.698502 6.689291 
1 1 1    4    4   30 o   35.005   8.3665   23.912   14.449   28.543   20.546   19.381   20.324   37.158   11.872   32.852   11.792 4.306194 16.73292 
1 1 1    4    4   31 o   91.838   4.7982  172.362   17.956  193.279   28.160  158.031   23.309   96.427   7.0806   87.249   6.4774 9.178436 9.596444 
1 1 1    4    4   32 o   84.961   4.8155  150.188   16.854  156.282   23.614  143.860   24.062   86.740   6.6006   83.183   7.0134 3.557198 9.630915 
1 1 1    4    4   33 o  191.843   3.1183  760.856   24.660  733.150   34.226  790.766   35.561  188.215   4.4089  195.471   4.4108 -7.255463 6.236501 
1 1 1    4    4   34 o   70.693   6.6507  106.219   19.143  120.320   26.407   90.601   27.792   75.822   8.4441   65.564   10.277 10.25791 13.30135 
1 1 1    4    4   35 o  205.885   3.3343  879.918   28.192  889.186   38.255  868.902   41.707  207.129   4.4779  204.641   4.9414 2.487442 6.668563 
1 1 1    4    4   36 o  101.779   4.6755  216.814   19.548  240.077   27.738  193.861   27.552  107.279   6.2689   96.278   6.9384 11.00088 9.350973 
1 1 1    4    4   37 o   52.022   10.129   61.298   22.208   68.629   34.357   56.036   29.107   54.488   14.872   49.557   13.755 4.931129 20.25752 
1 1 1    4    4   38 o   69.561   6.3283  103.653   18.125   96.917   25.622  110.399   25.644   67.213   9.2427   71.910   8.6464 -4.696854 12.65652 
1 1 1    4    4   39 o   43.160   9.4112   43.474   18.723   33.619   28.474   50.980   24.850   39.555   13.983   46.765   12.600 -7.209587 18.82240 
1 1 1    4    4   40 o   38.509   9.1097   33.073   17.011   33.796   24.360   32.385   23.765   38.851   12.962   38.167   12.803 0.6833344 18.21945 
1 1 1    4    4   41 o   49.069   8.4698   57.910   17.214   69.689   23.946   45.313   24.763   54.750   10.986   43.388   12.894 11.36234 16.93967 
1 1 1    4    4   42 o   23.286   7.4696 -15.9132   16.502   5.4787   23.405 -37.0573   23.269   27.640   11.751   18.933   9.2252 8.707043 14.93928 
1 1 1    4    4   43 o   68.750   6.1116  104.670   17.313   99.158   24.366  110.291   24.605   66.812   8.8421   70.689   8.4395 -3.876434 12.22323 
1 1 1    4    4   44 o   43.835   9.6679   47.258   23.640   0.4709   36.268   81.821   31.172   30.906   13.833   56.764   13.510 -25.85740 19.33585 
1 1 1    4    4   45 o   51.146   8.2103   65.375   17.741   42.113   25.354   87.694   24.834   40.561   13.210   61.730   9.7542 -21.16892 16.42069 
1 1 1    4    4   46 o   68.222   7.2626  109.675   19.698  137.008   29.793   88.447   26.256   76.641   9.4251   59.803   11.052 16.83761 14.52516 
1 1 1    4    4   47 o   36.225   8.4117   32.266   16.856   6.0376   24.609   55.448   23.136   26.727   11.704   45.723   12.085 -18.99599 16.82337 
1 1 1    4    4   48 o   40.068   8.4553   42.302   18.018   74.372   25.323   9.4196   25.642   52.689   11.930   27.447   11.985 25.24179 16.91054 
1 1 1    4    4   49 o   34.729   9.0049   34.288   17.060   27.964   24.095   40.644   24.157   32.267   12.570   37.191   12.898 -4.924084 18.00978 
1 1 1    4    4   50 o   36.302   10.708   45.782   27.582   28.043   40.219   61.533   37.898   32.383   14.525   40.222   15.737 -7.838879 21.41617 
1 1 1    4    4   51 o   30.463   9.8036   18.114   27.322   54.941   41.823  -9.3055   36.088   35.938   15.500   24.988   12.007 10.94977 19.60720 
1 1 1    4    5    0 o  629.029   4.4068  8166.31  161.653  8166.31  161.653  8166.31  161.653  629.029   6.2322  629.029   6.2322 0.000000 0.000000 
1 1 1    4    5    1 o  711.815   4.9239 10462.54  144.558 10463.47  204.467 10461.61  204.404  711.846   6.9642  711.784   6.9627 0.6280518E-01 9.847791 
1 1 1    4    5    2 o  232.087   2.1569  1111.07   20.647  1106.92   29.084  1115.30   29.314  231.650   3.0441  232.525   3.0566 -0.8750916 4.313893 
1 1 1    4    5    3 o  298.271   2.6790  1837.64   32.688  1818.52   49.352  1852.58   43.632  296.878   4.0305  299.664   3.5302 -2.785919 5.357936 
1 1 1    4    5    4 o  206.183   2.3659  876.987   20.118  867.730   28.322  886.416   28.583  205.085   3.3483  207.281   3.3434 -2.196548 4.731733 
1 1 1    4    5    5 o  251.999   3.2243  1310.80   33.512  1309.10   47.331  1312.51   47.455  251.835   4.5568  252.163   4.5628 -0.3276367 6.448543 
1 1 1    4    5    6 o  320.371   3.0310  2118.46   40.044  2106.98   56.068  2130.42   57.211  319.487   4.2549  321.255   4.3178 -1.767517 6.061980 
1 1 1    4    5    7 o  182.714   2.8680  688.009   21.594  716.102   31.352  662.656   29.785  186.256   4.0813  179.173   4.0305 7.083115 5.735992 
1 1 1    4    5    8 o  431.880   3.7643  3851.68   67.027  3895.86   96.310  3810.19   93.341  434.274   5.3770  429.486   5.2694 4.787354 7.528508 
1 1 1    4    5    9 o  158.886   2.3775  520.289   15.569  537.401   22.562  504.736   21.510  161.376   3.3898  156.396   3.3347 4.979706 4.755097 
1 1 1    4    5   10 o  234.888   2.3052  1138.32   22.331  1129.17   31.374  1147.71   31.791  233.932   3.2518  235.844   3.2682 -1.911880 4.610336 
1 1 1    4    5   11 o  174.054   2.1829  624.864   15.668  633.679   22.407  616.430   21.917  175.254   3.0999  172.853   3.0742 2.401016 4.365742 
1 1 1    4    5   12 o  467.444   3.7734  4512.65   72.072  4497.43  109.566  4524.26   95.689  466.715   5.6919  468.174   4.9555 -1.458740 7.546861 
1 1 1    4    5   13 o  293.721   2.8531  1775.25   34.048  1753.44   44.348  1806.56   53.138  291.540   3.6881  295.902   4.3541 -4.361908 5.706146 
1 1 1    4    5   14 o  337.179   2.8432  2345.45   39.539  2335.84   55.685  2355.22   56.152  336.483   4.0124  337.876   4.0294 -1.392639 5.686471 
1 1 1    4    5   15 o  167.479   2.4495  578.409   16.915  587.776   24.280  569.574   23.579  168.796   3.4875  166.163   3.4406 2.633255 4.899020 
1 1 1    4    5   16 o  279.046   3.0329  1606.37   34.904  1624.62   49.733  1588.66   48.997  280.607   4.2972  277.485   4.2812 3.122192 6.065852 
1 1 1    4    5   17 o  449.600   3.4445  4170.88   63.859  4136.58   89.232  4206.89   91.430  447.708   4.8324  451.491   4.9099 -3.783600 6.889027 
1 1 1    4    5   18 o  588.174   4.6003  7136.44  110.143  7097.95  144.385  7190.02  170.348  586.341   5.9704  590.006   7.0003 -3.664612 9.200524 
1 1 1    4    5   19 o  288.168   3.5405  1701.94   40.732  1761.87   67.108  1666.98   51.252  292.125   5.5698  284.212   4.3722 7.912292 7.080913 
1 1 1    4    5   20 o  112.534   3.7845  262.845   16.581  257.401   28.492  265.633   20.389  111.624   6.1887  113.445   4.3576 -1.820969 7.568963 
1 1 1    4    5   21 f  197.848   2.7892  805.005   22.548  787.649   29.767  828.367   34.536  195.365   3.6943  200.331   4.1798 -4.966431 5.578394 
1 1 1    4    5   22 o  246.993   2.8962  1261.12   29.288  1274.48   39.237  1244.31   44.013  248.488   3.8285  245.498   4.3468 2.990143 5.792385 
1 1 1    4    5   23 o  346.128   3.5319  2472.87   50.397  2534.25   72.682  2416.04   69.940  350.257   5.0312  341.999   4.9583 8.258667 7.063878 
1 1 1    4    5   24 o  214.254   2.7519  947.829   24.318  953.238   34.353  942.396   34.428  214.868   3.8764  213.641   3.9071 1.227386 5.503836 
1 1 1    4    5   25 o  118.494   3.8386  289.710   18.738  273.354   25.807  307.948   27.251  114.965   5.4426  122.024   5.4147 -7.059563 7.677292 
1 1 1    4    5   26 o  214.599   2.7707  951.293   24.522  940.031   34.606  962.651   34.754  213.322   3.9333  215.876   3.9033 -2.554031 5.541324 
1 1 1    4    5   27 o  116.239   3.4281  279.362   16.432  279.683   23.480  279.055   23.003  116.301   4.8950  116.177   4.8006 0.1248016 6.856156 
1 1 1    4    5   28 o  114.429   3.7196  270.897   17.464  269.924   23.508  272.095   26.087  114.220   4.9900  114.637   5.5175 -0.4166260 7.439298 
1 1 1    4    5   29 o   39.432   9.0954   31.818   17.068   27.188   25.360   35.651   23.077   37.842   13.210   41.021   12.506 -3.179260 18.19080 
1 1 1    4    5   30 o   75.238   4.9570  117.439   15.371  112.119   21.302  123.219   22.203   73.461   7.0307   77.015   6.9898 -3.553711 9.914034 
1 1 1    4    5   31 o  178.529   3.2204  658.034   23.598  645.404   31.707  673.716   35.331  176.638   4.3521  180.419   4.7479 -3.780411 6.440824 
1 1 1    4    5   32 o  149.707   3.8366  469.716   22.995  487.900   29.518  441.648   36.673  153.531   4.6615  145.883   6.0950 7.648697 7.673250 
1 1 1    4    5   33 o   81.191   5.1772  137.316   17.333  139.632   24.423  134.965   24.604   81.890   7.2310   80.491   7.4114 1.399750 10.35450 
1 1 1    4    5   34 o  107.037   4.6817  238.450   20.566  207.977   28.591  271.124   29.605   99.903   6.9388  114.171   6.2870 -14.26846 9.363416 
1 1 1    4    5   35 o   87.337   5.2401  161.223   18.548  126.990   26.182  195.709   26.279   77.801   8.1594   96.873   6.5772 -19.07253 10.48023 
1 1 1    4    5   36 o   55.792   7.9277   68.915   17.889   42.948   24.946   96.406   25.668   44.062   12.901   67.522   9.2168 -23.46029 15.85541 
1 1 1    4    5   37 o   61.153   10.311   88.418   25.256   77.331   41.007   95.194   32.057   57.270   16.476   65.036   12.404 -7.766018 20.62291 
1 1 1    4    5   38 o   32.359   8.6135   13.433   17.186   33.643   24.275  -6.8742   24.334   39.211   12.933   25.507   11.380 13.70454 17.22691 
1 1 1    4    5   39 o   64.556   6.6454   90.436   17.693   91.355   25.187   89.540   24.859   64.874   9.4132   64.237   9.3826 0.6372070 13.29073 
1 1 1    4    5   40 o   58.533   8.2553   72.791   19.214   51.461   24.068  110.272   31.904   46.759   12.311   70.306   11.002 -23.54673 16.51069 
1 1 1    4    5   41 o   28.985   8.3481   2.1647   17.680   27.935   24.991 -23.6558   25.016   35.964   13.053   22.006   10.410 13.95821 16.69616 
1 1 1    4    5   42 o   25.978   7.9487  -2.4779   16.360 -17.2905   22.819   13.188   23.467   21.867   10.217   30.089   12.179 -8.221251 15.89736 
1 1 1    4    5   43 o   61.448   6.8848   86.005   17.014   95.785   24.577   77.006   23.575   65.448   9.1050   57.448   10.330 7.999741 13.76965 
1 1 1    4    5   44 o   57.746   10.478   86.665   25.125  107.702   38.182   70.600   33.366   64.071   14.754   51.421   14.882 12.64988 20.95560 
1 1 1    4    5   45 o   21.124   7.0877 -22.2042   16.780 -31.2635   23.977 -13.5085   23.491   19.772   9.5712   22.477   10.456 -2.704834 14.17542 
1 1 1    4    5   46 o   33.841   8.4777   24.462   16.556   3.1177   23.171   46.723   23.663   25.718   11.307   41.964   12.635 -16.24566 16.95540 
1 1 1    4    5   47 o   50.368   8.2402   66.561   16.866   57.062   24.085   75.700   23.625   45.951   12.415   54.786   10.839 -8.835522 16.48046 
1 1 1    4    5   48 o   33.314   8.7880   27.280   17.272   43.780   24.474   10.906   24.380   39.162   12.989   27.466   11.840 11.69649 17.57606 
1 1 1    4    5   49 o   28.688   8.4450   15.885   17.073   3.5056   23.770   29.075   24.536   24.864   11.159   32.512   12.679 -7.648102 16.88993 
1 1 1    4    5   50 f   26.385   8.8903  -7.4693   26.526  -5.0374   39.995  -9.3789   35.442   27.190   12.949   25.581   12.185 1.609528 17.78050 
1 1 1    4    5   51 o   34.506   10.431   38.834   27.250   81.075   42.113   8.4099   35.741   41.754   16.511   27.258   12.752 14.49585 20.86217 
1 1 1    4    6    0 o  260.697   2.2901  1402.47   34.811  1402.47   34.811  1402.47   34.811  260.697   3.2386  260.697   3.2386 0.000000 0.000000 
1 1 1    4    6    1 o  619.247   4.3487  7919.49  111.066  7903.86  156.573  7935.32  157.573  618.634   6.1365  619.860   6.1634 -1.226074 8.697357 
1 1 1    4    6    2 o  209.225   2.0577  902.790   17.753  889.997   24.810  916.215   25.415  207.707   2.8961  210.744   2.9239 -3.036484 4.115396 
1 1 1    4    6    3 o  197.763   2.3216  803.171   18.881  855.300   28.049  759.982   25.531  203.602   3.3402  191.925   3.2253 11.67680 4.643241 
1 1 1    4    6    4 o  112.703   2.2535  263.588   10.320  271.551   13.598  252.769   15.850  114.727   2.8736  110.678   3.4721 4.049179 4.506999 
1 1 1    4    6    5 o  324.802   3.0395  2177.79   40.717  2170.58   57.352  2185.11   57.815  324.261   4.2883  325.343   4.3085 -1.082153 6.078911 
1 1 1    4    6    6 o  361.307   3.2916  2694.98   49.042  2720.61   70.156  2670.49   68.582  362.983   4.6861  359.630   4.6237 3.352539 6.583169 
1 1 1    4    6    7 o  287.734   2.6735  1712.20   31.522  1740.54   42.432  1677.30   47.087  290.411   3.5425  285.057   4.0050 5.354492 5.346953 
1 1 1    4    6    8 o  373.805   3.3942  2885.27   52.328  2892.93   74.371  2877.76   73.641  374.295   4.8175  373.315   4.7828 0.9793701 6.788484 
1 1 1    4    6    9 o  197.571   2.7509  807.167   21.995  813.745   28.541  797.546   34.516  198.580   3.4847  196.562   4.2575 2.017975 5.501749 
1 1 1    4    6   10 o  253.643   2.3860  1326.57   24.949  1355.14   35.966  1300.08   34.639  256.273   3.4027  251.014   3.3458 5.258133 4.772079 
1 1 1    4    6   11 o  397.118   3.0990  3254.66   50.758  3250.68   71.688  3258.65   71.879  396.875   4.3795  397.361   4.3858 -0.4860229 6.198017 
1 1 1    4    6   12 o  225.545   2.3596  1049.41   21.950  1050.63   31.065  1048.19   31.019  225.676   3.3375  225.413   3.3364 0.2624969 4.719182 
1 1 1    4    6   13 o  314.676   3.1494  2041.60   40.846  2007.11   56.527  2079.29   59.088  311.898   4.3941  317.453   4.5129 -5.554565 6.298798 
1 1 1    4    6   14 o  351.622   3.1630  2546.51   45.222  2523.86   59.058  2578.61   70.313  349.752   4.0940  353.492   4.8227 -3.740082 6.326097 
1 1 1    4    6   15 o  283.516   3.4120  1653.55   38.967  1682.37   62.448  1635.17   49.867  285.515   5.3030  281.518   4.2948 3.997406 6.824021 
1 1 1    4    6   16 o  560.545   4.9955  6494.88  108.956  6472.16  188.282  6506.33  133.599  559.670   8.1566  561.420   5.7696 -1.749268 9.990958 
1 1 1    4    6   17 o  163.938   2.6491  552.148   17.723  539.055   23.299  570.127   27.303  161.646   3.4947  166.230   3.9823 -4.583908 5.298277 
1 1 1    4    6   18 o  232.719   2.7161  1119.03   25.822  1129.42   34.320  1105.48   39.199  233.973   3.5564  231.465   4.1060 2.508652 5.432113 
1 1 1    4    6   19 o  357.740   3.8771  2636.78   56.055  2614.49   72.233  2670.54   88.879  355.886   4.9211  359.594   5.9926 -3.708618 7.754268 
1 1 1    4    6   20 o  219.612   2.5834  995.189   23.399  1000.22   33.279  990.269   32.906  220.161   3.6649  219.063   3.6419 1.097137 5.166763 
1 1 1    4    6   21 o  347.687   2.9869  2494.64   42.820  2464.86   59.729  2526.12   61.421  345.556   4.1908  349.818   4.2571 -4.262543 5.973735 
1 1 1    4    6   22 o  393.800   3.2326  3201.55   52.494  3235.20   75.125  3169.46   73.382  395.817   4.6018  391.782   4.5413 4.035370 6.465257 
1 1 1    4    6   23 o   84.646   5.2605  148.258   18.232  147.592   24.334  149.110   27.528   84.450   6.9864   84.843   7.8666 -0.3931198 10.52107 
1 1 1    4    6   24 o  223.270   2.9531  1030.43   26.957  1036.67   35.895  1022.36   40.826  224.068   3.8841  222.472   4.4493 1.595200 5.906155 
1 1 1    4    6   25 o  138.279   3.7966  392.663   21.285  380.582   27.481  410.774   33.650  135.675   4.9111  140.883   5.7911 -5.208328 7.593139 
1 1 1    4    6   26 o  252.773   2.9669  1321.67   30.766  1335.21   41.538  1305.21   45.793  254.235   3.9614  251.311   4.4179 2.924713 5.933847 
1 1 1    4    6   27 o  223.306   2.7820  1030.18   25.622  1032.46   36.370  1027.94   36.101  223.549   3.9446  223.062   3.9240 0.4873505 5.564002 
1 1 1    4    6   28 o  100.735   4.6378  210.546   19.226  209.009   28.088  211.901   26.373  100.369   6.7851  101.101   6.3246 -0.7321396 9.275650 
1 1 1    4    6   29 o   53.040   7.5522   62.836   16.039   41.103   23.672   81.280   21.807   43.623   12.509   62.456   8.4657 -18.83319 15.10441 
1 1 1    4    6   30 o  136.761   3.3308  387.203   18.773  369.745   26.541  404.685   26.558  133.664   4.8143  139.858   4.6042 -6.193924 6.661518 
1 1 1    4    6   31 o   96.440   4.2617  192.907   16.950  189.985   23.803  195.914   24.143   95.699   6.0307   97.181   6.0233 -1.482590 8.523464 
1 1 1    4    6   32 o   68.344   7.2607   97.476   20.393   87.483   27.675  109.350   30.167   64.520   10.400   72.169   10.135 -7.648186 14.52144 
1 1 1    4    6   33 o  132.611   4.1784  376.631   22.119  299.962   33.426  436.362   29.503  120.090   6.7485  145.132   4.9288 -25.04189 8.356764 
1 1 1    4    6   34 o  125.411   3.9048  326.660   20.193  333.515   28.511  319.759   28.604  126.742   5.4541  124.080   5.5893 2.662277 7.809499 
1 1 1    4    6   35 o   51.239   7.9784   57.801   17.717   93.327   25.382   24.044   24.742   66.497   9.2547   35.982   12.999 30.51468 15.95684 
1 1 1    4    6   36 o   97.466   4.8331  198.760   19.426  203.278   27.531  194.281   27.414   98.582   6.7710   96.350   6.8986 2.232147 9.666240 
1 1 1    4    6   37 o  131.720   4.2545  363.417   23.092  344.426   32.565  382.622   32.749  128.210   6.1584  135.229   5.8716 -7.019409 8.508904 
1 1 1    4    6   38 o   25.309   7.8047 -11.6251   16.741 -34.9190   23.339   13.063   24.027   19.586   9.4719   31.032   12.407 -11.44642 15.60934 
1 1 1    4    6   39 o  102.893   4.5663  223.731   19.377  222.546   27.221  224.949   27.590  102.628   6.4309  103.159   6.4845 -0.5317993 9.132634 
1 1 1    4    6   40 o   38.392   9.4577   30.575   20.520   51.305   27.122   2.8251   31.380   46.162   13.434   30.622   13.316 15.54004 18.91541 
1 1 1    4    6   41 o   43.975   8.7478   43.883   18.112   19.081   24.660   72.934   26.688   32.557   12.707   55.392   12.026 -22.83424 17.49563 
1 1 1    4    6   42 o   54.884   7.9157   70.855   17.301   64.247   24.765   77.154   24.180   51.951   11.824   57.817   10.528 -5.865704 15.83133 
1 1 1    4    6   43 o   27.787   8.3166   6.7223   16.583   12.736   23.675   0.9301   23.236   29.609   12.139   25.965   11.371 3.644136 16.63324 
1 1 1    4    6   44 o   49.000   8.7655   60.877   17.925   70.415   24.652   50.178   26.110   53.777   11.465   44.223   13.263 9.554703 17.53102 
1 1 1    4    6   45 o   32.000   8.6192   19.526   16.825   3.4071   23.807   35.610   23.781   26.410   11.539   37.590   12.806 -11.18008 17.23832 
1 1 1    4    6   46 o   37.924   7.4469   29.635   16.154 -11.1837   22.734   71.261   22.958   22.189   10.310   53.659   10.748 -31.47025 14.89380 
1 1 1    4    6   47 o   22.362   7.6009 -24.6975   19.840 -29.6967   25.621 -17.2086   31.358   20.260   9.8279   24.465   11.598 -4.205233 15.20170 
1 1 1    4    6   48 o   29.812   8.7096   18.479   17.536   12.635   24.703   24.415   24.897   27.994   11.991   31.630   12.635 -3.635761 17.41911 
1 1 1    4    6   49 o   40.632   10.114   52.038   22.563   80.045   33.158   27.887   30.791   49.057   14.998   32.207   13.574 16.85052 20.22809 
1 1 1    4    6   50 f   25.628   8.4235 -13.3882   23.650   25.840   32.125 -59.8003   34.943   31.099   13.499   20.157   10.080 10.94222 16.84710 
1 1 1    4    6   51 o   29.632   9.6705   22.131   27.580   18.470   42.024   24.901   36.554   29.315   13.750   29.950   13.601 -0.6354122 19.34094 
1 1 1    4    7    0 o  142.753   2.5805  421.219   21.455  421.219   21.455  421.219   21.455  142.753   3.6493  142.753   3.6493 0.000000 0.000000 
1 1 1    4    7    1 f  258.812   2.2822  1382.06   24.360  1374.12   34.254  1390.18   34.651  258.061   3.2182  259.564   3.2368 -1.502991 4.564385 
1 1 1    4    7    2 o  234.699   2.3458  1135.99   22.460  1141.07   34.429  1132.23   29.635  235.145   3.5499  234.253   3.0673 0.8914642 4.691521 
1 1 1    4    7    3 o  141.591   1.9726  415.013   11.431  401.602   17.116  425.810   15.357  139.515   2.9745  143.667   2.5917 -4.152191 3.945213 
1 1 1    4    7    4 o  127.926   2.2926  339.315   11.917  347.714   15.676  327.815   18.343  129.818   2.9277  126.034   3.5288 3.783592 4.585140 
1 1 1    4    7    5 o  219.282   2.4528  992.299   22.183  996.327   31.455  988.314   31.288  219.725   3.4709  218.839   3.4665 0.8851471 4.905512 
1 1 1    4    7    6 o  304.367   2.9250  1912.15   36.716  1926.15   52.335  1898.57   51.524  305.463   4.1540  303.271   4.1192 2.191925 5.850087 
1 1 1    4    7    7 o  105.438   2.1867  230.777   9.4132  240.539   12.611  218.496   14.145  107.976   2.8318  102.901   3.3329 5.075203 4.373453 
1 1 1    4    7    8 o  450.854   3.8929  4197.90   72.376  4232.62  103.513  4164.69  101.234  452.672   5.5443  449.035   5.4661 3.636993 7.785761 
1 1 1    4    7    9 o  232.040   3.6468  1102.21   27.412  1096.39   30.430  1127.29   63.134  230.519   3.2006  233.562   6.5539 -3.042923 7.293619 
1 1 1    4    7   10 o  410.922   3.4268  3482.72   57.363  3467.85   75.359  3503.20   88.452  409.911   4.4574  411.934   5.2061 -2.023865 6.853606 
1 1 1    4    7   11 o  766.645   6.4812 12176.69  194.220 12075.04  332.069 12229.54  239.446  763.886   10.540  769.403   7.5455 -5.516113 12.96236 
1 1 1    4    7   12 o  342.136   3.4726  2427.41   46.466  2377.43   79.122  2453.72   57.408  339.401   5.6522  344.871   4.0360 -5.470032 6.945288 
1 1 1    4    7   13 o  210.655   3.1174  913.307   26.372  905.591   33.588  925.711   42.585  209.511   3.8870  211.799   4.8749 -2.288971 6.234844 
1 1 1    4    7   14 o  332.760   3.0697  2280.96   41.598  2261.54   54.547  2307.96   64.308  331.084   3.9946  334.437   4.6621 -3.353668 6.139382 
1 1 1    4    7   15 o  369.721   3.4735  2820.04   52.952  2789.83   73.867  2851.97   75.946  367.687   4.8709  371.756   4.9532 -4.068329 6.946904 
1 1 1    4    7   16 o   77.022   3.4395  122.691   10.879  136.824   15.462  108.837   15.309   81.427   4.6039   72.618   5.1113 8.809441 6.879045 
1 1 1    4    7   17 o  178.062   2.4594  654.122   18.061  651.803   25.643  656.406   25.442  177.748   3.4978  178.375   3.4582 -0.6272125 4.918719 
1 1 1    4    7   18 o  458.782   3.5068  4344.55   66.356  4339.63   93.648  4349.51   94.037  458.522   4.9519  459.042   4.9669 -0.5201721 7.013642 
1 1 1    4    7   19 o  278.994   3.4350  1608.44   38.929  1615.83   50.889  1598.01   60.443  279.794   4.4098  278.194   5.2679 1.599762 6.870025 
1 1 1    4    7   20 o  189.821   2.8092  745.169   21.851  729.735   32.636  757.710   29.419  188.027   4.2084  191.616   3.7224 -3.588928 5.618446 
1 1 1    4    7   21 o  219.475   2.6451  994.185   23.944  995.737   33.883  992.637   33.839  219.646   3.7402  219.303   3.7412 0.3421631 5.290164 
1 1 1    4    7   22 o  105.956   3.5681  232.340   15.525  205.982   21.821  259.362   22.094   99.850   5.2986  112.062   4.7801 -12.21263 7.136156 
1 1 1    4    7   23 o  289.242   3.0767  1726.98   36.298  1733.47   55.674  1722.18   47.870  289.683   4.6598  288.800   4.0189 0.8827209 6.153433 
1 1 1    4    7   24 o  158.885   2.9226  521.279   19.147  515.949   26.723  526.903   27.448  158.053   4.0993  159.718   4.1667 -1.664841 5.845111 
1 1 1    4    7   25 o  307.824   3.3438  1958.79   42.452  1980.70   60.252  1937.19   59.822  309.535   4.7195  306.114   4.7382 3.421814 6.687604 
1 1 1    4    7   26 o  126.698   3.2713  331.830   17.094  333.877   24.095  329.757   24.254  127.094   4.5967  126.303   4.6559 0.7904053 6.542688 
1 1 1    4    7   27 o  164.154   3.1153  556.306   20.947  550.768   27.963  563.386   31.619  163.247   4.1531  165.061   4.6445 -1.814270 6.230531 
1 1 1    4    7   28 o  108.325   4.1997  241.797   18.692  257.968   27.957  228.723   25.137  111.571   6.0754  105.079   5.8000 6.491661 8.399455 
1 1 1    4    7   29 o  147.929   3.5073  452.564   21.389  466.116   30.809  439.954   29.719  150.063   4.9778  145.795   4.9422 4.268280 7.014580 
1 1 1    4    7   30 o   26.971   8.0618   1.5840   15.290   3.1716   23.360   0.3940   20.225   28.312   11.872   25.629   10.910 2.682898 16.12350 
1 1 1    4    7   31 o  102.184   4.0717  216.562   17.156  212.086   24.360  220.967   24.165  101.128   5.8403  103.240   5.6751 -2.111702 8.143433 
1 1 1    4    7   32 o   80.963   5.4447  138.076   17.951  125.181   26.809  148.557   24.169   77.418   8.3961   84.507   6.9343 -7.088890 10.88939 
1 1 1    4    7   33 o   37.417   9.2265   26.589   17.668   20.027   24.846   33.302   25.129   34.686   12.941   40.149   13.155 -5.463242 18.45294 
1 1 1    4    7   34 o  136.631   3.6718  387.214   20.677  408.280   29.614  367.175   28.882  140.267   5.1188  132.995   5.2654 7.272308 7.343499 
1 1 1    4    7   35 o   38.011   9.0098   28.193   17.343   14.797   24.296   42.108   24.763   32.315   12.613   43.708   12.870 -11.39374 18.01969 
1 1 1    4    7   36 o   71.935   7.9059  110.603   22.527  142.999   34.193   85.757   29.945   81.859   10.128   62.011   12.143 19.84723 15.81176 
1 1 1    4    7   37 o   30.138   8.5284   3.8088   17.537 -16.6590   23.972   27.379   25.724   23.213   10.716   37.063   13.270 -13.85062 17.05686 
1 1 1    4    7   38 o   49.094   8.5940   55.466   17.448   66.693   25.169   45.079   24.210   54.004   11.643   44.184   12.644 9.819347 17.18806 
1 1 1    4    7   39 o   31.636   8.8131   15.425   16.915   16.599   24.011   14.268   23.833   32.077   12.533   31.194   12.394 0.8828430 17.62626 
1 1 1    4    7   40 o   62.376   8.6342   91.427   21.621   96.356   29.188   85.434   32.185   65.407   10.820   59.346   13.459 6.061142 17.26847 
1 1 1    4    7   41 o   35.200   8.9349   22.865   18.450   44.814   25.521  -1.1687   26.705   42.998   13.160   27.403   12.089 15.59468 17.86986 
1 1 1    4    7   42 o   37.935   8.9869   33.306   16.757   26.340   23.577   40.416   23.820   34.891   12.676   40.978   12.743 -6.087017 17.97385 
1 1 1    4    7   43 o   31.015   9.2575   11.154   20.471   4.2903   29.724   17.348   28.236   29.530   12.898   32.500   13.283 -2.970324 18.51504 
1 1 1    4    7   44 o   25.830   7.9076  -2.5602   16.569   17.120   23.649 -21.5358   23.222   30.722   12.300   20.938   9.9416 9.784065 15.81517 
1 1 1    4    7   45 o   39.872   9.5726   41.868   18.724   42.369   28.148   41.470   25.076   39.946   13.919   39.799   13.146 0.1471825 19.14521 
1 1 1    4    7   46 o   60.835   6.9645   89.021   16.769   72.247   23.657  105.959   23.774   53.699   11.050   67.971   8.4803 -14.27170 13.92905 
1 1 1    4    7   47 f   31.302   9.5302   18.287   22.479   9.1730   31.438   27.820   32.154   29.023   12.943   33.582   13.993 -4.559685 19.06050 
1 1 1    4    7   48 o   31.740   8.9669   24.998   17.729   24.296   24.711   25.743   25.451   31.463   12.581   32.018   12.780 -0.5553818 17.93376 
1 1 1    4    7   49 o   25.641   8.4153  -2.8889   21.751 -17.6238   32.037   9.7104   29.625   23.693   11.366   27.588   12.413 -3.894157 16.83060 
1 1 1    4    7   50 o   27.525   8.7534   6.1613   22.359 -23.0993   32.732   31.761   30.616   22.810   11.075   32.239   13.558 -9.428844 17.50673 
1 1 1    4    7   51 o   36.727   10.920   60.061   28.272   56.526   43.345   62.678   37.299   35.384   15.513   38.070   15.374 -2.685574 21.84041 
1 1 1    4    8    0 o  190.925   1.9823  752.387   22.065  752.387   22.065  752.387   22.065  190.925   2.8034  190.925   2.8034 0.000000 0.000000 
1 1 1    4    8    1 o  293.791   2.6549  1782.62   31.871  1772.86   48.428  1790.07   42.329  293.065   4.0065  294.518   3.4847 -1.453156 5.309892 
1 1 1    4    8    2 o  310.219   2.7500  1985.88   34.812  1989.68   53.278  1983.05   45.986  310.457   4.1608  309.980   3.5969 0.4773254 5.500030 
1 1 1    4    8    3 o  163.611   2.1736  550.792   14.645  580.135   21.459  525.213   20.036  167.677   3.1029  159.544   3.0448 8.132736 4.347293 
1 1 1    4    8    4 o  125.183   2.0901  323.313   10.790  328.833   15.313  317.869   15.207  126.244   2.9410  124.121   2.9706 2.123123 4.180170 
1 1 1    4    8    5 o  226.270   2.3614  1055.87   21.777  1052.47   28.654  1060.52   33.507  225.850   3.0761  226.691   3.5837 -0.8403168 4.722865 
1 1 1    4    8    6 o  122.722   2.2700  310.748   11.490  314.292   16.294  307.243   16.204  123.418   3.2009  122.026   3.2197 1.392120 4.540074 
1 1 1    4    8    7 o  180.509   2.7291  674.526   19.839  662.723   31.539  682.255   25.521  179.183   4.2676  181.835   3.4029 -2.651886 5.458236 
1 1 1    4    8    8 o  408.192   3.9857  3449.13   66.935  3676.64   93.817  3213.25   95.528  421.959   5.3907  394.425   5.8722 27.53455 7.971353 
1 1 1    4    8    9 o  413.900   3.6711  3532.28   62.586  3614.74   91.306  3459.20   85.956  418.443   5.2905  409.357   5.0911 9.085754 7.342257 
1 1 1    4    8   10 o   57.171   3.2997   69.573   7.1522   73.234   8.6929   61.900   12.583   59.581   3.5374   54.761   5.5713 4.819622 6.599492 
1 1 1    4    8   11 o  379.062   3.0113  2964.05   47.073  2938.70   65.920  2990.42   67.241  377.409   4.2349  380.714   4.2823 -3.304749 6.022611 
1 1 1    4    8   12 o  148.454   2.3352  454.524   14.296  464.365   20.378  444.985   20.063  150.036   3.2930  146.872   3.3119 3.164474 4.670400 
1 1 1    4    8   13 o  160.738   2.6014  535.562   17.022  516.317   26.015  549.971   22.509  158.195   3.9872  163.280   3.3424 -5.085266 5.202818 
1 1 1    4    8   14 o  274.160   2.8166  1553.16   31.511  1567.96   41.745  1533.57   48.044  275.690   3.6713  272.632   4.2726 3.058136 5.633268 
1 1 1    4    8   15 o  486.889   4.1959  4893.97   84.259  4906.35  119.450  4881.71  118.871  487.501   5.9408  486.276   5.9269 1.224457 8.391753 
1 1 1    4    8   16 o   76.177   3.7032  117.406   11.379   86.917   15.067  157.884   17.361   64.888   5.6298   87.466   4.8124 -22.57803 7.406335 
1 1 1    4    8   17 o  246.127   2.5393  1249.75   25.776  1241.59   36.258  1258.10   36.652  245.314   3.5836  246.939   3.5986 -1.625214 5.078618 
1 1 1    4    8   18 o  121.983   3.0395  307.932   15.111  301.487   23.097  312.754   19.980  120.856   4.6337  123.109   3.9349 -2.253113 6.078999 
1 1 1    4    8   19 o  230.625   2.5640  1095.39   24.358  1056.47   33.429  1139.43   35.564  226.269   3.5821  234.981   3.6695 -8.711716 5.128045 
1 1 1    4    8   20 o  282.316   3.1586  1644.75   36.770  1613.80   51.300  1677.45   52.730  279.587   4.4487  285.045   4.4852 -5.457855 6.317233 
1 1 1    4    8   21 o  269.637   2.7565  1500.48   30.652  1482.93   42.963  1518.67   43.745  268.032   3.8863  271.242   3.9103 -3.209534 5.513050 
1 1 1    4    8   22 o  110.008   3.4951  249.788   15.851  240.356   22.068  259.840   22.783  107.864   4.9604  112.152   4.9253 -4.288147 6.990265 
1 1 1    4    8   23 o   89.637   4.0815  166.129   15.077  157.175   21.151  175.378   21.498   87.178   5.8824   92.097   5.6595 -4.919846 8.162912 
1 1 1    4    8   24 o   94.727   5.0739  176.120   19.054  152.772   23.354  222.607   32.954   85.877   6.5936  103.577   7.7139 -17.70055 10.14787 
1 1 1    4    8   25 o  102.383   3.7016  216.712   15.618  229.549   22.340  204.441   21.841  105.352   5.1413   99.413   5.3268 5.938972 7.403271 
1 1 1    4    8   26 o  179.849   2.8307  668.269   20.997  673.725   29.668  662.794   29.720  180.586   3.9833  179.111   4.0231 1.474152 5.661454 
1 1 1    4    8   27 o  163.961   2.9447  555.433   19.906  576.253   28.443  535.442   27.870  166.975   4.1300  160.947   4.1985 6.027344 5.889328 
1 1 1    4    8   28 o   50.894   8.0008   57.096   16.315   50.025   24.408   62.808   21.937   47.852   12.300   53.935   10.236 -6.083218 16.00158 
1 1 1    4    8   29 o  128.609   3.5883  340.043   18.960  315.683   25.482  370.253   28.378  123.492   5.0030  133.725   5.1451 -10.23397 7.176505 
1 1 1    4    8   30 o   68.666   5.5797   98.480   15.692   84.425   22.007  113.019   22.382   63.623   8.3863   73.708   7.3623 -10.08494 11.15946 
1 1 1    4    8   31 o   80.130   5.0587  133.556   16.704  126.210   23.460  141.110   23.788   77.881   7.3035   82.379   7.0014 -4.498665 10.11733 
1 1 1    4    8   32 o  136.339   3.5836  384.738   20.107  350.273   27.955  421.676   28.940  130.001   5.2138  142.677   4.9180 -12.67558 7.167276 
1 1 1    4    8   33 o   31.318   9.3021   3.5873   20.728   16.254   25.063 -23.8301   36.872   33.343   12.866   29.292   13.438 4.050915 18.60420 
1 1 1    4    8   34 o  113.432   4.1579  267.564   19.448  272.221   27.888  263.155   27.134  114.387   5.9112  112.477   5.8490 1.910652 8.315832 
1 1 1    4    8   35 o  109.203   4.3385  248.547   19.520  264.660   27.920  233.140   27.301  112.689   6.0072  105.718   6.2614 6.970993 8.677083 
1 1 1    4    8   36 o   74.573   7.2030  118.306   21.945  125.926   33.811  112.759   28.847   76.479   10.719   72.667   9.6249 3.811646 14.40603 
1 1 1    4    8   37 o   67.353   6.3013   97.116   17.487   99.188   24.368   94.916   25.108   68.159   8.6684   66.546   9.1478 1.612541 12.60257 
1 1 1    4    8   38 o   70.455   6.5817  107.430   18.763  135.745   27.374   82.338   25.769   79.541   8.3440   61.368   10.181 18.17282 13.16341 
1 1 1    4    8   39 o   46.962   8.6448   51.459   16.905   50.756   23.638   52.195   24.185   46.655   12.160   47.269   12.291 -0.6141319 17.28959 
1 1 1    4    8   40 o   27.677   8.5068   1.5666   17.990   3.7791   26.989  -0.2027   24.134   28.849   12.447   26.504   11.599 2.344723 17.01356 
1 1 1    4    8   41 o   41.313   9.0165   41.056   17.018   45.896   23.502   35.720   24.676   43.623   12.449   39.003   13.046 4.620106 18.03290 
1 1 1    4    8   42 o   26.933   8.2060   3.0647   16.646   8.8374   23.780  -2.4822   23.310   28.604   11.985   25.262   11.212 3.341984 16.41207 
1 1 1    4    8   43 o   30.182   9.1053   6.5443   20.382   20.826   29.835  -5.9551   27.911   33.907   13.730   26.458   11.963 7.448845 18.21060 
1 1 1    4    8   44 o   24.963   7.8791  -4.1664   16.779   6.6230   24.192 -14.1684   23.293   27.624   11.850   22.302   10.387 5.321835 15.75816 
1 1 1    4    8   45 o   32.893   9.1581   23.239   18.465   31.437   26.478   15.478   25.763   35.599   13.344   30.188   12.547 5.411358 18.31624 
1 1 1    4    8   46 o   32.462   8.6693   25.185   15.876   27.412   22.830   23.099   22.091   33.346   12.412   31.579   12.107 1.766844 17.33869 
1 1 1    4    8   47 o   37.217   9.6864   34.540   20.660   65.709   32.216   12.769   26.925   45.795   14.889   28.639   12.394 17.15616 19.37285 
1 1 1    4    8   48 o   35.533   9.2060   36.179   17.828   30.564   26.168   41.043   24.356   33.472   13.082   37.594   12.956 -4.122456 18.41206 
1 1 1    4    8   49 o   27.816   8.8919   9.5964   21.807   16.025   31.564   3.7252   30.164   29.188   12.996   26.445   12.140 2.743113 17.78378 
1 1 1    4    8   50 o   28.558   9.0344   17.401   21.845   17.042   31.328   17.741   30.478   28.539   12.809   28.577   12.744 -0.3778458E-01 18.06871 
1 1 1    4    8   51 o   28.550   9.3252   15.863   26.804  -8.6654   41.263   33.769   35.256   25.705   12.470   31.394   13.868 -5.688944 18.65033 
1 1 1    4    9    0 o  309.066   2.9358  1971.89   52.902  1971.89   52.902  1971.89   52.902  309.066   4.1518  309.066   4.1518 0.000000 0.000000 
1 1 1    4    9    1 o  268.076   3.0315  1478.52   32.655  1461.65   41.604  1505.58   52.703  266.121   3.7905  270.030   4.7321 -3.908844 6.063037 
1 1 1    4    9    2 o  253.624   3.5237  1367.21   30.762  1257.82   63.509  1400.74   35.162  246.703   6.2416  260.545   3.2721 -13.84244 7.047310 
1 1 1    4    9    3 o  300.873   4.3583  1867.64   50.625  1879.31   89.044  1862.06   61.539  301.459   7.1616  300.288   4.9687 1.170837 8.716501 
1 1 1    4    9    4 o  231.949   2.8269  1108.66   26.394  1102.43   33.776  1118.44   42.299  231.135   3.5430  232.764   4.4061 -1.629623 5.653893 
1 1 1    4    9    5 o  416.804   3.4145  3582.83   57.943  3562.16   75.981  3611.55   89.575  415.407   4.4347  418.201   5.1932 -2.793304 6.829041 
1 1 1    4    9    6 f  172.918   2.2145  617.085   15.617  618.152   20.612  615.646   23.928  173.100   2.8871  172.736   3.3586 0.3629761 4.428984 
1 1 1    4    9    7 o  371.289   3.1500  2850.71   47.969  2900.65   64.827  2790.27   71.310  374.907   4.1925  367.670   4.7025 7.236664 6.300024 
1 1 1    4    9    8 o  332.912   3.5055  2294.44   47.516  2332.48   62.677  2243.03   72.862  336.191   4.5202  329.633   5.3593 6.557770 7.010977 
1 1 1    4    9    9 o  253.848   2.5914  1330.39   26.887  1337.13   35.757  1321.63   40.786  254.594   3.4052  253.102   3.9071 1.492523 5.182734 
1 1 1    4    9   10 o  425.526   3.5164  3729.98   60.840  3698.68   79.463  3774.34   94.581  423.393   4.5504  427.659   5.3622 -4.265839 7.032728 
1 1 1    4    9   11 o  332.571   2.8751  2274.24   37.901  2254.36   47.343  2309.73   63.248  330.575   3.4723  334.567   4.5835 -3.992523 5.750293 
1 1 1    4    9   12 o  374.027   3.0144  2886.41   46.500  2878.55   65.529  2894.38   65.996  373.515   4.2536  374.540   4.2722 -1.024841 6.028713 
1 1 1    4    9   13 o  571.629   4.4496  6750.78  104.026  6706.27  157.393  6785.29  138.618  569.915   6.6959  573.343   5.8619 -3.428833 8.899285 
1 1 1    4    9   14 o  217.643   3.1145  976.207   27.207  972.178   34.657  982.680   43.922  217.073   3.8710  218.213   4.8802 -1.139908 6.229003 
1 1 1    4    9   15 o  221.132   2.6598  1003.91   23.850  982.688   30.863  1035.39   37.579  218.253   3.4285  224.011   4.0674 -5.758774 5.319623 
1 1 1    4    9   16 o  240.630   2.4997  1194.59   24.808  1193.23   35.053  1195.96   35.116  240.493   3.5339  240.768   3.5362 -0.2747192 4.999347 
1 1 1    4    9   17 o  141.443   2.5690  412.747   14.985  410.067   21.017  415.519   21.372  140.976   3.6146  141.910   3.6514 -0.9332275 5.137939 
1 1 1    4    9   18 o   89.874   3.8030  166.334   14.073  174.674   20.654  159.108   19.227   91.969   5.4451   87.778   5.3107 4.190514 7.606083 
1 1 1    4    9   19 o  374.637   3.0857  2895.36   47.649  2845.98   66.007  2949.10   68.855  371.309   4.3101  377.966   4.4169 -6.657288 6.171376 
1 1 1    4    9   20 o  270.904   2.9104  1514.53   32.237  1511.36   42.842  1518.66   48.945  270.596   3.8386  271.212   4.3756 -0.6156616 5.820738 
1 1 1    4    9   21 o  138.199   2.9685  394.303   16.909  394.972   24.378  393.683   23.472  138.309   4.2736  138.089   4.1213 0.2198792 5.936999 
1 1 1    4    9   22 o  234.122   2.7039  1130.91   26.100  1105.24   36.286  1158.43   37.568  231.373   3.8024  236.872   3.8454 -5.498672 5.407895 
1 1 1    4    9   23 o   81.490   4.3593  137.441   14.645  132.288   20.644  142.663   20.780   79.948   6.2607   83.033   6.0678 -3.084793 8.718626 
1 1 1    4    9   24 o  227.048   3.8875  1061.98   36.192  1026.04   48.295  1108.02   54.661  222.717   5.2576  231.379   5.7278 -8.661575 7.774937 
1 1 1    4    9   25 o   39.831   7.8424   33.910   13.348   37.508   19.654   30.829   18.185   41.656   11.198   38.006   10.983 3.649666 15.68489 
1 1 1    4    9   26 o   63.980   5.2879   84.764   13.932   91.379   20.290   78.862   19.164   66.339   7.4155   61.621   7.5405 4.717728 10.57584 
1 1 1    4    9   27 o  120.717   3.8959  301.640   19.370  303.359   28.188  300.102   26.662  121.031   5.6468  120.404   5.3689 0.6271210 7.791715 
1 1 1    4    9   28 o  223.095   2.9726  1026.96   27.133  1012.71   36.040  1045.61   41.223  221.346   3.9477  224.844   4.4452 -3.497238 5.945139 
1 1 1    4    9   29 o  214.523   3.0497  950.582   26.811  941.510   35.865  962.073   40.366  213.397   4.0749  215.648   4.5385 -2.251495 6.099405 
1 1 1    4    9   30 o  111.983   4.0236  260.872   18.466  251.164   27.413  268.937   24.985  110.032   6.0406  113.934   5.3168 -3.902733 8.047175 
1 1 1    4    9   31 o   54.446   7.4133   64.649   16.122   40.030   22.437   90.929   23.182   42.914   12.135   65.978   8.5188 -23.06361 14.82658 
1 1 1    4    9   32 o  162.223   3.7735  551.367   24.745  514.138   38.303  578.036   32.419  157.376   5.9011  167.069   4.7047 -9.693756 7.546956 
1 1 1    4    9   33 o   56.802   9.2834   70.200   21.662   47.496   29.112   98.365   32.425   46.614   14.010   66.990   12.184 -20.37553 18.56690 
1 1 1    4    9   34 o   88.016   5.1048  162.138   18.280  198.763   26.521  128.991   25.231   97.596   6.5886   78.437   7.7990 19.15878 10.20956 
1 1 1    4    9   35 o   67.705   6.6964   97.089   18.525  115.283   26.835   80.524   25.605   73.885   8.8061   61.525   10.091 12.36058 13.39278 
1 1 1    4    9   36 o   93.171   4.9191  182.503   18.895  189.612   27.160  175.837   26.302   94.933   6.9367   91.409   6.9766 3.523788 9.838196 
1 1 1    4    9   37 o   97.795   4.6829  201.635   18.887  202.583   26.577  200.667   26.846   98.044   6.5723   97.547   6.6726 0.4970169 9.365838 
1 1 1    4    9   38 o   76.220   6.2141  125.197   19.513  127.758   28.381  122.901   26.872   76.897   8.9486   75.544   8.6246 1.353310 12.42822 
1 1 1    4    9   39 o  119.586   4.0504  302.078   19.885  266.661   27.863  338.846   28.389  112.294   6.0159  126.878   5.4250 -14.58403 8.100727 
1 1 1    4    9   40 o   30.185   8.7822   11.612   17.600   12.164   25.097   11.078   24.689   30.434   12.490   29.936   12.349 0.4981232 17.56450 
1 1 1    4    9   41 o   46.974   8.1455   56.398   19.259   88.764   24.600   5.1559   30.953   63.259   9.4287   30.689   13.285 32.57005 16.29109 
1 1 1    4    9   42 o   35.119   8.5674   25.952   16.495   44.387   23.153   6.9491   23.507   42.444   12.429   27.794   11.795 14.65006 17.13474 
1 1 1    4    9   43 o   21.751   7.1681 -17.7869   16.077 -31.3587   22.717  -4.1685   22.757   19.180   9.2923   24.322   10.917 -5.142506 14.33614 
1 1 1    4    9   44 f   76.894   5.5968  131.706   17.675  119.188   25.059  144.099   24.934   72.952   8.3285   80.836   7.4788 -7.884354 11.19355 
1 1 1    4    9   45 o   21.361   7.1786 -21.5591   17.271 -12.6002   24.764 -30.0442   24.100   22.954   10.698   19.768   9.5755 3.186806 14.35724 
1 1 1    4    9   46 o   43.966   8.7595   51.605   17.687   74.918   25.662   30.507   24.412   53.522   11.930   34.409   12.829 19.11314 17.51892 
1 1 1    4    9   47 o   30.561   8.6672   18.328   17.942  -0.8883   25.801   36.321   24.966   25.095   11.408   36.028   13.051 -10.93267 17.33432 
1 1 1    4    9   48 o   27.696   8.2344   4.5207   19.205   34.947   25.008 -39.2133   29.983   34.775   12.981   20.618   10.134 14.15669 16.46881 
1 1 1    4    9   49 o   31.279   9.3188   17.208   22.295   53.432   33.176 -12.6255   30.108   38.910   14.856   23.648   11.255 15.26191 18.63761 
1 1 1    4    9   50 o   27.271   8.7960   11.928   21.840   16.558   32.225   7.9935   29.703   28.294   12.818   26.249   12.049 2.045132 17.59197 
1 1 1    4   10    0 o   82.476   2.1857  140.901   10.481  140.901   10.481  140.901   10.481   82.476   3.0910   82.476   3.0910 0.000000 0.000000 
1 1 1    4   10    1 o  511.109   4.0036  5382.59   83.083  5468.80  129.917  5322.93  108.070  514.495   6.1223  507.722   5.1607 6.773590 8.007276 
1 1 1    4   10    2 f  369.489   3.7489  2778.70   54.669  2685.15   67.541  2956.47   93.099  360.665   4.5404  378.313   5.9666 -17.64871 7.497730 
1 1 1    4   10    3 o  240.618   2.5712  1193.80   25.498  1173.42   35.261  1216.14   36.914  238.469   3.5851  242.768   3.6867 -4.298416 5.142443 
1 1 1    4   10    4 o  213.604   2.6807  947.422   23.429  999.710   31.765  885.035   34.697  220.118   3.4989  207.090   4.0623 13.02789 5.361369 
1 1 1    4   10    5 o  277.041   3.1278  1572.16   34.591  1538.26   43.508  1630.40   57.031  273.037   3.8635  281.044   4.9201 -8.007050 6.255682 
1 1 1    4   10    6 o  489.392   4.1382  4939.59   83.411  4849.17  114.541  5041.67  121.707  484.641   5.7303  494.142   5.9717 -9.501495 8.276314 
1 1 1    4   10    7 o  283.849   2.6796  1666.86   31.163  1705.90   42.013  1619.12   46.465  287.561   3.5423  280.138   4.0215 7.423828 5.359161 
1 1 1    4   10    8 o  536.441   4.5052  5996.90   92.378  6093.81  111.858  5789.02  163.822  543.427   4.9907  529.455   7.5020 13.97253 9.010401 
1 1 1    4   10    9 o  255.892   2.6048  1351.09   27.217  1352.68   36.050  1348.99   41.506  256.073   3.4133  255.711   3.9355 0.3627472 5.209513 
1 1 1    4   10   10 o  117.654   2.4908  289.148   11.887  309.578   15.802  262.518   18.040  122.506   3.1274  112.802   3.8776 9.703445 4.981628 
1 1 1    4   10   11 o  226.538   2.7595  1057.75   25.766  1086.11   37.261  1031.76   35.669  229.444   3.9374  223.632   3.8672 5.812103 5.518931 
1 1 1    4   10   12 o  645.694   4.7050  8612.79  121.430  8626.64  153.876  8589.92  197.700  646.479   5.7710  644.908   7.4326 1.571411 9.410017 
1 1 1    4   10   13 o  106.025   2.5486  231.835   11.140  241.544   15.902  222.478   15.611  108.205   3.5632  103.845   3.6448 4.359253 5.097144 
1 1 1    4   10   14 o  752.152   6.7336 11712.00  205.489 11632.61  320.254 11767.56  267.912  749.787   10.356  754.516   8.6091 -4.729187 13.46711 
1 1 1    4   10   15 o  248.062   2.4902  1269.51   25.477  1273.49   36.083  1265.55   35.977  248.450   3.5213  247.674   3.5219 0.7761993 4.980309 
1 1 1    4   10   16 o  331.886   2.8404  2272.79   38.879  2286.53   55.337  2259.39   54.636  332.876   4.0306  330.896   4.0034 1.980072 5.680899 
1 1 1    4   10   17 o  183.976   2.4715  698.290   18.752  705.718   26.759  691.122   26.286  184.937   3.5082  183.015   3.4824 1.921677 4.943098 
1 1 1    4   10   18 o  164.603   2.9636  559.465   20.111  542.865   28.525  575.870   28.358  162.172   4.2647  167.034   4.1162 -4.862503 5.927114 
1 1 1    4   10   19 o  201.112   2.5722  834.746   21.334  848.174   30.227  821.417   30.115  202.724   3.6151  199.499   3.6600 3.225220 5.144331 
1 1 1    4   10   20 o  280.615   2.9610  1624.41   33.873  1617.09   44.589  1634.40   52.088  279.892   3.8626  281.339   4.4889 -1.446625 5.921994 
1 1 1    4   10   21 o  179.565   2.9805  665.175   21.793  669.894   33.663  661.769   28.594  180.094   4.5320  179.036   3.8723 1.058197 5.960977 
1 1 1    4   10   22 o  265.149   2.7469  1451.66   30.039  1457.44   42.666  1445.98   42.299  265.672   3.8938  264.627   3.8756 1.044891 5.493779 
1 1 1    4   10   23 o  408.921   3.5885  3448.62   59.638  3404.53   77.729  3511.72   92.989  405.844   4.6436  411.998   5.4723 -6.154449 7.176988 
1 1 1    4   10   24 o  245.811   3.3136  1237.73   31.842  1284.32   55.036  1214.28   39.039  249.167   5.3554  242.455   3.9040 6.712036 6.627292 
1 1 1    4   10   25 o  247.269   2.9438  1262.84   29.793  1258.92   39.723  1267.88   45.042  246.861   3.9015  247.678   4.4093 -0.8167877 5.887537 
1 1 1    4   10   26 o   83.158   4.3079  143.321   14.774  141.247   20.921  145.383   20.865   82.555   6.1443   83.762   6.0397 -1.207008 8.615735 
1 1 1    4   10   27 o   91.948   4.7382  175.458   17.914  175.251   26.371  175.635   24.412   91.875   6.9593   92.020   6.4321 -0.1456985 9.476439 
1 1 1    4   10   28 o  183.696   2.9027  696.391   21.973  664.210   30.335  731.912   31.870  179.239   4.1034  188.152   4.1068 -8.912781 5.805491 
1 1 1    4   10   29 o   31.863   8.2180   17.447   14.055   20.195   20.228   14.882   19.544   33.156   11.778   30.571   11.463 2.584621 16.43596 
1 1 1    4   10   30 o  159.328   3.5456  525.388   23.266  531.502   33.905  519.948   31.986  160.188   5.1317  158.469   4.8939 1.719238 7.091174 
1 1 1    4   10   31 o   96.215   4.4193  192.232   17.513  178.791   24.512  206.246   25.029   92.763   6.4068   99.667   6.0888 -6.904022 8.838607 
1 1 1    4   10   32 o   76.324   6.1264  123.701   18.968  145.453   26.410  100.530   27.259   83.478   7.6707   69.171   9.5548 14.30683 12.25286 
1 1 1    4   10   33 o   58.709   9.3323   77.261   21.933   80.944   29.253   72.532   33.147   60.579   12.131   56.840   14.185 3.738308 18.66452 
1 1 1    4   10   34 o  106.284   4.4194  235.615   19.349  251.174   27.573  220.518   27.160  109.772   6.0902  102.797   6.4059 6.975090 8.838863 
1 1 1    4   10   35 o   32.732   9.4695   9.6693   20.221   18.180   30.983   3.3545   26.690   35.807   14.161   29.658   12.576 6.149670 18.93909 
1 1 1    4   10   36 o   81.946   5.4283  142.604   18.211  163.275   25.894  122.376   25.616   87.985   7.1356   75.907   8.1821 12.07805 10.85655 
1 1 1    4   10   37 o  102.774   4.5301  223.160   19.168  211.919   27.423  233.897   26.802  100.155   6.6386  105.393   6.1658 -5.238388 9.060245 
1 1 1    4   10   38 o   23.706   7.7283 -16.8812   17.710  -8.0846   25.047 -25.6764   25.045   25.438   11.433   21.974   10.402 3.463591 15.45651 
1 1 1    4   10   39 o   62.805   6.9812   89.113   17.220   66.952   23.961  112.784   24.764   53.600   11.199   72.011   8.3379 -18.41093 13.96236 
1 1 1    4   10   40 o   51.614   8.1187   64.078   17.413   42.974   25.445   82.666   23.880   42.196   13.178   61.032   9.4866 -18.83533 16.23736 
1 1 1    4   10   41 o   41.367   10.024   40.485   20.667   33.519   28.126   48.658   30.468   38.410   13.862   44.324   14.483 -5.913280 20.04768 
1 1 1    4   10   42 o   39.741   9.8680   38.601   20.093   35.013   29.441   41.729   27.489   38.516   14.139   40.966   13.770 -2.449841 19.73608 
1 1 1    4   10   43 o   29.152   8.5264   12.043   16.802   7.6128   24.188   16.175   23.358   27.961   11.918   30.343   12.197 -2.382278 17.05287 
1 1 1    4   10   44 o   64.949   6.7876   99.211   17.299   76.996   24.381  121.734   24.549   56.204   10.911   73.694   8.0769 -17.48929 13.57511 
1 1 1    4   10   45 o   50.245   8.4541   64.317   17.387   50.183   23.322   82.001   26.087   43.542   12.393   56.948   11.502 -13.40631 16.90823 
1 1 1    4   10   46 o   23.778   7.7352  -6.5378   17.442   0.7943   25.608 -12.8822   23.821   25.539   11.511   22.017   10.335 3.522161 15.47039 
1 1 1    4   10   47 o   19.582   6.7101 -27.3481   16.769 -21.3680   24.099 -32.9620   23.349   20.584   9.8700   18.579   9.0932 2.004997 13.42028 
1 1 1    4   10   48 o   35.180   10.916   9.7208   28.442 -26.5055   33.380  105.711   54.336   23.116   11.214   47.245   18.732 -24.12873 21.83205 
1 1 1    4   10   49 o   28.376   9.0207   13.748   22.082   16.961   31.512   10.648   30.953   29.069   12.961   27.683   12.550 1.386236 18.04137 
1 1 1    4   10   50 o   20.562   7.1494 -32.4434   21.344 -47.0895   31.523 -20.0434   29.005   19.578   9.7567   21.545   10.453 -1.966959 14.29873 
1 1 1    4   11    0 o  214.473   2.9626  949.981   37.030  949.981   37.030  949.981   37.030  214.473   4.1897  214.473   4.1897 0.000000 0.000000 
1 1 1    4   11    1 o  309.544   2.9480  1976.78   37.629  1957.92   52.585  1996.56   53.870  308.033   4.1390  311.055   4.1990 -3.021698 5.895985 
1 1 1    4   11    2 o  183.926   2.2758  697.891   17.263  696.573   24.564  699.177   24.265  183.754   3.2412  184.098   3.1956 -0.3441162 4.551613 
1 1 1    4   11    3 f  433.742   4.1402  3898.54   73.453  4008.25   98.571  3761.55  110.149  440.664   5.4234  426.821   6.2570 13.84222 8.280343 
1 1 1    4   11    4 o  362.684   3.2815  2713.47   49.071  2682.86   68.386  2745.96   70.455  360.578   4.5984  364.789   4.6828 -4.211761 6.563043 
1 1 1    4   11    5 o  594.505   5.4061  7313.49  130.625  7217.16  202.079  7382.63  171.201  591.057   8.2895  597.953   6.9418 -6.895630 10.81221 
1 1 1    4   11    6 o  244.212   2.4596  1229.46   24.543  1224.38   32.531  1236.17   37.394  243.632   3.2374  244.792   3.7037 -1.159897 4.919184 
1 1 1    4   11    7 o  384.745   4.6415  3133.85   68.690  3286.84   84.397  2833.65  118.220  399.092   5.1273  370.397   7.7386 28.69540 9.283023 
1 1 1    4   11    8 o  318.167   3.1465  2105.38   37.702  2130.06   45.075  2047.91   68.791  321.334   3.4011  315.001   5.2948 6.332336 6.293066 
1 1 1    4   11    9 o  163.537   3.2039  548.542   21.434  527.445   28.325  576.812   32.788  159.885   4.2953  167.190   4.7549 -7.305176 6.407714 
1 1 1    4   11   10 o  599.549   4.3980  7434.95  105.842  7483.96  135.204  7357.39  170.099  602.179   5.4438  596.920   6.9091 5.258484 8.796025 
1 1 1    4   11   11 o  425.797   3.5248  3740.14   61.200  3732.33   80.661  3750.74   93.949  425.295   4.5984  426.298   5.3434 -1.002319 7.049596 
1 1 1    4   11   12 o   65.425   3.2264   93.785   7.9779  104.558   9.8686   73.465   13.554   71.192   3.3609   59.658   5.5084 11.53471 6.452744 
1 1 1    4   11   13 f   74.925   3.3390  113.330   10.203   98.381   13.296  134.743   15.913   69.046   4.6689   80.803   4.7748 -11.75732 6.678092 
1 1 1    4   11   14 o  354.670   3.5639  2589.61   49.018  2616.12   85.568  2576.67   59.802  355.966   5.8283  353.375   4.1031 2.590485 7.127716 
1 1 1    4   11   15 o  292.596   2.8926  1767.60   34.503  1772.77   45.501  1760.61   52.927  293.115   3.7637  292.077   4.3935 1.037262 5.785208 
1 1 1    4   11   16 o  360.264   2.9732  2678.46   44.174  2659.00   61.942  2698.60   63.015  358.934   4.1842  361.594   4.2253 -2.660156 5.946465 
1 1 1    4   11   17 o  348.998   3.1666  2519.79   45.347  2456.62   67.159  2572.73   61.478  344.949   4.7205  353.047   4.2221 -8.098175 6.333125 
1 1 1    4   11   18 o  140.823   2.7285  409.392   15.841  411.938   22.121  406.712   22.695  141.275   3.7964  140.372   3.9199 0.9028625 5.456958 
1 1 1    4   11   19 o  158.434   2.6983  517.615   17.623  539.460   25.359  497.211   24.509  161.664   3.8032  155.203   3.8287 6.460526 5.396629 
1 1 1    4   11   20 o  298.149   2.8087  1834.90   34.533  1856.44   49.354  1814.23   48.336  299.862   3.9906  296.436   3.9534 3.425781 5.617323 
1 1 1    4   11   21 o  118.775   3.6839  291.844   18.002  287.611   26.297  295.577   24.696  117.954   5.4053  119.597   5.0066 -1.642860 7.367753 
1 1 1    4   11   22 o  103.994   3.4913  224.752   14.888  200.002   21.285  248.460   20.832   98.343   5.2476  109.646   4.6066 -11.30305 6.982692 
1 1 1    4   11   23 o  196.059   3.0720  794.335   24.838  793.963   34.854  794.718   35.405  196.016   4.3112  196.103   4.3774 -0.8703613E-01 6.143917 
1 1 1    4   11   24 o   54.707   6.4334   63.395   13.979   62.303   21.512   64.192   18.390   53.819   10.061   55.595   8.0204 -1.775578 12.86683 
1 1 1    4   11   25 o   58.970   6.6762   70.374   15.561   56.522   19.794   92.782   25.176   51.222   9.7251   66.718   9.1493 -15.49618 13.35237 
1 1 1    4   11   26 o  113.661   3.4298  266.945   16.069  277.266   23.200  257.428   22.278  115.770   4.8588  111.553   4.8421 4.217278 6.859615 
1 1 1    4   11   27 o   76.537   4.9921  120.434   15.672  109.363   20.883  134.706   23.713   72.559   6.9782   80.515   7.1406 -7.955795 9.984212 
1 1 1    4   11   28 o   98.289   3.9390  200.145   15.953  212.284   22.772  188.446   22.356  101.225   5.4544   95.354   5.6846 5.871628 7.878091 
1 1 1    4   11   29 o  148.530   3.1729  456.267   19.432  464.568   27.862  448.406   27.116  149.842   4.5084  147.217   4.4658 2.624893 6.345737 
1 1 1    4   11   30 o   36.271   8.4854   22.916   16.091   4.8039   22.185   43.021   23.374   28.139   11.665   44.403   12.326 -16.26430 16.97084 
1 1 1    4   11   31 o  101.380   4.2594  213.634   17.791  204.800   25.357  222.199   24.968   99.294   6.1916  103.466   5.8509 -4.171738 8.518743 
1 1 1    4   11   32 o  108.328   4.5116  244.591   20.127  253.821   28.077  234.834   28.867  110.466   6.1624  106.189   6.5911 4.277229 9.023194 
1 1 1    4   11   33 o  118.637   4.4412  292.272   21.396  299.409   33.488  287.349   27.813  119.753   6.7802  117.521   5.7380 2.231850 8.882334 
1 1 1    4   11   34 o   36.911   8.7574   23.539   17.354   2.6010   24.025   46.381   25.094   28.205   11.944   45.617   12.810 -17.41211 17.51471 
1 1 1    4   11   35 o   32.899   9.3319   12.154   20.058  -4.5476   30.738   24.540   26.470   29.520   12.999   36.279   13.392 -6.759029 18.66370 
1 1 1    4   11   36 o   38.712   8.8341   31.304   17.121   14.359   24.270   48.088   24.155   31.642   12.527   45.782   12.459 -14.14025 17.66818 
1 1 1    4   11   37 o  105.122   4.4327  233.254   19.165  211.344   26.839  256.046   27.375   99.991   6.5080  110.253   6.0200 -10.26221 8.865350 
1 1 1    4   11   38 o   35.614   8.9861   25.070   17.041   14.953   23.294   36.716   24.993   31.099   12.285   40.129   13.118 -9.030643 17.97227 
1 1 1    4   11   39 o   27.320   8.2337   3.2471   16.653   12.165   23.284  -6.0928   23.828   29.762   12.101   24.879   11.169 4.882486 16.46741 
1 1 1    4   11   40 o   33.951   7.7154   14.723   15.985   52.935   23.055 -20.6524   22.183   47.043   11.880   20.858   9.8477 26.18518 15.43081 
1 1 1    4   11   41 o   36.074   9.1368   24.316   18.603   49.438   27.960   4.3590   24.920   44.377   13.806   27.770   11.971 16.60715 18.27368 
1 1 1    4   11   42 o   56.448   9.2416   80.794   21.190   68.024   31.093   91.870   28.957   51.205   14.217   61.691   11.811 -10.48536 18.48311 
1 1 1    4   11   43 o   32.940   8.8702   23.366   16.739   20.426   23.691   26.297   23.652   31.846   12.448   34.034   12.640 -2.188690 17.74043 
1 1 1    4   11   44 o   23.438   7.6045  -7.8750   16.717  -6.3705   23.538  -9.4060   23.744   23.710   10.824   23.166   10.684 0.5442295 15.20908 
1 1 1    4   11   45 o   39.980   8.6122   42.583   16.292   27.846   23.712   55.760   22.422   33.605   12.622   46.356   11.721 -12.75141 17.22441 
1 1 1    4   11   46 o   24.884   8.0142  -1.4222   18.028  -2.5259   27.138  -0.5503   24.120   25.237   11.559   24.530   11.104 0.7072105 16.02837 
1 1 1    4   11   47 o   36.388   9.1343   37.948   17.248   35.038   24.718   40.710   24.078   35.199   12.950   37.578   12.886 -2.378994 18.26863 
1 1 1    4   11   48 o   30.321   10.344  -0.4201   38.597  -5.5601   52.391   5.6805   57.078   29.483   14.242   31.159   15.005 -1.676174 20.68781 
1 1 1    4   11   49 o   27.171   9.3322  -8.9052   28.314 -17.8885   33.040   15.930   54.937   23.442   11.320   30.900   14.839 -7.458853 18.66442 
1 1 1    4   11   50 o   19.758   9.7446 -33.2613   28.501   0.0000   0.0000 -33.2613   28.501  ?   ?    19.758   9.7446      ?      ? 
1 1 1    4   12    0 o  358.527   3.2589  2652.83   68.126  2652.83   68.126  2652.83   68.126  358.527   4.6088  358.527   4.6088 0.000000 0.000000 
1 1 1    4   12    1 o  345.577   3.5176  2474.84   49.690  2551.10   66.588  2379.00   74.647  351.627   4.5914  339.528   5.3305 12.09882 7.035295 
1 1 1    4   12    2 o  272.867   2.5723  1539.39   28.832  1494.21   42.385  1578.30   39.334  269.128   3.8184  276.607   3.4478 -7.479309 5.144685 
1 1 1    4   12    3 o   86.088   2.9830  160.310   9.4671  170.854   11.332  135.942   17.226   91.011   3.0188   81.164   5.1459 9.847015 5.966077 
1 1 1    4   12    4 o  104.299   2.3199  226.355   9.8854  243.884   13.444  205.723   14.585  108.736   2.9978   99.862   3.5412 8.873535 4.639702 
1 1 1    4   12    5 o  480.479   3.5313  4764.06   69.978  4747.83   98.462  4780.63   99.472  479.653   4.9771  481.304   5.0109 -1.651367 7.062634 
1 1 1    4   12    6 o  395.600   3.2912  3230.66   53.206  3219.94   80.849  3238.86   70.665  395.003   4.9626  396.196   4.3244 -1.192627 6.582383 
1 1 1    4   12    7 o  207.681   2.6730  894.391   21.770  904.807   26.983  874.965   36.848  209.436   3.1237  205.927   4.3384 3.508835 5.346011 
1 1 1    4   12    8 o  354.196   2.9517  2587.87   41.674  2586.44   52.564  2590.30   68.381  354.085   3.5993  354.307   4.6794 -0.2221680 5.903491 
1 1 1    4   12    9 o  573.984   4.4316  6810.95  104.254  6888.21  140.253  6715.55  155.853  577.664   5.8867  570.304   6.6259 7.359375 8.863145 
1 1 1    4   12   10 o  264.118   3.2217  1448.27   34.452  1488.41   44.991  1391.37   53.569  268.586   4.0614  259.650   5.0022 8.936615 6.443391 
1 1 1    4   12   11 o  226.391   2.5284  1057.89   23.339  1060.80   30.790  1053.97   35.783  226.764   3.2921  226.019   3.8385 0.7448425 5.056863 
1 1 1    4   12   12 o  116.172   3.3243  289.077   14.084  302.391   16.652  255.616   26.398  121.071   3.3347  111.274   5.7518 9.796494 6.648568 
1 1 1    4   12   13 o  312.518   3.3138  1994.97   39.372  1963.10   47.087  2069.03   71.785  308.459   3.7012  316.578   5.4978 -8.119415 6.627534 
1 1 1    4   12   14 o  463.348   4.4885  4443.92   84.540  4379.82  130.673  4490.07  110.869  460.401   6.8815  466.295   5.7648 -5.893982 8.977092 
1 1 1    4   12   15 o  245.141   2.8989  1237.64   29.245  1203.50   39.834  1277.56   43.072  241.486   3.9994  248.795   4.1975 -7.308990 5.797756 
1 1 1    4   12   16 o  438.780   3.3830  3974.98   61.221  3981.02   86.889  3969.02   86.273  439.110   4.7976  438.451   4.7708 0.6590271 6.765921 
1 1 1    4   12   17 o  307.108   3.1786  1946.98   40.258  1921.57   56.497  1973.20   57.380  305.073   4.4901  309.143   4.5002 -4.070557 6.357140 
1 1 1    4   12   18 o  331.138   2.8782  2263.16   39.302  2287.59   56.228  2239.81   54.956  332.883   4.0954  329.392   4.0452 3.490692 5.756393 
1 1 1    4   12   19 o  224.494   2.6089  1040.13   24.154  1022.67   33.900  1058.14   34.422  222.581   3.6928  226.408   3.6862 -3.827774 5.217728 
1 1 1    4   12   20 o   73.398   4.2940  111.321   12.985  113.604   18.887  109.275   17.880   74.107   6.1795   72.689   5.9640 1.417992 8.588082 
1 1 1    4   12   21 o   61.686   5.3464   79.486   13.463   92.101   18.984   66.724   19.095   66.674   6.9035   56.697   8.1656 9.976734 10.69280 
1 1 1    4   12   22 o  269.590   2.7662  1500.73   30.749  1524.48   44.133  1478.33   42.865  271.659   3.9389  267.521   3.8849 4.137726 5.532365 
1 1 1    4   12   23 o  115.591   3.6381  276.309   17.343  273.839   24.364  278.846   24.694  115.068   5.1337  116.114   5.1563 -1.045830 7.276160 
1 1 1    4   12   24 o  208.018   2.7060  893.957   23.215  894.662   32.973  893.263   32.691  208.097   3.8417  207.938   3.8118 0.1597443 5.411919 
1 1 1    4   12   25 o  217.873   3.6188  975.443   31.597  954.113   39.987  1010.90   51.557  214.807   4.5134  220.939   5.6579 -6.131180 7.237555 
1 1 1    4   12   26 o  143.402   3.5298  426.144   20.848  412.643   29.981  438.784   29.010  141.183   5.1487  145.620   4.8301 -4.436966 7.059657 
1 1 1    4   12   27 o  139.419   3.1255  402.314   17.953  395.301   25.861  408.839   24.944  138.234   4.5359  140.604   4.3013 -2.369354 6.251049 
1 1 1    4   12   28 o  161.437   3.2036  540.205   21.241  550.607   28.911  528.003   31.312  163.156   4.2963  159.719   4.7532 3.437500 6.407107 
1 1 1    4   12   29 o   52.198   7.2036   59.069   14.946   58.616   21.448   59.497   20.837   51.961   10.371   52.435   10.000 -0.4733009 14.40716 
1 1 1    4   12   30 o  114.337   4.0140  273.558   18.726  291.692   25.259  251.430   27.903  118.640   5.1621  110.035   6.1483 8.604347 8.027980 
1 1 1    4   12   31 o   60.789   7.4745   83.442   17.498   59.546   26.650  101.549   23.198   51.880   12.584   69.699   8.0698 -17.81890 14.94898 
1 1 1    4   12   32 o   70.546   5.9441  104.330   17.054  128.709   24.850   82.623   23.448   78.431   7.6818   62.661   9.0729 15.76954 11.88820 
1 1 1    4   12   33 o   53.298   7.7307   62.091   16.719   78.143   23.933   46.792   23.365   60.756   9.5509   45.840   12.159 14.91591 15.46132 
1 1 1    4   12   34 o   82.411   7.1669  145.219   24.281  146.275   33.121  143.993   35.701   82.858   9.6917   81.963   10.561 0.8947601 14.33378 
1 1 1    4   12   35 o   43.337   8.8138   42.488   16.637   46.169   23.589   38.845   23.468   45.056   12.333   41.618   12.594 3.437698 17.62763 
1 1 1    4   12   36 o   69.567   6.8139  108.435   17.530  164.493   25.697   59.637   23.975   88.117   7.0706   51.017   11.650 37.09991 13.62771 
1 1 1    4   12   37 o   29.394   7.9480   5.2368   15.985 -23.6135   23.219   31.227   22.038   21.248   10.045   37.541   12.320 -16.29284 15.89608 
1 1 1    4   12   38 o   50.433   7.7448   59.605   16.447   87.588   23.375   32.166   23.147   63.257   8.9595   37.609   12.635 25.64875 15.48950 
1 1 1    4   12   39 o   51.487   8.8319   63.142   18.604   75.678   27.675   52.806   25.130   56.289   12.267   46.685   12.709 9.604084 17.66374 
1 1 1    4   12   40 f   27.405   8.1582   3.4732   16.459 -11.1107   23.746   16.959   22.834   23.642   10.823   31.168   12.210 -7.526186 16.31631 
1 1 1    4   12   41 o   79.748   6.2584  141.096   20.012  144.790   32.377  138.812   25.458   79.893   9.8256   79.603   7.7542 0.2901459 12.51677 
1 1 1    4   12   42 o   20.123   6.8345 -27.5172   16.529 -22.7393   23.255 -32.3955   23.498   20.799   9.8966   19.447   9.4285 1.351944 13.66895 
1 1 1    4   12   43 o   21.907   7.2548 -16.1566   16.513 -10.5032   22.962 -22.2115   23.764   22.786   10.508   21.028   10.005 1.757458 14.50968 
1 1 1    4   12   44 o   36.514   8.6508   31.968   16.595   52.080   24.084   13.787   22.899   44.324   12.586   28.705   11.871 15.61944 17.30163 
1 1 1    4   12   45 o   37.000   9.3444   37.342   18.064   40.325   25.553   34.362   25.539   38.173   13.264   35.826   13.166 2.347645 18.68889 
1 1 1    4   12   46 o   36.723   9.3973   35.753   20.067   59.022   28.397   12.541   28.362   44.501   13.925   28.944   12.622 15.55689 18.79454 
1 1 1    4   12   47 o   20.663   7.0211 -25.1624   17.750 -43.7966   25.014  -6.2632   25.191   17.956   8.9049   23.370   10.857 -5.414583 14.04216 
1 1 1    4   12   48 o   41.072   17.873   83.013   56.611   83.013   56.611   0.0000   0.0000   41.072   17.873  ?   ?       ?      ? 
1 1 1    4   12   49 o   24.409   8.1672  -4.7410   21.587   1.5844   32.527  -9.7201   28.859   25.750   12.085   23.069   10.990 2.681442 16.33448 
1 1 1    4   12   50 o   24.364   7.9830 -11.5928   21.590 -62.2879   32.623   27.916   28.800   18.658   9.3869   30.070   12.915 -11.41214 15.96592 
1 1 1    4   13    0 o  173.823   2.8414  624.235   28.774  624.235   28.774  624.235   28.774  173.823   4.0184  173.823   4.0184 0.000000 0.000000 
1 1 1    4   13    1 o  249.209   2.4719  1277.52   25.054  1259.60   32.699  1302.99   38.987  247.106   3.2084  251.312   3.7613 -4.205765 4.943833 
1 1 1    4   13    2 o  364.422   2.8697  2739.33   43.119  2715.51   60.105  2764.59   61.894  362.792   4.0168  366.052   4.0996 -3.260193 5.739491 
1 1 1    4   13    3 o  321.217   3.3517  2137.70   43.984  2196.49   58.773  2062.86   66.311  326.272   4.3675  316.161   5.0853 10.11105 6.703353 
1 1 1    4   13    4 o  176.990   2.1897  647.942   15.893  664.424   21.520  628.164   23.574  179.475   2.9071  174.504   3.2754 4.971436 4.379442 
1 1 1    4   13    5 f  714.771   4.9617 10549.71  146.272 10536.97  206.434 10562.56  207.290  714.339   7.0067  715.203   7.0272 -0.8643188 9.923450 
1 1 1    4   13    6 o  553.803   4.3076  6308.19   96.625  6451.19  152.515  6212.30  124.885  558.977   6.6153  548.628   5.5191 10.34814 8.615292 
1 1 1    4   13    7 o  221.213   2.7414  999.429   23.432  981.129   28.398  1038.47   41.477  218.088   3.1571  224.337   4.4827 -6.249115 5.482821 
1 1 1    4   13    8 o  254.223   2.6124  1319.56   26.809  1269.44   34.250  1398.85   43.080  248.064   3.3475  260.381   4.0114 -12.31726 5.224721 
1 1 1    4   13    9 o  223.219   2.8909  1035.11   26.401  1099.21   35.870  959.325   39.000  230.822   3.7679  215.617   4.3854 15.20428 5.781744 
1 1 1    4   13   10 o  230.314   2.5206  1098.09   23.798  1132.61   32.235  1056.73   35.283  234.313   3.3356  226.316   3.7799 7.996902 5.041219 
1 1 1    4   13   11 o  519.293   4.0929  5573.40   86.958  5615.57  116.099  5519.51  131.244  521.571   5.3970  517.015   6.1547 4.557007 8.185852 
1 1 1    4   13   12 o  208.586   3.1236  887.606   25.897  860.746   32.311  935.855   43.306  204.243   3.8356  212.929   4.9311 -8.685745 6.247243 
1 1 1    4   13   13 o  170.015   2.8805  599.393   19.918  614.911   26.269  578.407   30.548  172.627   3.6896  167.403   4.4245 5.224228 5.760974 
1 1 1    4   13   14 o  175.163   2.5323  634.598   18.193  648.312   24.623  618.109   27.000  177.258   3.3680  173.067   3.7825 4.190521 5.064635 
1 1 1    4   13   15 o   77.561   3.4248  125.755   10.772  134.440   14.306  114.382   16.370   80.702   4.2980   74.419   5.3334 6.282799 6.849621 
1 1 1    4   13   16 o  534.439   4.5429  5904.75  100.137  5903.07  141.183  5906.46  142.050  534.366   6.4059  534.512   6.4434 -0.1459961 9.085884 
1 1 1    4   13   17 o  238.766   3.2446  1178.28   31.607  1184.51   41.800  1169.97   48.298  239.526   4.2311  238.005   4.9202 1.521393 6.489268 
1 1 1    4   13   18 o  353.902   3.6263  2585.30   50.157  2580.06   61.726  2595.50   86.053  353.481   4.2338  354.323   5.8885 -0.8424683 7.252531 
1 1 1    4   13   19 o  170.121   2.7917  588.528   19.340  653.076   30.384  544.565   25.076  177.833   4.1426  162.409   3.7436 15.42380 5.583494 
1 1 1    4   13   20 o  186.690   2.7679  717.028   21.139  740.924   32.239  699.006   27.997  189.393   4.1272  183.988   3.6895 5.405197 5.535870 
1 1 1    4   13   21 o  204.543   2.8253  863.817   23.729  859.185   32.039  869.445   35.314  203.952   3.8088  205.134   4.1739 -1.181381 5.650512 
1 1 1    4   13   22 o  104.232   3.8813  225.481   16.568  218.469   24.735  231.186   22.313  102.735   5.8375  105.729   5.1167 -2.993393 7.762591 
1 1 1    4   13   23 o  113.397   3.4628  265.967   16.093  265.671   24.149  266.202   21.583  113.322   5.1667  113.472   4.6117 -0.1498260 6.925546 
1 1 1    4   13   24 o   99.584   3.6114  204.949   14.823  214.240   21.402  196.383   20.551  101.751   5.0998   97.417   5.1148 4.333725 7.222788 
1 1 1    4   13   25 o  198.954   3.1638  817.235   25.927  843.604   37.861  793.952   35.577  201.962   4.5453  195.946   4.4022 6.016006 6.327624 
1 1 1    4   13   26 o   71.367   5.6761  104.636   16.595  120.743   25.210   92.319   22.046   76.148   8.0269   66.585   8.0275 9.563416 11.35221 
1 1 1    4   13   27 o  152.064   3.0224  478.145   18.952  482.824   27.144  473.694   26.472  152.786   4.3075  151.342   4.2409 1.444595 6.044821 
1 1 1    4   13   28 o   75.232   4.9787  117.989   15.406  109.832   22.035  125.788   21.546   72.654   7.3535   77.810   6.7139 -5.155937 9.957411 
1 1 1    4   13   29 o   71.640   5.4411  108.000   15.842   87.123   22.420  128.818   22.389   64.584   8.4168   78.696   6.8978 -14.11195 10.88217 
1 1 1    4   13   30 o   65.768   5.9716   91.150   16.035   77.243   22.847  104.650   22.510   60.709   9.1247   70.827   7.7058 -10.11707 11.94314 
1 1 1    4   13   31 o   96.320   5.3975  193.710   21.418  198.222   31.178  189.678   29.473   97.358   7.7644   95.281   7.4997 2.077080 10.79496 
1 1 1    4   13   32 o   37.957   8.2841   27.709   15.809   7.1488   21.990   49.703   22.744   28.616   11.712   47.298   11.719 -18.68182 16.56814 
1 1 1    4   13   33 o  106.882   4.3220  238.056   19.042  248.676   27.416  228.157   26.468  109.188   6.0879  104.577   6.1365 4.611198 8.644026 
1 1 1    4   13   34 f   31.808   10.223 -18.2079   29.419  -9.3955   41.271 -27.3116   41.948   33.158   14.805   30.457   14.101 2.700388 20.44558 
1 1 1    4   13   35 o   93.043   4.7158  182.578   18.079  179.268   26.000  185.677   25.156   92.175   6.8391   93.912   6.4947 -1.737457 9.431587 
1 1 1    4   13   36 o   51.252   8.0661   60.630   16.669   70.068   23.375   50.865   23.778   55.717   10.558   46.787   12.197 8.929470 16.13227 
1 1 1    4   13   37 o   26.451   7.8967  -1.2001   15.849   16.450   22.414 -18.8495   22.414   31.326   12.145   21.576   10.096 9.750546 15.79332 
1 1 1    4   13   38 o   21.257   7.0295 -20.0922   15.752 -34.7293   23.097  -7.3637   21.539   19.191   9.3146   23.323   10.531 -4.131542 14.05909 
1 1 1    4   13   39 o   28.993   8.5892   7.9461   17.478   0.8193   25.329   14.424   24.148   27.246   11.904   30.739   12.385 -3.492353 17.17844 
1 1 1    4   13   40 o   29.452   8.3398   11.442   16.204  -2.8249   23.647   24.071   22.248   25.357   11.272   33.546   12.294 -8.188519 16.67953 
1 1 1    4   13   41 o   77.742   6.6419  135.622   21.257  145.347   31.218  127.215   29.024   80.309   9.4250   75.176   9.3609 5.132843 13.28375 
1 1 1    4   13   42 o   26.141   8.3356  -3.3584   18.455  -2.8128   23.239  -4.2899   30.366   24.756   11.077   27.525   12.459 -2.768457 16.67127 
1 1 1    4   13   43 o   23.294   7.5299 -10.2827   16.608   3.5650   23.590 -23.8911   23.385   26.183   11.462   20.405   9.7679 5.778481 15.05976 
1 1 1    4   13   44 o   25.251   8.0277  -2.0436   17.882   7.9433   22.825 -17.9151   28.774   26.783   11.500   23.718   11.203 3.065702 16.05530 
1 1 1    4   13   45 f   46.921   9.7143   70.727   21.330   44.736   40.776   80.517   25.026   38.158   15.816   55.683   11.284 -17.52530 19.42868 
1 1 1    4   13   46 o   36.241   8.9749   31.228   20.271  -6.7753   29.325   66.004   28.052   25.115   11.683   47.368   13.627 -22.25288 17.94989 
1 1 1    4   13   47 o   26.637   8.7391  -1.4937   22.853   14.757   34.441 -14.2757   30.545   29.566   13.336   23.708   11.298 5.858110 17.47821 
1 1 1    4   13   48 f   26.169   8.8954  -8.7956   26.937 -32.5503   51.843  -0.0108   31.527   26.538   13.098   25.800   12.039 0.7382641 17.79080 
1 1 1    4   13   49 o   28.150   8.9412   16.845   21.702   29.189   31.949   6.2701   29.572   30.627   13.375   25.672   11.870 4.954548 17.88245 
1 1 1    4   14    0 o  373.265   2.9129  2874.95   63.402  2874.95   63.402  2874.95   63.402  373.265   4.1194  373.265   4.1194 0.000000 0.000000 
1 1 1    4   14    1 o  730.409   6.1155 11086.76  176.730 11249.10  221.564 10802.80  293.027  738.023   7.2788  722.795   9.8294 15.22839 12.23107 
1 1 1    4   14    2 o  622.372   4.7410  7990.60  120.144  7951.11  157.613  8045.36  185.619  620.601   6.1577  624.143   7.2106 -3.542664 9.482074 
1 1 1    4   14    3 o  855.381   5.8467 15109.67  206.103 15339.01  298.438 14900.56  284.974  861.556   8.3986  849.207   8.1363 12.34875 11.69337 
1 1 1    4   14    4 o  264.192   2.5456  1435.00   27.370  1410.41   35.760  1469.79   42.528  261.477   3.3159  266.908   3.8632 -5.431335 5.091137 
1 1 1    4   14    5 o  581.976   4.1448  6992.11   99.488  7005.66  140.777  6978.59  140.617  582.539   5.8593  581.412   5.8639 1.127197 8.289532 
1 1 1    4   14    6 o  437.743   4.6339  3900.63   82.296  4259.60  130.818  3665.53  105.870  454.133   6.9842  421.353   6.0920 32.77954 9.267797 
1 1 1    4   14    7 o  108.252   2.2949  239.143   10.035  229.546   12.832  254.257   16.103  105.489   2.9492  111.016   3.5168 -5.526558 4.589743 
1 1 1    4   14    8 o  367.676   3.0132  2792.97   44.296  2803.88   56.189  2775.08   71.999  368.651   3.6955  366.700   4.7605 1.951324 6.026486 
1 1 1    4   14    9 o  279.452   3.1167  1619.61   33.815  1635.79   41.459  1587.45   58.447  281.580   3.5698  277.324   5.1099 4.255493 6.233324 
1 1 1    4   14   10 o  633.808   4.8319  8306.59  125.329  8362.53  167.449  8235.34  188.984  636.308   6.3804  631.308   7.2580 4.999756 9.663756 
1 1 1    4   14   11 o  238.066   2.4537  1164.98   23.158  1153.65   28.928  1185.20   38.646  236.477   2.9659  239.655   3.9098 -3.178314 4.907439 
1 1 1    4   14   12 o  248.875   3.1193  1284.34   31.813  1340.06   43.205  1218.35   47.019  254.813   4.1110  242.937   4.6926 11.87622 6.238640 
1 1 1    4   14   13 o  250.223   2.6271  1296.26   26.813  1321.71   35.575  1262.80   40.799  253.089   3.4081  247.357   3.9991 5.731705 5.254285 
1 1 1    4   14   14 f  105.413   2.6601  230.585   11.096  233.863   13.910  224.849   18.399  106.461   3.1678  104.366   4.2744 2.095772 5.320279 
1 1 1    4   14   15 o  170.590   2.5418  595.334   17.500  576.161   22.373  625.553   28.088  167.095   3.2464  174.085   3.9120 -6.989655 5.083533 
1 1 1    4   14   16 o  106.937   4.2258  237.565   17.746  240.346   22.033  232.428   29.943  107.871   4.9522  106.002   6.8489 1.868591 8.451694 
1 1 1    4   14   17 o  389.840   3.1450  3138.57   50.567  3151.09   71.759  3126.23   71.268  390.611   4.4542  389.068   4.4412 1.542389 6.289991 
1 1 1    4   14   18 o  200.301   2.5366  828.092   20.952  836.542   29.942  819.984   29.330  201.300   3.6063  199.301   3.5681 1.999847 5.073143 
1 1 1    4   14   19 o   44.183   6.3312   44.177   11.290   23.120   16.643   62.127   15.366   33.602   10.680   54.764   6.8030 -21.16202 12.66241 
1 1 1    4   14   20 f   73.786   4.1784  113.358   12.635  105.086   18.501  120.589   17.297   71.229   6.2976   76.342   5.4932 -5.113167 8.356751 
1 1 1    4   14   21 f   93.656   3.8640  181.278   14.537  182.361   23.408  180.598   18.548   93.850   6.0475   93.463   4.8115 0.3865128 7.728050 
1 1 1    4   14   22 o  126.334   4.9013  327.857   23.640  339.304   42.729  322.807   28.379  127.777   8.1077  124.891   5.5094 2.886818 9.802514 
1 1 1    4   14   23 o   78.991   4.6655  129.058   15.075  126.728   19.994  132.127   22.949   78.193   6.1996   79.788   6.9737 -1.594826 9.330951 
1 1 1    4   14   24 o  174.507   4.0164  629.398   28.908  629.398   28.908   0.0000   0.0000  174.507   4.0164  ?   ?       ?      ? 
1 1 1    4   14   25 o  104.768   4.4206  219.174   18.175  255.094   31.877  201.874   22.123  110.814   6.9746   98.721   5.4333 12.09363 8.841160 
1 1 1    4   14   26 o  123.594   3.9981  315.038   20.150  306.643   26.415  326.721   31.162  121.676   5.2635  125.512   6.0196 -3.836510 7.996271 
1 1 1    4   14   27 o  130.055   3.2838  350.590   17.576  324.427   24.884  376.634   24.828  125.189   4.8195  134.922   4.4616 -9.733734 6.567575 
1 1 1    4   14   28 o  137.138   3.3646  389.469   19.027  385.332   27.104  393.488   26.716  136.413   4.8174  137.863   4.6984 -1.449890 6.729250 
1 1 1    4   14   29 o  125.915   3.6153  328.440   18.765  344.306   26.808  313.198   26.275  128.904   5.0423  122.927   5.1825 5.977486 7.230678 
1 1 1    4   14   30 o  173.993   3.6231  631.882   25.337  646.336   32.589  609.790   40.288  176.644   4.4730  171.342   5.7009 5.302933 7.246297 
1 1 1    4   14   31 o  243.665   3.9705  1231.48   39.848  1179.15   54.632  1290.96   58.250  238.166   5.5617  249.163   5.6682 -10.99719 7.941069 
1 1 1    4   14   32 o  116.073   4.0078  279.918   19.158  302.610   27.723  259.178   26.504  120.585   5.5742  111.562   5.7601 9.022865 8.015636 
1 1 1    4   14   33 o   54.521   7.5993   68.305   16.768   32.819   23.789  103.342   23.639   39.130   12.798   69.913   8.1978 -30.78279 15.19852 
1 1 1    4   14   34 o   73.909   6.8099  118.454   20.542  106.842   30.250  128.391   27.983   70.255   10.440   77.563   8.7472 -7.308403 13.61989 
1 1 1    4   14   35 o   75.650   5.5850  122.100   17.262  144.759   24.970  101.358   23.890   82.548   7.3340   68.752   8.4250 13.79526 11.16993 
1 1 1    4   14   36 o   83.396   5.0226  147.372   17.253  154.183   25.215  141.376   23.657   85.178   7.1773   81.613   7.0281 3.564545 10.04526 
1 1 1    4   14   37 o   37.806   8.1920   29.754   16.021   5.3357   22.487   54.929   22.832   27.326   11.563   48.286   11.608 -20.96046 16.38403 
1 1 1    4   14   38 o   50.636   8.0738   61.916   17.869   28.437   25.625   93.610   24.932   36.216   13.206   65.055   9.2920 -28.83962 16.14768 
1 1 1    4   14   39 o   46.225   8.7783   51.617   17.091   50.592   23.987   52.674   24.357   45.768   12.400   46.682   12.429 -0.9146004 17.55668 
1 1 1    4   14   40 o   40.268   9.0129   39.864   16.809   36.984   23.787   42.737   23.755   38.972   12.800   41.564   12.692 -2.591507 18.02579 
1 1 1    4   14   41 o   41.269   10.043   43.616   20.747   40.047   30.983   46.517   27.936   40.019   14.532   42.518   13.867 -2.498875 20.08686 
1 1 1    4   14   42 o   30.489   9.1656   11.459   20.413   18.998   27.479   2.1748   30.493   32.184   13.123   28.793   12.799 3.391047 18.33125 
1 1 1    4   14   43 o   39.952   9.0681   42.621   17.919   26.485   26.546   56.130   24.288   33.715   13.177   46.189   12.462 -12.47353 18.13622 
1 1 1    4   14   44 o   24.723   7.7523   0.0661   16.049 -10.1529   22.594   10.473   22.800   22.137   10.284   27.309   11.604 -5.172092 15.50467 
1 1 1    4   14   45 o   25.642   8.0594   3.2918   17.288  -4.3469   24.749   10.572   24.161   23.965   10.999   27.320   11.782 -3.355061 16.11871 
1 1 1    4   14   46 o   28.305   8.4610   10.872   18.038  -7.9014   24.995   31.273   26.056   23.064   10.748   33.546   13.070 -10.48160 16.92199 
1 1 1    4   14   47 o   18.793   6.6524 -59.9019   21.821 -68.7609   31.668 -51.8938   30.109   18.417   9.2635   19.169   9.5501 -0.7525368 13.30473 
1 1 1    4   14   48 o   33.405   9.6666   35.562   22.643   13.332   32.814   55.768   31.285   27.955   12.769   38.854   14.516 -10.89887 19.33323 
1 1 1    4   14   49 o   34.011   10.871   34.973   28.836   8.7053   33.813  105.021   55.216   26.693   12.460   41.328   17.818 -14.63467 21.74240 
1 1 1    4   15    0 o  124.613   2.5640  321.108   18.601  321.108   18.601  321.108   18.601  124.613   3.6261  124.613   3.6261 0.000000 0.000000 
1 1 1    4   15    1 o  113.655   2.5919  263.707   12.079  293.213   18.331  241.063   16.058  119.214   3.7281  108.096   3.6019 11.11861 5.183809 
1 1 1    4   15    2 o  308.001   3.3942  1908.79   40.633  1818.38   49.219  2102.27   72.001  296.869   4.0198  319.133   5.4702 -22.26416 6.788329 
1 1 1    4   15    3 o  308.785   2.7628  1971.80   34.995  2014.57   47.387  1920.48   51.902  312.486   3.6768  305.084   4.1248 7.401978 5.525615 
1 1 1    4   15    4 o  332.899   3.3702  2270.66   42.732  2244.85   51.234  2329.67   77.456  329.858   3.7659  335.940   5.5902 -6.082306 6.740338 
1 1 1    4   15    5 o  283.322   3.4537  1573.16   38.706  1384.98   47.338  1952.72   67.230  259.068   4.4303  307.576   5.2996 -48.50729 6.907487 
1 1 1    4   15    6 o  200.439   2.6233  826.267   21.565  956.499   31.431  710.434   29.642  215.318   3.5392  185.559   3.8732 29.75925 5.246657 
1 1 1    4   15    7 o  490.316   3.7023  4978.77   73.054  5037.49   93.862  4888.53  116.350  494.050   4.6063  486.581   5.7975 7.469177 7.404696 
1 1 1    4   15    8 o   80.631   3.7890  136.891   11.350  140.565   13.498  128.025   20.969   82.535   3.9653   78.727   6.4578 3.807869 7.578036 
1 1 1    4   15    9 o   98.217   2.3193  195.806   8.9984  188.309   11.118  210.044   15.321   95.542   2.8214  100.893   3.6819 -5.351082 4.638614 
1 1 1    4   15   10 o   65.414   4.5316   91.500   10.224   94.228   11.714   82.776   20.950   67.568   4.2035   63.260   8.0294 4.308239 9.063141 
1 1 1    4   15   11 o  209.570   2.4981  903.615   21.332  889.570   27.969  923.149   32.983  207.638   3.2659  211.502   3.7811 -3.863617 4.996241 
1 1 1    4   15   12 o  101.221   3.4421  208.027   14.232  237.736   22.080  186.913   18.614  107.297   4.9894   95.146   4.7433 12.15156 6.884261 
1 1 1    4   15   13 o  168.781   2.7554  586.191   19.136  613.439   28.255  563.104   26.009  172.391   3.9740  165.173   3.8178 7.218033 5.510729 
1 1 1    4   15   14 o  158.830   2.5868  521.047   16.865  524.624   22.807  516.732   25.051  159.438   3.4682  158.221   3.8389 1.217178 5.173525 
1 1 1    4   15   15 o  297.824   2.7693  1834.40   33.011  1844.90   41.962  1817.34   53.471  298.983   3.4028  296.666   4.3700 2.317291 5.538648 
1 1 1    4   15   16 o  116.097   3.1847  281.099   14.953  293.670   19.584  263.520   23.157  119.260   3.9814  112.934   4.9716 6.326546 6.369318 
1 1 1    4   15   17 o  131.446   3.6040  358.892   17.875  361.586   21.379  352.635   32.584  132.329   3.9172  130.564   6.0508 1.765732 7.208063 
1 1 1    4   15   18 o  114.164   2.9311  269.253   13.780  269.201   20.057  269.298   18.964  114.149   4.2602  114.180   4.0269 -0.3170776E-01 5.862177 
1 1 1    4   15   19 o  149.005   2.6908  458.719   16.527  454.604   23.726  462.597   23.034  148.351   3.8776  149.659   3.7316 -1.307480 5.381539 
1 1 1    4   15   20 o  224.280   2.8634  1039.04   26.137  1038.30   34.287  1040.08   40.384  224.216   3.7077  224.344   4.3645 -0.1273651 5.726726 
1 1 1    4   15   21 o  239.279   2.6274  1182.66   25.929  1180.03   36.765  1185.27   36.573  239.013   3.7295  239.546   3.7018 -0.5332031 5.254747 
1 1 1    4   15   22 o   82.755   4.5412  140.508   15.380  118.341   20.705  167.796   22.972   75.533   6.6462   89.976   6.1903 -14.44319 9.082499 
1 1 1    4   15   23 o  271.756   3.1647  1527.18   35.464  1526.31   50.662  1528.01   49.661  271.673   4.5214  271.839   4.4293 -0.1660767 6.329442 
1 1 1    4   15   24 o   89.051   3.8632  164.228   14.172  165.097   20.572  163.444   19.552   89.265   5.5876   88.836   5.3364 0.4296722 7.726462 
1 1 1    4   15   25 o  100.535   4.3940  210.099   18.086  206.157   27.137  213.250   24.259   99.646   6.6029  101.424   5.7992 -1.777847 8.788013 
1 1 1    4   15   26 o  126.551   4.1736  332.117   21.782  330.211   30.531  334.094   31.084  126.185   5.8662  126.916   5.9383 -0.7309341 8.347212 
1 1 1    4   15   27 o  316.202   3.4838  2069.77   45.425  2019.17   63.528  2122.70   64.977  312.248   4.9328  320.156   4.9208 -7.908539 6.967556 
1 1 1    4   15   28 o  143.352   3.6836  424.661   21.489  433.515   33.370  418.390   28.087  144.569   5.5965  142.135   4.7911 2.434738 7.367224 
1 1 1    4   15   29 o   87.274   5.2581  157.221   18.641  149.676   24.101  168.455   29.408   84.767   6.8935   89.781   7.9416 -5.013771 10.51621 
1 1 1    4   15   30 f   47.700   8.4381   47.127   17.705   21.700   23.496   80.539   26.933   34.718   12.648   60.682   11.173 -25.96379 16.87612 
1 1 1    4   15   31 o   28.402   8.4545   3.2994   16.929  -1.0724   24.652   7.2009   23.288   27.537   11.889   29.267   12.024 -1.730385 16.90897 
1 1 1    4   15   32 o   92.082   5.3096  178.707   19.673  175.681   31.313  180.680   25.287   91.241   8.3210   92.924   6.5978 -1.682999 10.61928 
1 1 1    4   15   33 o   55.602   8.7398   76.056   20.383   36.534   32.116  102.713   26.376   41.894   14.846   69.310   9.2267 -27.41605 17.47950 
1 1 1    4   15   34 o  100.873   4.4738  213.677   18.588  228.872   27.037  200.059   25.596  104.278   6.2863   97.468   6.3673 6.810181 8.947624 
1 1 1    4   15   35 o   34.077   9.4104   19.424   18.727   19.828   23.664   18.748   30.633   33.132   12.571   35.021   14.007 -1.888844 18.82079 
1 1 1    4   15   36 o   33.968   8.3760   20.777   16.134  -0.2959   23.133   40.735   22.513   26.188   11.411   41.748   12.265 -15.55988 16.75203 
1 1 1    4   15   37 o   40.316   8.7683   38.326   16.324   29.045   23.248   47.352   22.927   36.127   12.646   44.504   12.150 -8.376232 17.53669 
1 1 1    4   15   38 o   54.683   8.1511   71.394   18.237   47.848   26.017   94.138   25.571   44.282   13.230   65.085   9.5257 -20.80331 16.30223 
1 1 1    4   15   39 o   49.343   9.4197   58.543   18.959   51.951   23.512   70.798   32.055   46.135   12.178   52.551   14.374 -6.416637 18.83950 
1 1 1    4   15   40 o   25.593   8.3756 -11.2803   19.212 -13.2343   35.174 -10.4495   22.936   28.113   12.979   23.072   10.590 5.040400 16.75112 
1 1 1    4   15   41 o   52.185   8.2675   66.985   17.309   65.161   23.522   69.139   25.563   51.631   11.355   52.739   12.020 -1.108402 16.53507 
1 1 1    4   15   42 o   26.838   8.3613   3.1353   17.813   5.7632   27.360   1.2019   23.468   28.160   12.335   25.515   11.291 2.644403 16.72265 
1 1 1    4   15   43 o   26.915   7.8393   7.8696   15.211  -9.7697   22.158   23.590   20.919   22.140   10.250   31.691   11.864 -9.550535 15.67850 
1 1 1    4   15   44 o   42.089   9.0241   49.843   17.071   46.520   24.275   53.093   24.010   40.549   12.899   43.629   12.623 -3.080257 18.04816 
1 1 1    4   15   45 o   24.534   7.7469  -1.3591   16.575   14.016   23.644 -16.2178   23.244   28.071   11.866   20.997   9.9628 7.074106 15.49385 
1 1 1    4   15   46 f   28.826   9.0858   10.260   22.219   30.119   32.996  -6.2180   30.055   32.819   13.952   24.834   11.642 7.984795 18.17153 
1 1 1    4   15   47 o   35.280   9.3800   31.955   25.573 -49.1998   43.077   76.119   31.778   23.407   11.621   47.154   14.727 -23.74734 18.75995 
1 1 1    4   15   48 o   29.554   9.6728   20.914   25.714   21.524   53.561   20.731   29.314   30.470   14.638   28.639   12.649 1.830904 19.34565 
1 1 1    4   16    0 o  193.532   2.3988  773.271   27.060  773.271   27.060  773.271   27.060  193.532   3.3924  193.532   3.3924 0.000000 0.000000 
1 1 1    4   16    1 o  521.077   3.7637  5605.05   80.886  5590.67  113.923  5619.67  114.863  520.405   5.3077  521.750   5.3377 -1.344788 7.527428 
1 1 1    4   16    2 o  200.424   2.2785  828.956   18.565  830.175   24.298  827.247   28.777  200.608   2.9367  200.241   3.4844 0.3671570 4.556935 
1 1 1    4   16    3 o   85.723   2.2442  148.779   7.6772  141.077   9.5926  162.502   12.804   82.698   2.8124   88.748   3.4981 -6.050224 4.488471 
1 1 1    4   16    4 o  391.467   3.1263  3163.16   48.822  3164.49   61.667  3160.93   79.917  391.616   3.8179  391.319   4.9515 0.2964478 6.252539 
1 1 1    4   16    5 o  320.847   2.8554  2130.08   37.567  2182.57   50.832  2066.92   55.766  325.227   3.7896  316.467   4.2724 8.759247 5.710891 
1 1 1    4   16    6 o  403.109   3.3218  3360.07   54.957  3416.26   74.482  3292.92   81.422  406.836   4.4388  399.382   4.9430 7.453461 6.643501 
1 1 1    4   16    7 o  128.843   2.1790  337.526   11.001  327.127   13.486  358.209   19.020  125.928   2.5965  131.758   3.5000 -5.829926 4.358021 
1 1 1    4   16    8 o  622.312   4.5381  8014.42  113.146  8053.61  144.032  7951.25  182.853  624.451   5.5923  620.173   7.1486 4.278564 9.076188 
1 1 1    4   16    9 o  370.318   3.0551  2823.70   44.861  2805.45   56.094  2856.09   74.725  368.709   3.6886  371.926   4.8713 -3.217560 6.110257 
1 1 1    4   16   10 o  157.766   2.9188  508.601   17.240  501.621   20.396  526.064   32.262  155.920   3.1716  159.613   4.9008 -3.692841 5.837509 
1 1 1    4   16   11 o  546.946   4.2758  6188.98   95.718  6235.69  127.969  6129.66  144.215  549.366   5.6478  544.525   6.4214 4.841675 8.551683 
1 1 1    4   16   12 o  223.717   2.8338  1032.30   24.508  1030.70   29.836  1035.63   42.972  223.489   3.2368  223.945   4.6524 -0.4565277 5.667622 
1 1 1    4   16   13 o  106.421   2.6945  236.631   11.643  253.744   15.524  214.632   17.601  110.883   3.3945  101.959   4.1854 8.923355 5.388917 
1 1 1    4   16   14 o  210.269   2.4652  911.016   20.619  906.666   25.904  918.537   34.063  209.610   2.9963  210.928   3.9154 -1.318329 4.930386 
1 1 1    4   16   15 o   53.965   3.8348   58.861   8.3440   54.304   10.568   66.403   13.596   51.264   4.9984   56.667   5.8171 -5.403591 7.669594 
1 1 1    4   16   16 o  164.617   3.1035  560.352   20.991  566.323   28.553  553.330   30.965  165.585   4.1808  163.648   4.5877 1.936874 6.206952 
1 1 1    4   16   17 o  169.500   3.0813  586.229   18.234  579.806   20.777  607.754   38.034  167.596   3.0057  171.405   5.3800 -3.808792 6.162680 
1 1 1    4   16   18 o  135.547   2.6266  380.934   14.085  384.744   17.632  374.218   23.412  136.516   3.1316  134.577   4.2179 1.938980 5.253293 
1 1 1    4   16   19 o  121.988   3.0255  305.586   15.174  281.721   20.518  334.399   22.545  116.764   4.2605  127.211   4.2970 -10.44691 6.051060 
1 1 1    4   16   20 o  116.498   3.4431  282.240   16.435  263.889   24.179  298.000   22.407  112.936   5.1908  120.061   4.5250 -7.124352 6.886264 
1 1 1    4   16   21 o  157.212   2.8415  509.882   18.363  500.367   24.865  521.295   27.234  155.613   3.8741  158.810   4.1578 -3.197006 5.682971 
1 1 1    4   16   22 o  133.534   3.0705  369.481   16.873  385.680   23.439  352.060   24.307  136.593   4.1606  130.476   4.5169 6.117065 6.141098 
1 1 1    4   16   23 o   94.169   3.8799  184.623   14.831  178.273   22.899  189.211   19.465   92.727   5.9875   95.612   4.9361 -2.884567 7.759837 
1 1 1    4   16   24 o  133.864   3.0326  369.239   16.707  391.361   24.636  350.403   22.733  137.558   4.3424  130.170   4.2343 7.387558 6.065103 
1 1 1    4   16   25 o   66.758   5.8660   93.362   15.863   90.598   24.683   95.306   20.704   65.838   9.0899   67.678   7.4172 -1.839989 11.73206 
1 1 1    4   16   26 o   20.789   6.6729 -19.1412   13.948 -52.9653   22.578   1.7341   17.737   17.095   8.4748   24.484   10.310 -7.388674 13.34575 
1 1 1    4   16   27 o   43.392   8.8479   38.154   16.479   28.754   20.771   54.117   27.068   37.223   11.942   49.560   13.059 -12.33735 17.69576 
1 1 1    4   16   28 o  101.936   4.0208  215.693   16.900  208.888   23.766  222.654   24.037  100.303   5.7448  103.570   5.6270 -3.266464 8.041517 
1 1 1    4   16   29 o   38.711   8.0872   29.403   15.039   51.298   22.201   10.839   20.443   48.204   11.354   29.219   11.520 18.98519 16.17449 
1 1 1    4   16   30 o  179.835   4.0252  673.060   29.854  681.206   42.251  664.937   42.190  180.931   5.6619  178.740   5.7230 2.191010 8.050415 
1 1 1    4   16   31 o   70.389   5.9130  106.170   16.863   89.597   24.856  120.304   22.954   65.040   9.2659   75.737   7.3483 -10.69687 11.82596 
1 1 1    4   16   32 o  122.368   4.2478  312.140   21.392  340.481   31.375  287.522   29.242  127.549   5.9641  117.186   6.0501 10.36346 8.495527 
1 1 1    4   16   33 o   31.261   9.0677   10.403   18.732   3.1152   29.175   15.515   24.434   30.420   13.030   32.102   12.614 -1.681908 18.13545 
1 1 1    4   16   34 o   71.432   6.6712  107.813   19.081  122.943   31.720   99.234   23.885   74.929   10.264   67.935   8.5244 6.994774 13.34234 
1 1 1    4   16   35 o   43.477   10.452   35.137   23.498   11.887   29.941   72.427   37.918   32.717   13.556   54.236   15.913 -21.51894 20.90442 
1 1 1    4   16   36 o   46.703   9.4145   51.209   18.586   44.286   23.482   62.821   30.412   43.028   12.494   50.378   14.087 -7.349930 18.82897 
1 1 1    4   16   37 o   20.220   6.8736 -40.1003   17.821 -11.9804   23.804 -75.9609   26.881   23.497   10.786   16.943   8.5239 6.553596 13.74727 
1 1 1    4   16   38 o   26.637   8.2137   1.0312   16.975  -1.6828   25.129   3.3091   23.022   26.482   11.703   26.793   11.528 -0.3116989 16.42735 
1 1 1    4   16   39 o   66.794   6.5456  100.156   17.981  100.284   26.412  100.045   24.547   66.621   9.6121   66.967   8.8874 -0.3461151 13.09111 
1 1 1    4   16   40 o   32.646   9.6717   14.798   22.647  -1.6940   34.144   27.753   30.262   29.533   13.304   35.760   14.042 -6.226940 19.34336 
1 1 1    4   16   41 o   33.759   8.4042   22.051   16.468   46.460   23.742  -0.5801   22.861   42.521   12.623   24.997   11.099 17.52333 16.80835 
1 1 1    4   16   42 o   36.173   9.1204   33.817   17.965   19.842   28.273   43.279   23.265   31.909   13.193   40.437   12.596 -8.528713 18.24086 
1 1 1    4   16   43 o   21.161   7.1132 -18.7433   16.873 -11.1531   21.512 -30.8785   27.200   21.371   9.9634   20.952   10.155 0.4193535 14.22642 
1 1 1    4   16   44 o   29.839   8.5560   19.138   16.573   25.482   23.546   12.910   23.331   31.925   12.429   27.752   11.762 4.172714 17.11201 
1 1 1    4   16   45 o   38.522   8.4117   38.863   17.502   8.3633   24.399   71.194   25.121   26.410   11.607   50.634   12.178 -24.22396 16.82331 
1 1 1    4   16   46 o   21.520   7.4032 -26.9993   20.727 -26.5665   31.521 -27.3291   27.511   22.314   10.842   20.726   10.084 1.587694 14.80648 
1 1 1    4   16   47 o   21.976   7.6244 -36.3237   24.397 -71.7516   37.369 -10.0059   32.208   19.837   9.9883   24.115   11.522 -4.278448 15.24872 
1 1 1    4   16   48 o   30.286   9.0367   16.773   21.438   60.381   32.413 -17.1351   28.582   38.900   14.724   21.671   10.481 17.22898 18.07346 
1 1 1    4   17    0 o  434.824   3.7755  3903.46   95.724  3903.46   95.724  3903.46   95.724  434.824   5.3394  434.824   5.3394 0.000000 0.000000 
1 1 1    4   17    1 o  173.286   2.0146  619.186   14.395  606.544   20.077  632.558   20.649  171.467   2.8390  175.105   2.8591 -3.637955 4.029140 
1 1 1    4   17    2 o  260.864   2.5406  1405.09   27.014  1410.03   35.618  1398.39   41.450  261.418   3.3034  260.311   3.8607 1.106354 5.081103 
1 1 1    4   17    3 o  220.239   2.1711  1000.80   19.720  1008.92   27.806  992.583   27.971  221.138   3.0486  219.339   3.0919 1.799088 4.342140 
1 1 1    4   17    4 o  624.695   4.5643  8059.32  113.560  8045.81  143.031  8082.36  186.782  624.152   5.5562  625.239   7.2431 -1.087280 9.128696 
1 1 1    4   17    5 o  355.113   3.0640  2607.18   44.496  2636.09   59.372  2570.12   67.208  357.385   4.0279  352.840   4.6183 4.544861 6.128015 
1 1 1    4   17    6 o  253.005   2.9442  1320.65   30.723  1320.65   30.723   0.0000   0.0000  253.005   2.9442  ?   ?       ?      ? 
1 1 1    4   17    7 o  148.301   2.9042  464.568   16.529  484.679   20.236  424.244   28.653  153.263   3.2012  143.338   4.8467 9.925125 5.808427 
1 1 1    4   17    8 o  277.244   3.0441  1564.48   30.224  1542.36   34.827  1631.96   60.826  273.404   3.0885  281.085   5.2467 -7.681976 6.088261 
1 1 1    4   17    9 o  123.888   2.4284  310.557   12.249  280.385   15.848  355.324   19.304  116.564   3.2963  131.213   3.5669 -14.64826 4.856841 
1 1 1    4   17   10 o  265.831   2.5410  1463.69   27.026  1480.32   34.384  1436.79   43.714  267.841   3.1125  263.820   4.0174 4.021118 5.082073 
1 1 1    4   17   11 o   72.349   3.2343  108.391   9.6218  113.091   13.291  103.215   13.947   74.006   4.3543   70.692   4.7836 3.314392 6.468606 
1 1 1    4   17   12 o   51.453   4.3866   57.594   8.8375   41.162   13.397   70.252   11.759   44.590   7.2847   58.315   4.8889 -13.72521 8.773136 
1 1 1    4   17   13 o  119.678   2.7069  292.899   13.278  271.870   17.615  320.565   20.205  114.755   3.7217  124.601   3.9316 -9.845894 5.413721 
1 1 1    4   17   14 o   65.298   3.3941   89.924   8.8993   97.935   11.669   78.789   13.758   68.863   4.1086   61.733   5.4036 7.129772 6.788154 
1 1 1    4   17   15 o  106.242   2.6952  231.850   11.575  226.958   14.878  239.351   18.422  104.844   3.4407  107.639   4.1496 -2.795097 5.390495 
1 1 1    4   17   16 o  183.941   2.5899  704.630   19.448  750.914   26.268  648.482   28.932  190.704   3.3397  177.177   3.9593 13.52776 5.179701 
1 1 1    4   17   17 o  258.971   2.6328  1374.69   26.913  1349.88   33.367  1420.89   45.526  255.707   3.1638  262.236   4.2092 -6.529297 5.265682 
1 1 1    4   17   18 o  147.916   2.7557  452.035   16.767  452.994   22.907  450.929   24.609  148.094   3.7503  147.737   4.0386 0.3565063 5.511354 
1 1 1    4   17   19 o   88.548   3.1220  166.775   10.808  178.622   13.586  146.353   17.836   92.994   3.5421   84.102   5.1420 8.891869 6.243908 
1 1 1    4   17   20 o  115.254   3.1520  274.072   14.957  265.463   20.437  284.001   21.948  113.315   4.3728  117.193   4.5408 -3.878159 6.303957 
1 1 1    4   17   21 f  120.293   3.5160  297.199   17.348  279.298   23.109  320.315   26.260  116.186   4.8224  124.400   5.1181 -8.213486 7.032069 
1 1 1    4   17   22 o   81.987   3.8723  137.578   12.921  173.042   19.362  109.106   17.349   91.421   5.1349   72.553   5.7975 18.86757 7.744575 
1 1 1    4   17   23 o  246.109   2.9023  1253.42   29.279  1262.15   39.366  1242.61   43.802  247.105   3.8626  245.112   4.3328 1.993530 5.804537 
1 1 1    4   17   24 o  131.253   3.4806  354.663   18.373  365.650   29.661  347.822   23.404  132.839   5.4137  129.668   4.3762 3.171555 6.961212 
1 1 1    4   17   25 o  184.955   2.8209  707.099   21.512  718.245   30.894  696.608   29.973  186.365   4.0193  183.544   3.9593 2.820999 5.641895 
1 1 1    4   17   26 o   95.921   4.4102  195.696   16.807  171.951   26.732  211.218   21.614   90.888   7.1312  100.953   5.1909 -10.06517 8.820410 
1 1 1    4   17   27 o   93.504   4.7746  179.646   18.093  170.189   23.248  194.173   28.813   90.488   6.2292   96.521   7.2377 -6.033669 9.549191 
1 1 1    4   17   28 o   96.009   4.2362  192.384   16.698  183.136   24.447  200.470   22.861   93.793   6.3197   98.225   5.6429 -4.431938 8.472387 
1 1 1    4   17   29 o  152.132   3.2375  478.822   20.288  508.490   29.576  452.453   27.882  156.571   4.5799  147.693   4.5772 8.878540 6.475058 
1 1 1    4   17   30 o   27.457   8.1694   2.9501   15.863  -3.6104   23.683   8.2886   21.364   26.287   11.497   28.627   11.609 -2.339798 16.33871 
1 1 1    4   17   31 o  113.621   3.9793  269.799   18.633  263.385   26.679  275.907   26.035  112.268   5.7618  114.975   5.4902 -2.707329 7.958651 
1 1 1    4   17   32 o   83.745   5.4445  149.371   18.292  107.910   25.193  195.605   26.603   71.111   8.5896   96.379   6.6924 -25.26835 10.88898 
1 1 1    4   17   33 o   35.039   8.8058   24.624   16.175   31.702   23.211   17.942   22.553   37.970   12.652   32.108   12.251 5.862068 17.61166 
1 1 1    4   17   34 o   42.147   8.2818   41.260   18.489   70.188   23.613  -4.5783   29.724   55.715   10.664   28.579   12.674 27.13601 16.56352 
1 1 1    4   17   35 o   59.481   8.3474   76.672   18.762  104.174   33.599   64.211   22.616   66.247   12.760   52.715   10.766 13.53125 16.69474 
1 1 1    4   17   36 o   81.109   5.4013  141.963   18.046  132.965   24.904  151.910   26.185   78.376   7.7042   83.841   7.5724 -5.464996 10.80254 
1 1 1    4   17   37 o   34.908   8.7990   21.308   17.785   45.714   25.723  -1.0450   24.618   43.373   13.199   26.443   11.639 16.92962 17.59808 
1 1 1    4   17   38 o   36.924   8.9018   32.148   16.315   36.284   23.221   28.115   22.929   38.704   12.644   35.144   12.534 3.559731 17.80360 
1 1 1    4   17   39 o   55.969   7.4591   73.166   16.823   83.562   24.321   63.628   23.296   60.612   9.7288   51.327   11.310 9.285336 14.91829 
1 1 1    4   17   40 o   25.713   8.0515  -1.7048   17.247 -12.1923   24.716   8.2477   24.077   23.408   10.833   28.017   11.915 -4.609385 16.10304 
1 1 1    4   17   41 o   53.579   8.7781   72.971   18.733   82.057   29.683   66.956   24.150   55.724   13.130   51.434   11.654 4.290024 17.55623 
1 1 1    4   17   42 o   24.641   8.0059  -6.7197   18.619 -12.7795   28.286  -2.0865   24.733   24.329   11.370   24.953   11.274 -0.6241093 16.01188 
1 1 1    4   17   43 o   24.194   8.5248 -33.1421   20.364 -38.5755   22.204  -4.3709   51.094   17.324   8.5544   31.064   14.748 -13.74004 17.04969 
1 1 1    4   17   44 o   26.333   8.2503  -0.4784   17.976 -16.9388   23.228   24.099   28.383   20.839   9.9085   31.828   13.194 -10.98890 16.50058 
1 1 1    4   17   45 o   23.139   7.6940 -11.5418   18.558 -23.0181   24.464   4.0160   28.484   20.092   9.7120   26.186   11.936 -6.093630 15.38802 
1 1 1    4   17   46 o   25.098   8.2935  -4.5355   21.803 -21.8001   32.069   10.304   29.732   22.871   11.071   27.324   12.352 -4.452698 16.58706 
1 1 1    4   17   47 f   31.785   9.7233   31.248   24.500   9.0474   34.714   53.281   34.583   27.097   12.641   36.473   14.778 -9.375116 19.44662 
1 1 1    4   18    0 o   55.545   2.8921   64.683   9.2532   64.683   9.2532   64.683   9.2532   55.545   4.0900   55.545   4.0900 0.000000 0.000000 
1 1 1    4   18    1 o  246.037   2.6601  1249.14   26.991  1262.86   38.518  1235.91   37.834  247.363   3.7754  244.711   3.7485 2.652115 5.320259 
1 1 1    4   18    2 o  346.186   2.9961  2476.29   42.363  2490.81   56.220  2457.23   64.437  347.386   3.9239  344.986   4.5287 2.400055 5.992121 
1 1 1    4   18    3 o  351.162   2.8016  2545.36   40.576  2553.35   57.344  2537.34   57.424  351.715   3.9530  350.609   3.9710 1.106171 5.603183 
1 1 1    4   18    4 o  125.426   2.7797  330.929   12.633  338.034   14.780  311.666   24.337  128.000   2.7996  122.851   4.8031 5.149345 5.559458 
1 1 1    4   18    5 o   80.488   2.4568  127.396   7.4780  118.817   8.8128  149.458   14.132   75.887   2.8157   85.090   4.0269 -9.202812 4.913651 
1 1 1    4   18    6 f  227.714   2.4539  1074.50   22.849  1106.73   30.648  1034.16   34.285  231.587   3.2086  223.841   3.7136 7.746124 4.907743 
1 1 1    4   18    7 o  242.407   2.8810  1202.81   25.036  1192.50   28.903  1233.80   50.103  240.406   2.9150  244.407   4.9703 -4.001312 5.762028 
1 1 1    4   18    8 o  228.965   2.8625  1067.84   23.252  1054.29   26.679  1110.69   47.424  226.044   2.8616  231.887   4.9586 -5.842682 5.725049 
1 1 1    4   18    9 o  147.577   2.9904  463.520   16.398  483.261   19.591  417.330   29.968  153.029   3.1040  142.125   5.1123 10.90453 5.980834 
1 1 1    4   18   10 o  219.195   2.3884  989.437   20.750  983.614   25.935  999.793   34.589  218.327   2.8802  220.063   3.8109 -1.735931 4.776864 
1 1 1    4   18   11 o  170.190   3.0015  597.748   21.069  597.748   21.069   0.0000   0.0000  170.190   3.0015  ?   ?       ?      ? 
1 1 1    4   18   12 o  163.058   2.4716  549.509   16.531  555.087   22.309  542.718   24.619  163.986   3.2985  162.130   3.6816 1.856277 4.943105 
1 1 1    4   18   13 o  168.378   2.5464  574.791   17.356  533.936   22.183  639.283   27.871  160.818   3.3444  175.938   3.8409 -15.11974 5.092858 
1 1 1    4   18   14 o   79.479   2.9355  131.330   9.4655  135.383   12.429  125.734   14.606   80.963   3.7220   77.995   4.5404 2.967262 5.870978 
1 1 1    4   18   15 o  124.336   2.8092  320.694   13.657  323.616   16.862  315.121   23.284  125.197   3.2654  123.474   4.5720 1.722977 5.618409 
1 1 1    4   18   16 o  347.849   2.9896  2501.97   41.516  2507.40   52.521  2492.92   67.779  348.439   3.6546  347.259   4.7323 1.179382 5.979228 
1 1 1    4   18   17 o   88.974   3.6406  162.602   13.186  170.785   20.574  156.897   17.178   90.841   5.4912   87.107   4.7814 3.734306 7.281189 
1 1 1    4   18   18 o  415.212   3.8673  3601.90   60.472  3650.82   72.348  3488.47  110.159  420.273   4.1738  410.151   6.5119 10.12186 7.734691 
1 1 1    4   18   19 o   74.650   3.2565  113.972   9.6026  110.955   11.895  119.617   16.272   73.276   3.9358   76.024   5.1894 -2.748466 6.513097 
1 1 1    4   18   20 o  152.565   2.8107  483.330   17.604  519.816   24.426  443.893   25.394  158.605   3.7339  146.525   4.2020 12.07938 5.621334 
1 1 1    4   18   21 o  175.644   2.6901  636.119   18.923  631.457   24.001  643.779   30.764  174.840   3.3283  176.447   4.2273 -1.607330 5.380262 
1 1 1    4   18   22 o   80.583   4.1350  134.592   13.738  139.997   19.613  129.387   19.249   82.175   5.7867   78.991   5.9082 3.184196 8.269996 
1 1 1    4   18   23 o   33.516   7.7274   22.795   12.433   17.286   18.307   27.512   16.938   31.105   11.189   35.927   10.661 -4.822264 15.45484 
1 1 1    4   18   24 o  174.090   3.9131  630.463   27.962  602.943   41.074  654.235   38.174  170.484   5.8413  177.695   5.2086 -7.211121 7.826284 
1 1 1    4   18   25 o  149.842   3.1985  463.321   19.735  439.060   26.983  491.224   28.937  145.642   4.4920  154.043   4.5546 -8.400925 6.397032 
1 1 1    4   18   26 f   85.413   4.3517  150.201   15.245  174.008   22.735  130.751   20.550   91.520   6.0231   79.307   6.2825 12.21238 8.703300 
1 1 1    4   18   27 o   39.171   8.4739   27.012   15.833   54.514   25.647   10.074   20.127   49.561   12.537   28.780   11.404 20.78059 16.94788 
1 1 1    4   18   28 o   88.227   4.5734  164.889   16.340  132.164   23.484  195.599   22.750   79.495   7.1625   96.959   5.6889 -17.46377 9.146884 
1 1 1    4   18   29 o   77.758   5.4436  127.239   17.368  123.328   25.666  130.543   23.589   76.575   8.1265   78.941   7.2450 -2.366119 10.88716 
1 1 1    4   18   30 f   77.850   5.1511  126.872   16.491  137.206   24.484  118.291   22.311   80.720   7.3541   74.979   7.2146 5.741127 10.30212 
1 1 1    4   18   31 o   55.255   8.3604   65.300   18.201   49.533   23.004   91.695   29.763   46.647   11.914   63.862   11.732 -17.21547 16.72086 
1 1 1    4   18   32 o   53.072   12.336   56.591   25.007   93.217   61.793   49.417   27.347   60.105   20.641   46.039   13.516 14.06620 24.67210 
1 1 1    4   18   33 o   51.203   8.3355   59.904   17.263   71.311   25.578   50.362   23.395   55.815   11.494   46.591   12.075 9.223431 16.67096 
1 1 1    4   18   34 o   27.235   8.0620   5.1109   15.555  -4.1470   22.654   13.369   21.396   24.856   11.042   29.613   11.750 -4.756330 16.12390 
1 1 1    4   18   35 o   84.530   5.5801  159.756   18.527  135.336   29.679  175.346   23.714   78.336   9.1860   90.723   6.3376 -12.38754 11.16013 
1 1 1    4   18   36 o   77.366   7.0754  147.175   19.534  182.023   25.081   93.444   31.144   92.253   6.5918   62.480   12.522 29.77226 14.15072 
1 1 1    4   18   37 o   54.542   7.7538   69.910   16.741   73.000   25.274   67.495   22.347   55.336   11.451   53.747   10.457 1.589199 15.50769 
1 1 1    4   18   38 o   30.349   8.4916   16.188   15.801   19.399   22.500   13.065   22.195   31.533   12.184   29.165   11.831 2.368380 16.98329 
1 1 1    4   18   39 o   39.115   9.7841   38.275   19.613   40.467   29.602   36.560   26.185   39.898   14.241   38.333   13.421 1.564823 19.56825 
1 1 1    4   18   40 o   40.182   8.9357   40.989   16.829   30.317   22.932   53.441   24.772   35.143   12.535   45.222   12.738 -10.07881 17.87149 
1 1 1    4   18   41 o   23.993   7.4139  -6.9391   15.993 -40.2645   24.665   17.233   21.007   18.696   9.1903   29.290   11.636 -10.59374 14.82772 
1 1 1    4   18   42 o   28.295   8.0218   11.466   15.490   31.162   22.410  -6.5531   21.435   34.391   12.378   22.199   10.207 12.19208 16.04361 
1 1 1    4   18   43 o   37.146   9.9368   39.346   21.460   25.869   30.078   53.321   30.628   32.704   13.572   41.587   14.517 -8.883171 19.87357 
1 1 1    4   18   44 o   25.767   7.9869   5.5424   16.751   18.620   23.806  -7.2845   23.577   29.029   12.063   22.505   10.471 6.523993 15.97371 
1 1 1    4   18   45 o   31.926   9.5503   28.271   21.665   31.486   31.455   25.368   29.882   32.756   13.758   31.095   13.250 1.661139 19.10053 
1 1 1    4   18   46 o   34.121   9.7893   38.200   21.652   57.026   33.028   24.011   28.673   38.552   14.798   29.689   12.820 8.863659 19.57853 
1 1 1    4   18   47 o   30.618   9.6562   29.906   24.722   26.300   34.073   33.916   35.926   29.848   13.380   31.389   13.926 -1.541643 19.31231 
1 1 1    4   19    0 o  210.559   2.4757  915.405   30.386  915.405   30.386  915.405   30.386  210.559   3.5011  210.559   3.5011 0.000000 0.000000 
1 1 1    4   19    1 o  234.074   2.9141  1104.56   27.121  1229.00   45.801  1037.38   33.655  243.959   4.5519  224.189   3.6397 19.76985 5.828188 
1 1 1    4   19    2 o  140.766   1.9859  407.634   11.508  389.886   15.699  428.252   16.921  137.465   2.7689  144.068   2.8476 -6.602707 3.971855 
1 1 1    4   19    3 o  326.253   2.6845  2196.84   36.109  2186.29   50.306  2208.06   51.861  325.449   3.7477  327.057   3.8446 -1.608185 5.369051 
1 1 1    4   19    4 o  134.997   3.0120  372.224   16.396  357.890   20.901  395.160   26.438  131.670   3.8487  138.325   4.6342 -6.654678 6.023934 
1 1 1    4   19    5 o  185.874   2.5665  715.737   18.633  721.295   22.972  705.047   31.858  186.961   2.9791  184.787   4.1801 2.174255 5.133019 
1 1 1    4   19    6 o  371.545   3.4191  2851.44   52.390  2873.66   74.699  2829.94   73.498  372.967   4.8560  370.124   4.8147 2.842560 6.838233 
1 1 1    4   19    7 o  140.302   2.8715  400.837   14.720  394.513   17.141  418.600   28.729  138.264   3.0059  142.340   4.8936 -4.075699 5.743073 
1 1 1    4   19    8 o  253.233   3.0326  1330.70   29.503  1341.89   35.806  1307.03   52.065  254.969   3.4049  251.497   5.0194 3.471939 6.065264 
1 1 1    4   19    9 o  170.300   2.2313  605.411   15.129  626.274   19.231  571.535   24.506  174.214   2.6765  166.387   3.5710 7.826996 4.462663 
1 1 1    4   19   10 o  126.638   2.2667  331.981   11.340  334.356   14.162  327.736   18.933  127.288   2.6975  125.987   3.6436 1.301651 4.533476 
1 1 1    4   19   11 o  195.455   2.4377  788.106   19.152  785.693   24.465  791.926   30.781  195.096   3.0404  195.814   3.8112 -0.7181702 4.875428 
1 1 1    4   19   12 o  139.033   2.5128  397.971   14.301  389.659   19.004  408.825   21.717  137.374   3.3541  140.691   3.7425 -3.316559 5.025559 
1 1 1    4   19   13 o  101.336   3.7439  218.793   13.680  226.080   16.018  199.157   26.296  104.625   3.7121   98.046   6.5028 6.579353 7.487739 
1 1 1    4   19   14 o  138.218   2.7790  394.583   15.806  359.721   22.089  431.165   22.627  131.954   4.0587  144.481   3.7971 -12.52684 5.557924 
1 1 1    4   19   15 o   74.040   3.2083  112.911   9.5057  111.664   12.031  114.984   15.508   73.518   3.9676   74.562   5.0428 -1.043503 6.416530 
1 1 1    4   19   16 o  194.286   2.5744  782.256   20.538  811.498   28.083  748.636   30.112  198.220   3.4350  190.352   3.8355 7.867737 5.148820 
1 1 1    4   19   17 o  250.425   2.7114  1299.65   27.795  1329.83   37.345  1262.17   41.618  253.727   3.5686  247.123   4.0833 6.603867 5.422889 
1 1 1    4   19   18 o  226.970   2.5489  1063.98   23.043  1063.15   29.035  1065.40   37.877  226.903   3.1025  227.037   4.0449 -0.1343384 5.097715 
1 1 1    4   19   19 o   78.281   4.8904  125.507   14.408  123.019   17.091  131.620   26.787   77.069   5.3768   79.494   8.1702 -2.424843 9.780739 
1 1 1    4   19   20 o  121.722   2.9253  298.354   13.535  286.518   16.103  326.853   24.987  117.772   3.3150  125.672   4.8208 -7.899460 5.850582 
1 1 1    4   19   21 o   92.694   3.6159  178.698   13.763  163.113   19.756  193.394   19.184   88.728   5.3986   96.660   4.8119 -7.931915 7.231872 
1 1 1    4   19   22 o   46.609   4.9002   43.962   8.8797   41.745   10.756   48.707   15.736   44.867   5.8123   48.352   7.8908 -3.484547 9.800337 
1 1 1    4   19   23 o   81.605   4.2861  139.612   14.231  114.212   20.230  164.496   20.024   74.132   6.6165   89.078   5.4502 -14.94527 8.572172 
1 1 1    4   19   24 o   85.322   4.7086  150.039   16.469  128.990   22.256  175.514   24.484   78.745   6.8526   91.899   6.4595 -13.15390 9.417198 
1 1 1    4   19   25 f   73.470   4.8073  111.176   14.487  125.335   21.893  100.147   19.323   77.582   6.8421   69.358   6.7547 8.223824 9.614533 
1 1 1    4   19   26 f   75.147   4.9361  119.681   15.030  104.610   22.533  131.761   20.173   70.720   7.7251   79.574   6.1466 -8.854271 9.872112 
1 1 1    4   19   27 o   86.137   4.9896  154.968   17.069  155.675   28.249  154.562   21.422   86.134   7.9516   86.141   6.0296 -0.6988525E-02 9.979226 
1 1 1    4   19   28 o   85.661   5.4072  154.484   18.605  156.264   23.843  151.712   29.748   86.468   6.6857   84.853   8.5002 1.615570 10.81442 
1 1 1    4   19   29 o   64.667   8.7832   95.793   19.928   86.713   39.152   98.969   23.152   60.941   15.531   68.392   8.2075 -7.450806 17.56644 
1 1 1    4   19   30 o   92.205   4.5807  178.349   17.393  164.919   24.104  192.935   25.121   88.557   6.5994   95.852   6.3543 -7.294670 9.161327 
1 1 1    4   19   31 o   24.131   7.4687  -8.9233   14.817   10.001   22.286 -23.9172   19.837   29.184   11.849   19.078   9.0950 10.10591 14.93745 
1 1 1    4   19   32 o   96.479   4.6534  195.837   18.430  171.109   25.165  224.440   27.066   89.867   6.7894  103.090   6.3655 -13.22274 9.306788 
1 1 1    4   19   33 o   26.863   8.0259   3.1813   15.770  -8.5179   23.514   12.745   21.260   24.329   10.992   29.398   11.698 -5.069309 16.05182 
1 1 1    4   19   34 o   67.340   5.9301   99.768   16.275   85.001   23.389  113.631   22.662   62.126   9.1277   72.553   7.5730 -10.42708 11.86028 
1 1 1    4   19   35 o   57.897   6.9400   75.663   16.104   86.758   23.187   65.322   22.384   62.741   8.9604   53.054   10.600 9.686852 13.88009 
1 1 1    4   19   36 o   22.992   7.8218 -35.3462   20.857 -41.5997   26.631 -25.4255   33.543   20.177   9.8399   25.807   12.161 -5.629721 15.64365 
1 1 1    4   19   37 o   49.315   7.9516   58.185   15.806   64.087   23.149   53.030   21.634   51.746   11.173   46.885   11.317 4.861671 15.90318 
1 1 1    4   19   38 o   37.266   8.6930   33.963   15.706   27.592   22.642   39.872   21.805   34.506   12.440   40.026   12.146 -5.520435 17.38603 
1 1 1    4   19   39 o   34.750   9.2224   24.658   18.534   44.205   28.173   9.7452   24.608   41.002   13.939   28.498   12.079 12.50365 18.44479 
1 1 1    4   19   40 o   28.759   8.1262   13.831   15.398   0.0504   22.456   26.060   21.154   24.623   10.963   32.895   11.999 -8.271870 16.25246 
1 1 1    4   19   41 o   59.951   7.2583   89.938   16.917   73.805   25.667  102.328   22.494   53.085   12.005   66.816   8.1625 -13.73080 14.51669 
1 1 1    4   19   42 o   31.216   8.3428   23.142   15.380   11.270   22.033   34.426   21.480   26.882   11.414   35.549   12.171 -8.666815 16.68563 
1 1 1    4   19   43 o   25.460   8.1753   1.3552   18.211   2.4320   29.517   0.6934   23.140   26.709   12.165   24.211   10.925 2.498621 16.35070 
1 1 1    4   19   44 o   22.818   7.2155 -16.6680   16.367   23.022   22.967 -57.6152   23.328   29.928   12.072   15.708   7.9073 14.21939 14.43102 
1 1 1    4   19   45 o   28.652   8.7951   13.844   21.134 -14.8433   31.503   37.323   28.500   23.436   11.250   33.867   13.522 -10.43158 17.59015 
1 1 1    4   19   46 o   26.548   8.5534   10.050   20.569   22.441   30.914   0.2060   27.554   29.020   12.894   24.075   11.242 4.944675 17.10673 
1 1 1    4   20    0 o   77.751   2.1465  125.281   9.7007  125.281   9.7007  125.281   9.7007   77.751   3.0356   77.751   3.0356 0.000000 0.000000 
1 1 1    4   20    1 o  317.901   3.0386  2086.68   39.827  2068.80   55.476  2105.68   57.212  316.502   4.2497  319.301   4.3443 -2.798126 6.077276 
1 1 1    4   20    2 o  207.466   2.1312  888.336   18.235  893.311   25.655  883.257   25.922  208.054   2.9898  206.878   3.0380 1.176483 4.262406 
1 1 1    4   20    3 f  452.370   3.3684  4227.93   62.847  4229.17   88.713  4226.68   89.046  452.438   4.7540  452.301   4.7733 0.1364746 6.736856 
1 1 1    4   20    4 o  162.336   2.2158  543.947   14.718  543.566   22.256  544.243   19.621  162.277   3.3252  162.395   2.9295 -0.1177216 4.431551 
1 1 1    4   20    5 o  434.177   4.2491  3894.97   74.403  3877.43   95.584  3921.93  118.520  433.079   5.3512  435.276   6.6018 -2.197083 8.498203 
1 1 1    4   20    6 o  316.323   3.4961  2067.57   44.454  2065.81   56.821  2070.34   71.373  316.228   4.3565  316.418   5.4690 -0.1895752 6.992102 
1 1 1    4   20    7 o  264.948   3.0659  1462.84   31.442  1487.45   38.509  1413.63   54.459  268.407   3.4786  261.490   5.0495 6.917236 6.131717 
1 1 1    4   20    8 o  262.616   3.0637  1447.69   31.394  1498.56   38.955  1353.42   53.026  269.393   3.5060  255.840   5.0253 13.55365 6.127396 
1 1 1    4   20    9 o  131.766   3.0216  364.392   14.450  370.857   16.906  346.862   27.839  134.033   3.0582  129.498   5.2123 4.535233 6.043217 
1 1 1    4   20   10 o  289.161   4.0553  1766.62   35.924  1785.04   39.432  1676.70   87.122  294.039   3.2515  284.283   7.4304 9.755585 8.110657 
1 1 1    4   20   11 o   37.498   3.4852   29.279   5.3519   32.070   7.4031   26.224   7.7460   39.390   4.5568   35.606   5.2746 3.784397 6.970383 
1 1 1    4   20   12 o  220.614   2.4253  1007.10   21.275  1013.00   26.786  997.022   35.016  221.530   2.9316  219.699   3.8643 1.831146 4.850523 
1 1 1    4   20   13 o  173.471   2.4810  623.552   17.647  643.403   23.933  599.896   26.125  176.522   3.2872  170.420   3.7168 6.102524 4.961900 
1 1 1    4   20   14 o  246.093   2.8695  1246.20   29.034  1187.84   39.223  1316.95   43.182  239.758   3.9664  252.428   4.1476 -12.67014 5.738945 
1 1 1    4   20   15 o  191.929   2.4179  762.014   18.396  765.157   23.056  756.507   30.518  192.516   2.9037  191.342   3.8670 1.173553 4.835810 
1 1 1    4   20   16 o  300.589   2.9126  1872.79   35.866  1916.20   48.332  1819.59   53.507  304.521   3.8482  296.658   4.3731 7.862885 5.825121 
1 1 1    4   20   17 o  149.005   2.8998  459.623   17.771  418.345   25.038  501.532   25.228  142.239   4.2679  155.772   3.9268 -13.53311 5.799536 
1 1 1    4   20   18 f  142.337   2.6286  415.239   15.205  399.616   19.715  438.178   23.889  139.081   3.4368  145.592   3.9783 -6.511765 5.257240 
1 1 1    4   20   19 o   43.064   7.0221   52.027   10.354   59.122   11.227   11.679   26.774   53.435   5.0942   32.694   13.088 20.74110 14.04428 
1 1 1    4   20   20 o   81.536   3.4584  137.658   10.964  137.702   13.431  137.570   18.983   81.609   3.9903   81.464   5.6498 0.1451416 6.916864 
1 1 1    4   20   21 o   72.291   3.5909  109.165   10.173  111.301   12.628  105.216   17.169   73.358   4.1736   71.225   5.8447 2.133316 7.181888 
1 1 1    4   20   22 o  113.229   2.9331  259.016   13.142  244.465   16.218  286.836   22.426  108.749   3.6159  117.709   4.6192 -8.960052 5.866170 
1 1 1    4   20   23 o  125.689   3.3303  331.815   16.457  343.506   20.596  311.165   27.372  128.880   3.8746  122.498   5.4176 6.382156 6.660564 
1 1 1    4   20   24 o  157.833   3.8671  525.777   23.256  540.833   28.193  493.716   41.140  161.633   4.2291  154.035   6.4756 7.598053 7.734267 
1 1 1    4   20   25 o   31.844   8.0945   15.186   15.308  -8.2853   23.799   31.751   19.993   25.275   11.267   38.412   11.625 -13.13660 16.18891 
1 1 1    4   20   26 o  129.586   4.1379  354.829   20.284  336.300   36.421  363.160   24.422  126.840   6.9619  132.331   4.4745 -5.490891 8.275865 
1 1 1    4   20   27 o  103.322   4.1150  222.984   17.476  202.613   24.781  243.135   24.647   98.564   6.0959  108.079   5.5292 -9.514702 8.229990 
1 1 1    4   20   28 o   75.270   7.5511  135.777   19.733  155.009   23.947   95.087   34.832   85.933   6.7566   64.608   13.506 21.32577 15.10213 
1 1 1    4   20   29 o  106.090   3.9402  237.217   17.096  207.887   24.624  264.510   23.753   99.593   5.9946  112.587   5.1153 -12.99364 7.880472 
1 1 1    4   20   30 o   87.966   4.4862  164.254   16.149  147.291   23.447  179.565   22.276   83.469   6.8106   92.462   5.8412 -8.992561 8.972455 
1 1 1    4   20   31 o   32.775   8.2840   19.844   15.983  -7.9825   27.140   34.619   19.776   26.556   11.920   38.994   11.507 -12.43830 16.56801 
1 1 1    4   20   32 o   76.121   5.0009  124.157   15.614  112.794   22.484  134.743   21.701   72.580   7.5109   79.662   6.6048 -7.081917 10.00184 
1 1 1    4   20   33 o   34.727   8.5567   26.183   15.299   32.878   21.333   19.092   21.952   37.656   12.104   31.798   12.098 5.858633 17.11336 
1 1 1    4   20   34 o   58.706   6.9483   79.422   15.960   68.552   24.388   87.565   21.108   53.992   11.314   63.421   8.0694 -9.429573 13.89655 
1 1 1    4   20   35 o   57.865   6.7595   75.583   15.739   72.417   22.741   78.493   21.804   56.072   10.209   59.657   8.8617 -3.585213 13.51892 
1 1 1    4   20   36 o   40.085   9.0822   40.682   18.253   19.308   30.134   53.070   22.941   33.592   13.725   46.578   11.899 -12.98648 18.16447 
1 1 1    4   20   37 o   34.399   8.5709   24.562   18.073   45.828   22.798 -11.4058   29.649   42.823   12.275   25.976   11.966 16.84707 17.14176 
1 1 1    4   20   38 o   30.008   8.2023   14.143   15.775  -4.2315   22.617   31.553   22.015   24.046   10.830   35.969   12.322 -11.92254 16.40468 
1 1 1    4   20   39 o   29.494   7.9163   13.721   15.067  -7.7294   21.567   34.169   21.057   22.400   10.276   36.588   12.044 -14.18775 15.83264 
1 1 1    4   20   40 f   32.506   8.4321   24.325   15.224   36.132   22.341   14.089   20.801   37.026   12.414   27.985   11.415 9.040333 16.86427 
1 1 1    4   20   41 o   20.962   6.9662 -13.0774   15.446  -8.2447   21.455 -18.2777   22.256   21.707   10.062   20.216   9.6367 1.491066 13.93248 
1 1 1    4   20   42 o   26.516   7.9052   6.4997   16.022 -12.9310   22.781   25.519   22.538   21.337   10.045   31.696   12.209 -10.35869 15.81037 
1 1 1    4   20   43 o   39.678   8.1303   43.738   17.204   9.6616   24.644   76.138   24.030   26.445   11.643   52.910   11.351 -26.46489 16.26058 
1 1 1    4   20   44 o   27.991   8.8211   11.089   21.373  -6.4351   31.008   26.949   29.499   24.729   11.665   31.253   13.235 -6.523842 17.64216 
1 1 1    4   20   45 o   31.668   9.2038   25.981   20.986   57.643   30.989  -0.8415   28.523   39.052   14.476   24.285   11.371 14.76681 18.40768 
1 1 1    4   21    0 o  178.535   3.0115  659.076   31.320  659.076   31.320  659.076   31.320  178.535   4.2588  178.535   4.2588 0.000000 0.000000 
1 1 1    4   21    1 o  236.350   2.5932  1152.56   25.249  1133.02   34.743  1174.44   36.756  234.236   3.5963  238.465   3.7371 -4.229858 5.186456 
1 1 1    4   21    2 o   74.209   2.1085  113.589   6.4484  111.640   8.9151  115.729   9.3384   73.543   2.9391   74.876   3.0239 -1.332672 4.216936 
1 1 1    4   21    3 o  362.724   2.8679  2715.17   42.851  2663.69   58.908  2773.02   62.448  359.089   3.9774  366.359   4.1328 -7.269836 5.735857 
1 1 1    4   21    4 o   92.648   3.5054  192.115   11.226  150.345   21.988  206.842   13.056   85.201   6.2570  100.095   3.1624 -14.89408 7.010820 
1 1 1    4   21    5 o  110.793   2.6432  256.166   11.950  288.439   16.533  220.861   17.292  118.191   3.3917  103.395   4.0550 14.79620 5.286450 
1 1 1    4   21    6 o  161.019   2.9269  529.060   18.457  515.200   22.634  556.566   31.885  157.955   3.4743  164.083   4.7114 -6.128006 5.853898 
1 1 1    4   21    7 o  137.588   3.0646  398.231   16.456  414.338   20.456  368.688   27.704  141.651   3.5014  133.525   5.0305 8.125931 6.129120 
1 1 1    4   21    8 o   43.455   5.8675   37.818   7.7072   36.773   8.3928   43.441   19.471   42.174   4.8250   44.736   10.697 -2.561657 11.73496 
1 1 1    4   21    9 o  182.798   2.8999  698.076   19.865  709.188   23.694  671.789   36.444  185.346   3.0995  180.249   4.9022 5.096329 5.799882 
1 1 1    4   21   10 o   73.922   4.9955   90.870   9.7535   85.171   10.248  145.647   31.773   64.210   3.8697   83.634   9.2111 -19.42342 9.990968 
1 1 1    4   21   11 o   82.291   3.9058  138.211   10.646  136.898   11.893  143.503   23.883   81.413   3.5417   83.169   6.9625 -1.755814 7.811532 
1 1 1    4   21   12 o  111.320   2.3517  254.864   10.323  252.351   12.809  259.522   17.439  110.563   2.8088  112.076   3.7726 -1.513199 4.703423 
1 1 1    4   21   13 o  122.496   2.3068  308.272   11.192  304.207   13.953  315.606   18.743  121.393   2.7869  123.600   3.6767 -2.206520 4.613565 
1 1 1    4   21   14 o   96.521   3.0896  192.586   12.298  189.591   17.254  195.679   17.534   95.758   4.3687   97.283   4.3699 -1.525139 6.179116 
1 1 1    4   21   15 o  137.004   2.3553  386.504   12.810  383.308   16.035  392.141   21.295  136.253   2.8534  137.754   3.7480 -1.501205 4.710582 
1 1 1    4   21   16 o  137.343   2.6436  390.720   14.925  402.862   20.490  376.993   21.786  139.635   3.5577  135.051   3.9112 4.584503 5.287191 
1 1 1    4   21   17 o  282.483   2.7333  1635.93   30.366  1605.64   37.485  1693.76   51.793  278.804   3.2598  286.162   4.3883 -7.357727 5.466551 
1 1 1    4   21   18 o  178.173   3.3491  663.571   23.669  632.484   38.775  682.035   29.883  174.719   5.3808  181.625   3.9892 -6.905945 6.698236 
1 1 1    4   21   19 o   32.672   5.5844   25.690   7.7387   32.930   9.3557   10.003   13.771   39.854   5.6917   25.490   9.6097 14.36375 11.16876 
1 1 1    4   21   20 o  133.593   3.6313  365.459   16.458  362.245   18.548  377.354   35.686  132.402   3.3966  134.785   6.4194 -2.382797 7.262618 
1 1 1    4   21   21 o  194.047   3.4444  764.874   25.296  743.078   30.065  817.689   46.801  189.565   3.8454  198.528   5.7156 -8.963272 6.888821 
1 1 1    4   21   22 o  160.458   3.6095  529.364   22.858  548.443   38.687  519.130   28.333  162.548   5.7705  158.368   4.3377 4.179184 7.218997 
1 1 1    4   21   23 o  218.398   3.4781  985.682   31.128  961.121   41.494  1017.29   47.075  215.355   4.6715  221.441   5.1543 -6.086243 6.956282 
1 1 1    4   21   24 o  238.518   2.9735  1180.93   29.171  1218.77   40.203  1138.85   42.393  242.609   4.0178  234.428   4.3845 8.180771 5.946972 
1 1 1    4   21   25 o   57.351   4.7891   69.034   10.493   69.560   12.682   67.891   18.685   57.843   5.3157   56.859   7.9677 0.9839935 9.578197 
1 1 1    4   21   26 o   87.279   5.7151  171.211   14.512  176.272   15.845  144.856   36.154   92.202   4.1665   82.356   10.644 9.845909 11.43025 
1 1 1    4   21   27 o  153.061   3.2929  485.253   20.739  456.788   28.169  518.939   30.645  148.195   4.6087  157.927   4.7047 -9.732101 6.585898 
1 1 1    4   21   28 o   59.269   8.2845   74.742   20.252   0.0000   0.0000   74.742   20.252  ?   ?    59.269   8.2845      ?      ? 
1 1 1    4   21   29 o   27.456   8.2298  -1.1423   15.990 -11.3063   20.042   16.653   26.520   21.798   9.9656   33.113   13.100 -11.31453 16.45953 
1 1 1    4   21   30 o  104.203   3.8653  229.438   16.494  205.604   23.852  251.280   22.834   98.849   5.8503  109.557   5.0533 -10.70753 7.730600 
1 1 1    4   21   31 o   83.836   5.5287  149.150   18.945  164.312   29.259  138.205   24.859   87.328   8.1235   80.344   7.5018 6.983772 11.05747 
1 1 1    4   21   32 o   83.203   4.6892  147.693   16.070  150.847   23.430  144.892   22.084   83.983   6.7641   82.423   6.4963 1.559929 9.378424 
1 1 1    4   21   33 o   30.266   8.0016   14.357   14.300   30.055   21.033   0.8635   19.500   36.203   12.043   24.329   10.539 11.87423 16.00316 
1 1 1    4   21   34 f   53.922   7.3652   68.600   15.724   53.675   23.637   80.449   21.059   47.233   12.084   60.611   8.4240 -13.37845 14.73047 
1 1 1    4   21   35 o   74.203   5.3015  120.422   16.174  110.767   22.991  129.882   22.756   71.058   7.8447   77.348   7.1332 -6.290009 10.60297 
1 1 1    4   21   36 o   40.998   8.6636   41.782   15.762   40.008   23.640   43.202   21.150   40.097   12.726   41.899   11.759 -1.802212 17.32718 
1 1 1    4   21   37 f   44.973   9.3203   51.005   18.079   45.021   23.146   60.370   28.955   42.144   12.452   47.802   13.871 -5.657188 18.64052 
1 1 1    4   21   38 o   26.155   8.2222  -0.0206   18.135 -10.6750   26.720   9.0798   24.695   24.293   11.250   28.017   11.994 -3.724117 16.44439 
1 1 1    4   21   39 o   32.215   8.4827   24.340   15.189   30.480   22.028   18.773   20.973   34.643   12.293   29.787   11.692 4.856554 16.96534 
1 1 1    4   21   40 o   29.812   8.3142   19.258   15.415   28.180   21.900   10.497   21.702   32.984   12.180   26.641   11.320 6.342581 16.62848 
1 1 1    4   21   41 f   39.768   8.6967   42.723   15.860   32.409   21.008   56.389   24.183   34.645   12.027   44.891   12.565 -10.24553 17.39346 
1 1 1    4   21   42 o   24.177   7.6904  -3.2826   17.338 -27.5822   26.016   16.133   23.255   20.268   9.8482   28.086   11.814 -7.818325 15.38073 
1 1 1    4   21   43 o   38.976   8.9875   46.203   17.014   35.617   23.913   57.056   24.213   34.396   12.723   43.557   12.698 -9.160744 17.97506 
1 1 1    4   21   44 o   28.862   9.8291   3.8548   34.902 -14.1976   50.000   21.010   48.742   27.130   13.284   30.594   14.491 -3.464596 19.65827 
1 1 1    4   21   45 o   31.861   9.4467   34.561   20.844   37.723   30.918   31.927   28.223   32.549   13.654   31.174   13.059 1.375561 18.89342 
1 1 1    4   22    0 o   45.769   2.6053   44.064   6.8516   44.064   6.8516   44.064   6.8516   45.769   3.6845   45.769   3.6845 0.000000 0.000000 
1 1 1    4   22    1 o   52.755   2.8566   57.657   6.0969   58.347   7.9140   56.650   9.5626   53.154   3.6099   52.356   4.4283 0.7973480 5.713287 
1 1 1    4   22    2 o  344.915   2.7721  2455.78   39.404  2417.62   54.472  2497.67   57.068  342.116   3.8604  347.715   3.9793 -5.599701 5.544174 
1 1 1    4   22    3 o  154.543   2.3954  490.610   14.637  502.033   24.609  484.357   18.208  155.901   3.8271  153.185   2.8819 2.715973 4.790826 
1 1 1    4   22    4 o  101.647   2.6419  219.405   10.704  185.587   16.668  243.139   13.964   94.770   4.2644  108.524   3.1197 -13.75414 5.283730 
1 1 1    4   22    5 o  220.158   3.6907  1001.08   33.512  1001.08   33.512   0.0000   0.0000  220.158   3.6907  ?   ?       ?      ? 
1 1 1    4   22    6 o  229.441   2.9063  1090.49   25.464  1095.05   30.714  1080.44   45.539  230.297   3.2336  228.586   4.8302 1.710922 5.812658 
1 1 1    4   22    7 o  187.129   2.8345  716.347   19.750  707.021   23.284  740.262   37.286  185.056   3.0507  189.201   4.7781 -4.145279 5.668962 
1 1 1    4   22    8 o  154.340   2.8454  483.391   16.045  473.510   18.664  511.376   31.409  151.443   2.9881  157.237   4.8433 -5.793442 5.690871 
1 1 1    4   22    9 o  114.251   3.1312  262.839   12.397  257.128   14.046  282.967   26.368  111.594   3.0518  116.909   5.4685 -5.314644 6.262471 
1 1 1    4   22   10 o  151.413   3.1123  478.227   17.622  484.198   20.971  463.879   32.509  153.119   3.3206  149.707   5.2649 3.411652 6.224630 
1 1 1    4   22   11 o  197.604   2.9686  820.749   22.117  841.809   26.566  773.187   39.923  201.903   3.1902  193.306   5.0074 8.597153 5.937258 
1 1 1    4   22   12 o  249.067   3.1010  1285.13   29.363  1288.86   35.281  1276.72   52.965  249.789   3.4245  248.345   5.1709 1.443527 6.202078 
1 1 1    4   22   13 o   66.441   4.8911   87.598   11.124   84.547   12.508   99.139   24.331   63.922   4.7444   68.959   8.5547 -5.036922 9.782195 
1 1 1    4   22   14 o  123.046   2.6828  314.387   13.157  318.809   16.658  307.052   21.453  124.237   3.2509  121.854   4.2687 2.382767 5.365588 
1 1 1    4   22   15 o  126.498   2.6263  331.277   13.634  336.856   18.472  324.599   20.208  127.685   3.5075  125.312   3.9098 2.373436 5.252573 
1 1 1    4   22   16 o  129.084   2.5954  345.767   13.583  352.307   17.745  336.516   21.107  130.591   3.2946  127.577   4.0113 3.013962 5.190842 
1 1 1    4   22   17 o  221.368   3.1916  1008.24   26.207  1000.96   30.866  1027.03   49.605  220.105   3.4000  222.631   5.4022 -2.526337 6.383114 
1 1 1    4   22   18 o  214.502   2.6710  948.125   23.227  934.948   30.091  967.550   36.535  212.710   3.4299  216.294   4.0954 -3.584015 5.341961 
1 1 1    4   22   19 o  121.099   4.6966  305.165   20.399  304.214   40.454  305.490   23.622  120.732   8.1240  121.465   4.7152 -0.7331390 9.393242 
1 1 1    4   22   20 o  125.065   3.3409  326.201   17.110  290.870   24.715  358.716   23.709  118.477   5.0578  131.652   4.3665 -13.17464 6.681830 
1 1 1    4   22   21 o   77.868   4.0076  126.940   12.737  107.138   18.155  146.133   17.874   71.794   6.1312   83.943   5.1626 -12.14985 8.015240 
1 1 1    4   22   22 o  214.624   3.6666  947.069   31.221  924.196   38.915  988.382   52.300  211.197   4.4675  218.050   5.8154 -6.853683 7.333285 
1 1 1    4   22   23 o   95.915   3.4623  189.335   12.579  186.925   15.017  195.004   23.030   95.019   3.8318   96.811   5.7677 -1.791542 6.924545 
1 1 1    4   22   24 o   30.750   6.6072   19.526   8.6512   18.540   10.434   21.695   15.475   29.294   8.2723   32.206   10.305 -2.911779 13.21447 
1 1 1    4   22   25 o   49.917   5.0247   50.822   9.7249   48.228   11.751   56.462   17.325   48.077   5.9260   51.756   8.1161 -3.679333 10.04935 
1 1 1    4   22   26 f   25.214   6.3499   12.059   8.5622   16.764   10.099   0.0331   16.146   27.870   8.2224   22.557   9.6786 5.313589 12.69977 
1 1 1    4   22   27 o   87.452   3.7384  164.284   12.394  172.011   15.053  148.018   21.840   90.980   4.0116   83.925   6.3096 7.054863 7.476882 
1 1 1    4   22   28 o   50.216   5.3940   47.881   10.294   39.802   12.042   69.806   19.839   43.383   6.7300   57.050   8.4314 -13.66688 10.78798 
1 1 1    4   22   29 o   94.387   4.8543  177.975   14.290  172.479   15.621  206.161   35.374   90.988   4.1626   97.785   8.7710 -6.796547 9.708687 
1 1 1    4   22   30 o   83.896   4.7261  149.538   16.346  154.723   23.553  144.720   22.703   85.293   6.6953   82.498   6.6721 2.794548 9.452192 
1 1 1    4   22   31 o   28.827   7.7203   12.437   13.667  -2.5796   19.886   25.881   18.815   23.607   10.423   34.047   11.392 -10.44003 15.44058 
1 1 1    4   22   32 o   31.156   8.1834   18.942   14.064   23.326   20.489   15.036   19.340   33.074   11.843   29.238   11.297 3.835285 16.36682 
1 1 1    4   22   33 o   57.942   6.5867   76.092   15.141   68.102   22.465   82.742   20.495   54.261   10.417   61.622   8.0638 -7.360817 13.17336 
1 1 1    4   22   34 o   25.538   7.3358  -5.6754   14.785 -37.7947   21.052   25.588   20.770   17.365   8.5266   33.712   11.940 -16.34687 14.67166 
1 1 1    4   22   35 o   36.044   8.7358   30.927   15.719   27.432   23.176   33.904   21.391   34.692   12.573   37.396   12.131 -2.704006 17.47151 
1 1 1    4   22   36 o   47.374   7.8141   54.407   15.131   68.345   22.124   42.158   20.740   53.556   10.391   41.193   11.674 12.36315 15.62823 
1 1 1    4   22   37 o   30.462   8.6714   16.157   16.438   27.162   26.462   9.2406   20.977   34.162   13.210   26.761   11.237 7.401566 17.34280 
1 1 1    4   22   38 o   33.237   7.5160   17.978   15.227   54.615   21.924 -16.1657   21.165   46.105   11.553   20.369   9.6174 25.73622 15.03209 
1 1 1    4   22   39 o   37.669   8.6783   38.581   15.475   38.351   22.301   38.795   21.490   37.496   12.398   37.843   12.147 -0.3469810 17.35660 
1 1 1    4   22   40 o   33.463   8.4804   29.573   14.878   27.177   20.829   32.070   21.259   32.411   11.893   34.515   12.092 -2.103355 16.96076 
1 1 1    4   22   41 o   43.582   8.5005   53.341   15.763   54.042   21.374   52.505   23.341   44.410   11.558   42.754   12.468 1.656013 17.00099 
1 1 1    4   22   42 o   24.480   7.8407   0.5316   17.434 -11.9774   24.698   12.955   24.613   21.833   10.333   27.128   11.795 -5.295427 15.68133 
1 1 1    4   22   43 o   34.676   8.5415   35.612   16.179   53.269   23.064   18.506   22.701   41.560   12.465   27.793   11.681 13.76678 17.08298 
1 1 1    4   22   44 o   29.285   9.7047   12.667   23.504   59.096   51.766   0.6100   26.380   34.764   15.938   23.806   11.077 10.95846 19.40941 
1 1 1    4   23    0 o   96.542   3.2379  193.757   18.140  193.757   18.140  193.757   18.140   96.542   4.5791   96.542   4.5791 0.000000 0.000000 
1 1 1    4   23    1 o   46.729   3.7253   47.358   6.8298   32.779   10.115   59.572   9.2589   39.771   6.1667   53.686   4.1815 -13.91528 7.450668 
1 1 1    4   23    2 o  188.416   2.0707  731.013   16.057  705.837   21.861  760.507   23.661  184.906   2.8664  191.925   2.9891 -7.018295 4.141378 
1 1 1    4   23    3 o  115.133   3.1242  258.859   11.639  299.075   27.623  250.179   12.833  120.182   5.5726  110.085   2.8265 10.09624 6.248477 
1 1 1    4   23    4 o  158.127   2.5942  522.762   16.698  466.436   24.837  569.218   22.557  150.234   4.0084  166.020   3.2942 -15.78607 5.188320 
1 1 1    4   23    5 o  170.951   2.9009  608.035   19.731  619.789   24.953  588.425   32.230  173.223   3.4927  168.680   4.6326 4.542633 5.801742 
1 1 1    4   23    6 o  281.691   3.3136  1625.14   36.918  1586.31   45.832  1696.89   62.302  277.055   4.0108  286.327   5.2756 -9.272156 6.627117 
1 1 1    4   23    7 o  189.293   2.8345  738.107   20.009  734.887   23.664  746.183   37.477  188.657   3.0413  189.929   4.7842 -1.271484 5.668991 
1 1 1    4   23    8 o  114.397   3.1424  273.725   12.478  276.441   14.257  264.836   25.790  115.709   2.9875  113.085   5.5294 2.623322 6.284832 
1 1 1    4   23    9 f  215.344   3.8506  956.984   25.788  955.195   28.327  965.644   62.324  215.059   3.1935  215.628   7.0078 -0.5683594 7.701170 
1 1 1    4   23   10 o  102.454   3.4601  218.454   12.296  219.496   14.027  214.998   25.547  103.084   3.2993  101.825   6.0831 1.259796 6.920228 
1 1 1    4   23   11 o  288.762   3.2639  1726.86   36.049  1729.87   43.517  1720.29   64.354  289.337   3.6466  288.187   5.4142 1.149933 6.527725 
1 1 1    4   23   12 o   73.667   4.7786  127.459   10.409  135.334   11.508   92.027   24.411   80.936   3.4474   66.399   8.9138 14.53661 9.557242 
1 1 1    4   23   13 o  135.076   3.4296  379.319   17.049  381.359   20.045  373.982   32.417  135.850   3.5775  134.302   5.8523 1.547974 6.859115 
1 1 1    4   23   14 o   24.467   3.9876   12.402   4.3006   20.491   6.2609   5.1756   5.9177   31.462   4.8248   17.471   6.3501 13.99146 7.975142 
1 1 1    4   23   15 o   99.807   3.6303  196.549   13.400  228.521   26.254  185.285   15.583  104.950   6.0652   94.664   3.9912 10.28641 7.260613 
1 1 1    4   23   16 o  128.952   2.5761  343.792   13.511  344.241   17.704  343.165   20.909  129.077   3.3255  128.827   3.9352 0.2509460 5.152149 
1 1 1    4   23   17 o  224.086   2.5296  1044.00   22.583  1062.03   28.595  1014.13   36.812  226.741   3.0577  221.431   4.0307 5.310638 5.059279 
1 1 1    4   23   18 o   59.574   3.5199   74.456   8.4540   78.505   11.038   68.710   13.149   61.591   4.3451   57.557   5.5390 4.033596 7.039898 
1 1 1    4   23   19 o   37.970   5.0037   31.511   7.3689   34.330   9.4084   27.038   11.852   40.670   5.6088   35.269   8.2880 5.401421 10.00747 
1 1 1    4   23   20 o  120.146   2.8022  297.371   13.649  291.447   17.661  306.157   21.509  118.704   3.6073  121.588   4.2891 -2.883965 5.604367 
1 1 1    4   23   21 o  138.592   4.0787  402.621   22.028  409.422   27.170  389.573   37.631  140.511   4.6883  136.674   6.6756 3.837265 8.157435 
1 1 1    4   23   22 o   66.792   3.9696   89.632   10.386   83.246   12.633  102.949   18.243   63.324   4.8370   70.259   6.2956 -6.934555 7.939233 
1 1 1    4   23   23 o   44.626   5.4331   44.520   8.7095   47.325   10.408   37.966   15.910   47.702   5.2898   41.549   9.4917 6.152874 10.86627 
1 1 1    4   23   24 f   71.045   4.6195  106.631   13.416   93.449   19.374  118.774   18.596   66.700   7.0423   75.389   5.9805 -8.688614 9.239097 
1 1 1    4   23   25 o   38.867   6.7769   34.799   12.269   10.242   18.929   52.587   16.110   27.899   11.058   49.835   7.8380 -21.93657 13.55381 
1 1 1    4   23   26 o   29.545   6.5217   19.243   8.5146   21.431   9.9956   13.455   16.255   31.168   7.7956   27.921   10.457 3.246464 13.04334 
1 1 1    4   23   27 o   36.173   6.6691   28.872   9.1873   28.710   10.654   29.343   18.144   36.129   7.3987   36.216   11.098 -0.8647537E-01 13.33817 
1 1 1    4   23   28 o   57.822   6.3429   75.751   14.090   52.265   20.385   97.236   19.498   47.947   10.591   67.696   6.9831 -19.74924 12.68588 
1 1 1    4   23   29 f   31.160   7.0535   17.095   8.9290   12.879   10.100   32.178   19.103   24.913   8.3467   37.407   11.373 -12.49438 14.10692 
1 1 1    4   23   30 o   38.351   7.7539   41.866   11.832   47.232   12.183 -47.2030   49.632   47.107   6.2703   29.594   14.184 17.51309 15.50779 
1 1 1    4   23   31 o   86.821   3.7974  157.332   12.395  154.561   14.714  164.104   23.005   85.942   4.1510   87.701   6.3600 -1.758835 7.594788 
1 1 1    4   23   32 o   67.226   5.6559   98.431   15.681   97.320   22.078   99.563   22.278   66.839   8.0086   67.614   7.9886 -0.7745590 11.31174 
1 1 1    4   23   33 o   25.154   7.4912  -0.8836   14.415   18.138   20.691 -18.8254   20.095   30.564   11.717   19.744   9.3372 10.82073 14.98240 
1 1 1    4   23   34 o   83.870   4.8358  152.505   16.727  152.558   23.778  152.453   23.535   83.863   6.8745   83.877   6.8030 -0.1399231E-01 9.671596 
1 1 1    4   23   35 o   40.498   8.6309   36.036   15.830   63.606   26.569   20.863   19.710   49.899   12.836   31.096   11.541 18.80302 17.26171 
1 1 1    4   23   36 o   39.297   8.3372   38.849   14.732   47.587   21.601   31.251   20.143   43.180   11.795   35.413   11.786 7.766884 16.67432 
1 1 1    4   23   37 o   30.414   9.2364   13.896   20.649   0.2193   36.733   20.214   24.967   29.611   13.520   31.218   12.588 -1.606443 18.47285 
1 1 1    4   23   38 o   30.578   8.6740   20.657   16.457   21.478   20.961   19.337   26.570   30.432   11.760   30.724   12.754 -0.2912140 17.34801 
1 1 1    4   23   39 o   46.718   7.6558   56.459   14.567   46.052   20.183   67.777   21.046   41.517   11.426   51.919   10.192 -10.40182 15.31165 
1 1 1    4   23   40 o   68.634   5.7018  110.730   15.852  134.055   22.661   88.382   22.182   76.605   7.1723   60.664   8.8657 15.94183 11.40357 
1 1 1    4   23   41 o   20.241   6.7798 -13.1679   15.140  -8.7901   21.383 -17.5684   21.439   21.019   9.8430   19.463   9.3262 1.556093 13.55960 
1 1 1    4   23   42 o   26.228   8.1802   11.191   17.317   14.044   23.192   7.5968   26.033   26.705   11.530   25.751   11.607 0.9538956 16.36045 
1 1 1    4   23   43 o   18.127   8.9975 -39.2220   25.758   0.0000   0.0000 -39.2220   25.758  ?   ?    18.127   8.9975      ?      ? 
1 1 1    4   24    0 o   36.135   7.1615   32.683   13.063   32.683   13.063   32.683   13.063   36.135   10.128   36.135   10.128 0.000000 0.000000 
1 1 1    4   24    1 o  155.128   2.8872  499.785   18.354  562.735   25.887  436.153   26.027  165.021   3.8034  145.235   4.3449 19.78604 5.774459 
1 1 1    4   24    2 o  297.306   2.5315  1825.78   31.030  1812.75   43.234  1839.61   44.563  296.220   3.5387  298.393   3.6210 -2.173889 5.062961 
1 1 1    4   24    3 o  157.077   3.2470  519.512   16.939  494.935   37.058  526.003   19.045  154.542   5.8139  159.611   2.8930 -5.069229 6.493929 
1 1 1    4   24    4 o  286.009   3.1889  1700.63   37.347  1607.28   55.330  1778.77   50.618  278.703   4.8134  293.315   4.1841 -14.61255 6.377758 
1 1 1    4   24    5 o   87.278   2.9030  158.083   10.407  143.810   14.873  171.773   14.567   83.392   4.3244   91.164   3.8741 -7.772781 5.805965 
1 1 1    4   24    6 o   49.565   5.6338   54.885   8.0467   56.235   8.8043   48.037   19.828   52.154   4.0930   46.976   10.498 5.177914 11.26767 
1 1 1    4   24    7 o  203.245   3.0336  857.417   24.504  866.326   30.869  842.240   40.291  204.755   3.6553  201.736   4.8424 3.019699 6.067139 
1 1 1    4   24    8 o  227.641   3.4853  1072.55   32.719  1096.95   46.454  1048.53   46.090  230.216   4.8924  225.066   4.9652 5.150269 6.970575 
1 1 1    4   24    9 o  130.727   4.5690  367.425   22.533  388.909   27.345  321.979   39.771  137.079   4.8366  124.375   7.7530 12.70367 9.137931 
1 1 1    4   24   10 o  178.206   3.3115  659.450   23.902  669.550   31.130  644.945   37.307  179.936   4.1946  176.477   5.1255 3.458588 6.623091 
1 1 1    4   24   11 o  115.710   4.1269  278.730   19.576  289.295   26.580  266.207   28.939  118.156   5.4542  113.264   6.1948 4.891838 8.253757 
1 1 1    4   24   12 o   43.732   6.8537   46.103   8.0626   47.866   8.5350   31.488   24.577   48.105   4.3018   39.359   13.015 8.745998 13.70732 
1 1 1    4   24   13 o  135.283   4.9167  379.822   23.499  379.210   26.994  381.735   47.754  135.339   4.8359  135.226   8.5622 0.1126862 9.833419 
1 1 1    4   24   14 o  159.494   3.2320  541.138   18.534  557.425   21.651  496.467   35.857  164.261   3.1958  154.728   5.6188 9.532578 6.464005 
1 1 1    4   24   15 o  156.830   3.2535  505.830   17.892  502.836   20.454  515.584   36.918  156.007   3.1788  157.653   5.6777 -1.646194 6.507033 
1 1 1    4   24   16 o  109.107   2.7113  243.865   12.119  227.432   16.050  265.658   18.484  104.881   3.7104  113.333   3.9543 -8.451973 5.422520 
1 1 1    4   24   17 o  163.016   3.3748  546.109   19.885  541.361   23.059  559.878   39.270  161.825   3.4549  164.207   5.7983 -2.381577 6.749554 
1 1 1    4   24   18 o   92.878   3.2207  177.757   12.304  163.785   16.702  194.335   18.194   88.910   4.5546   96.847   4.5548 -7.937599 6.441311 
1 1 1    4   24   19 o  117.059   2.8355  282.901   13.530  278.523   17.763  288.951   20.882  116.017   3.7122  118.101   4.2870 -2.084549 5.670939 
1 1 1    4   24   20 o  142.532   4.0514  426.043   22.582  433.405   27.959  412.229   38.297  144.529   4.6904  140.534   6.6073 3.994781 8.102794 
1 1 1    4   24   21 o   78.309   3.2790  126.693   10.171  125.234   12.688  129.315   17.013   77.748   3.9566   78.869   5.2299 -1.121048 6.557932 
1 1 1    4   24   22 o  139.536   5.1478  309.297   16.124  293.415   16.658  544.854   64.155  119.051   3.3926  160.021   9.7205 -40.96952 10.29552 
1 1 1    4   24   23 o   70.672   4.4885  106.591   12.824   85.687   18.591  125.568   17.714   63.804   7.0646   77.541   5.5388 -13.73673 8.977043 
1 1 1    4   24   24 o   65.182   4.6985   89.694   12.574   85.680   18.419   93.198   17.208   63.738   7.0063   66.625   6.2621 -2.886433 9.396960 
1 1 1    4   24   25 o   44.634   5.0288   38.216   8.5388   30.383   10.152   57.154   15.785   37.373   6.8384   51.894   7.3751 -14.52143 10.05758 
1 1 1    4   24   26 o   42.615   6.9837   42.096   12.041   33.461   18.440   48.516   15.899   38.375   11.051   46.854   8.5421 -8.479424 13.96732 
1 1 1    4   24   27 o   57.059   5.4588   78.218   10.921   93.465   13.582   50.329   18.370   66.828   4.9278   47.291   9.7422 19.53678 10.91763 
1 1 1    4   24   28 o   35.567   6.4444   29.343   8.9171   30.740   10.489   25.700   16.937   37.338   7.0696   33.796   10.777 3.541855 12.88886 
1 1 1    4   24   29 o   20.332   6.1813   1.1138   8.1245   0.6437   9.3111   2.6138   16.631   17.368   7.3983   23.296   9.9046 -5.927704 12.36269 
1 1 1    4   24   30 o   48.988   5.8953   39.759   9.7725   30.742   10.770   81.774   23.248   37.204   7.2796   60.773   9.2751 -23.56850 11.79064 
1 1 1    4   24   31 o   25.436   6.2097   13.874   8.6154   19.970   9.6240 -10.7224   19.331   29.774   7.7587   21.098   9.6976 8.675713 12.41937 
1 1 1    4   24   32 o   47.565   6.1438   51.167   10.215   51.314   11.845   50.740   20.181   49.018   5.8587   46.111   10.801 2.907501 12.28769 
1 1 1    4   24   33 o   74.671   4.1114  106.427   11.681   88.326   13.677  155.226   22.456   64.504   5.1408   84.838   6.4177 -20.33388 8.222878 
1 1 1    4   24   34 o   25.943   7.8796   4.6977   15.223   8.1272   20.817   0.7558   22.318   26.687   11.200   25.199   11.087 1.488888 15.75922 
1 1 1    4   24   35 o   24.930   7.6001   1.6930   14.796   14.072   20.862 -10.8367   20.989   28.367   11.483   21.493   9.9592 6.873743 15.20026 
1 1 1    4   24   36 o   51.226   7.4235   65.558   15.548   39.451   21.754   92.820   22.230   38.793   12.196   63.659   8.4667 -24.86552 14.84692 
1 1 1    4   24   37 o   23.114   7.2677 -11.8391   15.276 -36.7706   20.745   17.698   22.579   16.832   8.3037   29.396   11.930 -12.56415 14.53544 
1 1 1    4   24   38 o   20.428   6.8777 -26.9001   15.465 -46.1038   19.760   3.4542   24.843   15.129   7.5678   25.726   11.486 -10.59726 13.75543 
1 1 1    4   24   39 o   43.059   8.0330   50.152   14.481   51.716   20.187   48.493   20.785   44.014   11.117   42.105   11.599 1.909485 16.06604 
1 1 1    4   24   40 o   22.045   7.0877  -1.2286   14.095  -0.0549   19.935  -2.4017   19.930   22.331   10.102   21.759   9.9439 0.5713158 14.17536 
1 1 1    4   24   41 o   24.320   7.6513   5.3077   15.565   12.332   22.349  -1.3086   21.690   26.140   11.303   22.501   10.316 3.639647 15.30267 
1 1 1    4   24   42 o   20.675   6.8895  -7.9361   15.222  -8.3064   21.369  -7.5546   21.690   20.540   9.6877   20.811   9.7985 -0.2704124 13.77906 
1 1 1    4   25    0 o   89.782   1.9775  166.814   10.333  166.814   10.333  166.814   10.333   89.782   2.7966   89.782   2.7966 0.000000 0.000000 
1 1 1    4   25    1 o  135.962   2.0558  382.105   11.491  376.556   16.877  386.901   15.691  135.033   3.0302  136.891   2.7791 -1.857635 4.111650 
1 1 1    4   25    2 o   82.766   2.0028  140.303   6.8048  129.979   9.1009  153.391   10.248   79.343   2.7811   86.189   2.8828 -6.846115 4.005570 
1 1 1    4   25    3 o  172.889   3.3916  642.162   21.244  568.639   40.223  670.604   25.018  165.608   5.8888  180.170   3.3667 -14.56178 6.783200 
1 1 1    4   25    4 o   65.806   3.2351   98.289   7.8971   66.045   13.103  116.684   9.8966   56.451   5.6277   75.160   3.1925 -18.70932 6.470130 
1 1 1    4   25    5 o  221.557   2.8940  1018.46   26.274  981.584   39.053  1048.94   35.512  217.843   4.3466  225.270   3.8221 -7.427109 5.788038 
1 1 1    4   25    6 f  122.676   3.5136  312.738   17.682  324.758   24.084  298.682   26.044  125.272   4.6614  120.080   5.2587 5.191429 7.027219 
1 1 1    4   25    7 o   73.022   4.7961  113.061   14.118  125.619   18.810   96.858   21.366   77.830   5.8596   68.214   7.5944 9.616768 9.592163 
1 1 1    4   25    8 o  206.711   3.4519  884.123   29.389  875.668   40.421  893.606   42.806  205.682   4.7648  207.740   4.9960 -2.057755 6.903874 
1 1 1    4   25    9 o  218.763   7.0373  995.008   63.496   0.0000   0.0000  995.008   63.496  ?   ?   218.763   7.0373      ?      ? 
1 1 1    4   25   10 f  190.815   3.5673  753.653   28.037  745.778   38.565  762.481   40.831  189.778   4.9270  191.853   5.1601 -2.075409 7.134582 
1 1 1    4   25   11 o  120.376   4.0757  302.383   20.091  320.125   27.365  281.638   29.591  124.280   5.3387  116.473   6.1598 7.806580 8.151366 
1 1 1    4   25   12 o  108.501   6.1951  253.479   24.687  229.628   45.946  263.160   29.271  104.444   10.666  112.557   6.3053 -8.112816 12.39028 
1 1 1    4   25   13 o  100.469   5.0679  193.708   11.829  190.456   12.335  230.950   41.740   96.015   3.1149  104.924   9.6453 -8.909241 10.13579 
1 1 1    4   25   14 o  104.774   3.6749  216.103   12.182  210.060   13.363  245.833   29.641  100.825   3.2135  108.723   6.6100 -7.897438 7.349778 
1 1 1    4   25   15 o  136.694   3.4200  378.528   15.799  372.228   17.746  402.594   34.685  134.204   3.2061  139.185   6.0421 -4.981155 6.840030 
1 1 1    4   25   16 o   69.435   5.7904  104.311   10.410  105.324   11.075   96.627   30.501   71.349   3.7635   67.521   10.952 3.827988 11.58090 
1 1 1    4   25   17 o   70.519   3.6374  101.870   10.134  107.945   17.196   98.636   12.545   72.047   5.7868   68.991   4.4085 3.055740 7.274787 
1 1 1    4   25   18 o  129.535   3.5750  347.255   19.100  347.255   19.100   0.0000   0.0000  129.535   3.5750  ?   ?       ?      ? 
1 1 1    4   25   19 o   74.346   3.6109  116.285   10.907   94.878   15.608  136.718   15.248   67.518   5.6047   81.175   4.5544 -13.65783 7.221835 
1 1 1    4   25   20 o  147.772   3.0543  452.681   18.499  387.519   25.624  523.614   26.735  136.626   4.5473  158.918   4.0789 -22.29242 6.108607 
1 1 1    4   25   21 o   34.559   5.5056   26.716   7.5694   29.269   9.7945   22.931   11.927   36.804   6.6993   32.315   8.7388 4.488388 11.01123 
1 1 1    4   25   22 o  102.822   3.3288  218.518   14.056  193.578   19.032  248.442   20.848   96.399   4.7869  109.245   4.6269 -12.84582 6.657522 
1 1 1    4   25   23 o   46.519   7.7754   53.233   9.5959   54.829   10.061   37.137   31.943   51.272   4.7575   41.765   14.805 9.506950 15.55079 
1 1 1    4   25   24 o   89.028   3.1539  163.434   10.985  159.486   13.469  171.276   18.984   87.592   3.7282   90.464   5.0880 -2.871162 6.307729 
1 1 1    4   25   25 o   42.138   4.9558   34.482   8.0045   27.197   9.6059   51.033   14.479   35.268   6.8507   49.008   7.1630 -13.74014 9.911622 
1 1 1    4   25   26 o   22.495   6.8087   1.0803   11.252  -2.0985   17.031   3.5428   14.990   22.178   9.7233   22.813   9.5337 -0.6348991 13.61741 
1 1 1    4   25   27 o   82.513   3.5080  136.995   11.319  124.977   13.709  162.727   20.061   77.274   4.3015   87.751   5.5427 -10.47709 7.016031 
1 1 1    4   25   28 o   53.666   6.7356   68.890   13.848   44.891   20.959   87.486   18.450   43.502   11.505   63.829   7.0081 -20.32758 13.47120 
1 1 1    4   25   29 o   16.923   5.3734  -4.1417   7.7908   1.9719   8.9358 -23.5165   15.908   17.677   7.3718   16.170   7.8200 1.506477 10.74686 
1 1 1    4   25   30 o   25.624   6.4922   13.495   8.5686   16.590   9.9395   4.5396   16.908   27.266   8.1841   23.982   10.080 3.283951 12.98430 
1 1 1    4   25   31 o   53.975   8.0359   57.158   17.290   31.659   20.595  118.019   31.819   36.484   11.907   71.465   10.795 -34.98108 16.07184 
1 1 1    4   25   32 o   14.838   4.9291  -9.8231   7.6199  -1.5020   8.3879 -49.1210   18.228   15.441   6.7954   14.235   7.1417 1.206361 9.858111 
1 1 1    4   25   33 o   31.415   7.0022   22.572   9.1875   22.839   10.428   21.646   19.420   31.484   8.0111   31.346   11.487 0.1380825 14.00431 
1 1 1    4   25   34 o   21.754   6.7417   0.9652   8.9887  -0.4771   9.9044   7.7012   21.404   17.083   7.4542   26.424   11.236 -9.340895 13.48345 
1 1 1    4   25   35 o   37.615   8.1588   36.363   14.344   46.295   19.986   25.811   20.600   42.607   11.219   32.622   11.849 9.984753 16.31764 
1 1 1    4   25   36 o   34.605   7.4785   28.261   10.562   25.655   12.205   36.035   21.079   32.496   8.8620   36.714   12.049 -4.218418 14.95697 
1 1 1    4   25   37 o   20.697   6.5762  -3.2167   8.9523  -6.4173   9.8836   11.406   21.126   14.736   6.8304   26.659   11.240 -11.92226 13.15237 
1 1 1    4   25   38 o   26.670   7.3400   12.835   9.7128   9.8870   10.868   24.535   21.651   22.280   8.5036   31.060   11.966 -8.779928 14.67992 
1 1 1    4   25   39 o   28.204   8.4834   16.842   16.706   18.359   20.116   13.471   29.990   27.980   11.294   28.429   12.662 -0.4483376 16.96684 
1 1 1    4   25   40 o   25.106   7.4276  -3.3355   16.350   32.728   21.885 -48.8891   24.597   33.228   12.191   16.985   8.4880 16.24384 14.85512 
1 1 1    4   25   41 o   23.007   7.5089  -2.6464   16.363 -13.4136   21.237   13.083   25.669   19.594   9.3603   26.419   11.744 -6.825474 15.01775 
1 1 1    4   26    0 o   93.628   2.5250  181.755   13.744  181.755   13.744  181.755   13.744   93.628   3.5710   93.628   3.5710 0.000000 0.000000 
1 1 1    4   26    1 o  106.122   3.0088  236.370   10.998  226.692   22.927  239.263   12.534  104.602   5.3143  107.643   2.8231 -3.040558 6.017615 
1 1 1    4   26    2 o  161.430   2.6796  537.884   17.513  542.871   27.592  534.520   22.664  162.020   4.1291  160.840   3.4165 1.179504 5.359227 
1 1 1    4   26    3 o   80.976   3.9671  137.165   11.137  133.637   23.087  138.235   12.714   80.176   6.9816   81.776   3.7695 -1.600861 7.934192 
1 1 1    4   26    4 o   98.762   2.5573  195.631   10.025  223.126   17.070  181.153   12.386  103.879   3.9841   93.644   3.2070 10.23525 5.114503 
1 1 1    4   26    5 o  166.370   2.7057  573.656   18.515  530.693   26.388  615.316   25.985  160.201   3.9937  172.539   3.6515 -12.33870 5.411397 
1 1 1    4   26    6 o  104.391   3.7821  226.357   16.074  229.111   21.178  222.613   24.689  105.185   4.8816  103.596   5.7782 1.588448 7.564232 
1 1 1    4   26    7 o  211.699   3.4298  925.434   29.870  893.126   40.550  963.761   44.166  207.693   4.7338  215.706   4.9643 -8.013718 6.859540 
1 1 1    4   26    8 o   90.362   4.4922  169.684   16.459  169.949   21.414  169.302   25.729   90.509   5.7364   90.215   6.9147 0.2939682 8.984403 
1 1 1    4   26    9 f  137.542   4.1523  391.587   23.380  400.822   35.462  384.486   31.096  138.925   6.1890  136.159   5.5372 2.765213 8.304515 
1 1 1    4   26   10 o  169.002   3.5958  591.512   25.020  586.174   34.306  597.578   36.568  168.210   4.9449  169.794   5.2217 -1.583817 7.191528 
1 1 1    4   26   11 o  136.070   3.8995  384.212   21.814  385.613   29.716  382.574   32.125  136.372   5.2832  135.767   5.7370 0.6045685 7.799088 
1 1 1    4   26   12 o   68.924   9.1271  110.208   22.271   88.078   42.036  118.844   26.260   62.498   16.181   75.350   8.4497 -12.85222 18.25422 
1 1 1    4   26   13 o   39.747   10.119   25.672   18.202   21.571   20.554   40.581   39.191   33.731   11.885   45.762   16.380 -12.03086 20.23751 
1 1 1    4   26   14 f   50.369   8.6473   55.393   17.681   48.859   23.369   64.141   27.039   46.980   12.013   53.758   12.441 -6.777435 17.29469 
1 1 1    4   26   15 o   33.389   6.9044   25.830   6.9012   27.293   7.1133   2.4045   28.470   36.272   4.7548   30.506   12.964 5.766453 13.80873 
1 1 1    4   26   16 o   22.461   6.5191   7.1710   6.3746   8.9859   6.5569 -24.1104   27.222   20.970   6.7075   23.952   11.181 -2.982422 13.03817 
1 1 1    4   26   17 o   56.095   7.1072   68.668   9.5362   68.832   10.043   67.163   30.418   57.621   4.2257   54.569   13.572 3.052467 14.21447 
1 1 1    4   26   18 o   63.437   3.9150   79.790   9.4811   94.509   17.630   73.800   11.246   67.255   6.3556   59.618   4.5735 7.636238 7.830075 
1 1 1    4   26   19 o  120.454   3.1292  302.805   15.473  283.712   22.529  319.852   21.288  116.791   4.6771  124.118   4.1586 -7.326744 6.258497 
1 1 1    4   26   20 o  124.656   2.6976  317.189   13.573  298.355   17.273  347.588   21.945  119.963   3.4911  129.350   4.1135 -9.387085 5.395202 
1 1 1    4   26   21 o   26.836   5.6104   15.433   6.5610   14.796   8.5178   16.361   10.288   26.114   7.5079   27.558   8.3388 -1.444040 11.22076 
1 1 1    4   26   22 o  102.534   2.8951  212.845   12.007  190.281   15.269  249.395   19.434   95.659   3.8701  109.408   4.3067 -13.74815 5.790128 
1 1 1    4   26   23 o   56.310   3.8076   67.771   8.3670   70.718   10.420   62.422   14.039   58.234   4.3383   54.387   6.2586 3.847191 7.615178 
1 1 1    4   26   24 o   46.487   4.6311   48.041   7.9677   51.496   9.8143   41.361   13.646   49.623   4.7952   43.351   7.9243 6.272202 9.262232 
1 1 1    4   26   25 o   47.620   4.3551   44.358   8.0115   38.177   9.5278   59.277   14.802   42.550   5.4290   52.690   6.8112 -10.13935 8.710159 
1 1 1    4   26   26 o  101.731   3.3596  221.243   13.471  231.874   16.987  203.232   22.110  105.381   3.9084   98.081   5.4657 7.299507 6.719291 
1 1 1    4   26   27 o   54.137   5.8869   67.178   12.233   47.611   17.920   84.256   16.741   45.464   9.8417   62.809   6.4624 -17.34471 11.77378 
1 1 1    4   26   28 o   44.988   5.3703   42.413   8.7901   39.782   10.314   49.399   16.804   43.306   5.7743   46.669   9.0565 -3.363190 10.74068 
1 1 1    4   26   29 o   71.983   6.2247  120.318   17.390   93.642   27.515  138.060   22.439   63.982   10.427   79.984   6.8021 -16.00129 12.44936 
1 1 1    4   26   30 o   96.503   3.9826  198.266   15.751  170.173   21.843  228.697   22.735   89.214   5.9364  103.792   5.3108 -14.57744 7.965232 
1 1 1    4   26   31 o   13.117   4.5197 -15.7200   7.3635  -8.6569   8.3365 -40.7918   15.706   12.798   6.0408   13.436   6.7246 -0.6372414 9.039391 
1 1 1    4   26   32 o   25.391   7.1256   11.815   9.3569   14.790   9.8919 -13.4823   28.844   25.742   8.2390   25.041   11.628 0.7008400 14.25129 
1 1 1    4   26   33 o   24.824   6.3830   13.163   8.9356   18.598   9.9766  -8.8815   20.092   28.276   8.1243   21.373   9.8471 6.902891 12.76591 
1 1 1    4   26   34 o   60.220   4.8926   79.141   10.783   77.675   12.612   83.123   20.786   60.167   5.0824   60.273   8.3617 -0.1059494 9.785155 
1 1 1    4   26   35 o   64.472   5.5680   94.826   14.766   89.187   20.001  101.582   21.891   62.466   7.7631   66.479   7.9840 -4.012390 11.13601 
1 1 1    4   26   36 o   54.093   6.5790   70.020   11.736   69.454   13.325   71.976   24.783   56.292   5.7393   51.895   11.840 4.397251 13.15791 
1 1 1    4   26   37 o   71.545   4.5890  108.492   12.255  100.407   14.337  130.423   23.615   67.959   5.1150   75.132   7.6206 -7.173149 9.178077 
1 1 1    4   26   38 o   25.455   7.0030   14.489   9.7172   15.835   10.923   9.3825   21.276   25.568   8.6794   25.342   10.993 0.2261486 14.00601 
1 1 1    4   26   39 o   32.374   7.2871   29.365   10.644   31.366   12.084   22.439   22.482   35.394   8.4034   29.355   11.908 6.039131 14.57415 
1 1 1    4   26   40 o   20.945   6.8360  -5.2792   10.220 -10.2901   11.274   17.844   24.218   14.461   6.8837   27.428   11.813 -12.96694 13.67201 
1 1 1    4   26   41 o   19.948   6.4842   0.3809   10.480   2.7711   11.595 -10.2804   24.489   18.629   8.0979   21.267   10.129 -2.638231 12.96846 
1 1 1    4   27    0 o   66.613   2.1860   92.176   8.4517   92.176   8.4517   92.176   8.4517   66.613   3.0914   66.613   3.0914 0.000000 0.000000 
1 1 1    4   27    1 o  180.537   2.1721  674.342   16.133  657.202   23.494  689.635   22.192  178.350   3.1939  182.724   2.9447 -4.373566 4.344227 
1 1 1    4   27    2 o   94.652   2.8913  191.698   10.899  151.110   16.518  222.992   14.504   85.428   4.6881  103.877   3.3854 -18.44891 5.782699 
1 1 1    4   27    3 o   91.749   3.5977  178.418   10.213  168.404   24.419  180.541   11.244   90.006   6.5780   93.493   2.9159 -3.486519 7.195353 
1 1 1    4   27    4 o   50.141   4.8686   48.330   9.6348   67.347   16.899   39.172   11.728   56.872   7.2046   43.410   6.5502 13.46196 9.737119 
1 1 1    4   27    5 o  179.639   5.9483  669.946   44.072  669.946   44.072   0.0000   0.0000  179.639   5.9483  ?   ?       ?      ? 
1 1 1    4   27    6 f  153.968   4.8630  499.877   29.975  523.271   38.581  464.249   47.611  158.759   5.8920  149.177   7.7381 9.582382 9.725974 
1 1 1    4   27    7 o   51.938   7.0970   59.800   14.636   73.513   19.888   43.600   21.616   59.313   8.1299   44.563   11.635 14.74979 14.19406 
1 1 1    4   27    8 f   38.059   8.8628   26.560   14.493   22.501   16.754   38.629   28.887   33.092   10.736   43.027   14.104 -9.935097 17.72564 
1 1 1    4   27    9 o  144.146   4.1828  431.747   24.643  432.389   37.456  431.258   32.722  144.166   6.2993  144.126   5.5048 0.3968811E-01 8.365627 
1 1 1    4   27   10 o  110.836   4.3156  253.965   19.597  242.714   26.024  268.703   29.784  108.058   5.8392  113.613   6.3561 -5.555389 8.631113 
1 1 1    4   27   11 o  125.703   4.0759  329.011   21.020  333.627   28.418  323.435   31.233  126.734   5.4368  124.672   6.0740 2.062263 8.151798 
1 1 1    4   27   12 o  141.426   5.5182  416.975   29.367  424.167   54.149  413.979   34.955  141.834   9.2565  141.019   6.0098 0.8155670 11.03634 
1 1 1    4   27   13 o   43.980   8.8897   43.728   17.320   52.957   22.503   30.315   27.130   48.867   11.378   39.094   13.662 9.772141 17.77941 
1 1 1    4   27   14 o   67.490   6.7439   97.683   18.406  104.248   24.319   88.879   28.163   70.379   8.3779   64.600   10.570 5.778816 13.48775 
1 1 1    4   27   15 o   91.169   5.7338  180.788   20.788  219.014   28.220  135.435   30.738  102.356   6.6846   79.982   9.3180 22.37402 11.46768 
1 1 1    4   27   16 o   92.289   4.4299  186.070   11.552  189.290   12.493  167.064   30.353   95.638   3.1670   88.940   8.2744 6.697884 8.859793 
1 1 1    4   27   17 o  180.117   4.1580  703.335   22.725  716.064   24.954  641.462   55.015  185.939   3.2538  174.296   7.6530 11.64383 8.315969 
1 1 1    4   27   18 o   27.521   7.3220   11.819   6.6210   11.987   6.8205   9.0682   27.573   23.572   6.6994   31.469   13.022 -7.897224 14.64409 
1 1 1    4   27   19 o  110.143   2.6537  240.890   11.159  281.045   20.693  224.423   13.251  116.210   4.3173  104.076   3.0870 12.13336 5.307348 
1 1 1    4   27   20 o   73.013   2.9933  110.899   8.8947  110.268   11.657  111.779   13.762   72.821   3.8810   73.204   4.5581 -0.3829422 5.986516 
1 1 1    4   27   21 o  122.763   3.2782  313.989   16.578  295.424   22.826  334.714   24.117  118.926   4.6535  126.600   4.6187 -7.673454 6.556460 
1 1 1    4   27   22 o   30.053   5.2612   20.843   6.5203   24.663   8.3219   14.769   10.493   33.695   6.2172   26.412   8.4892 7.283056 10.52236 
1 1 1    4   27   23 o   73.955   3.4681  116.203   10.438  129.528   14.255  100.801   15.325   78.709   4.3910   69.201   5.3694 9.508240 6.936258 
1 1 1    4   27   24 o   89.496   5.4779  175.140   19.013  179.444   23.448  166.877   32.486   91.870   6.1883   87.122   9.0408 4.747437 10.95586 
1 1 1    4   27   25 f   42.868   4.5156   37.408   7.4964   34.290   9.0000   44.473   13.547   40.283   5.4169   45.452   7.2263 -5.168732 9.031240 
1 1 1    4   27   26 o   18.328   5.4861   2.0740   6.4931   3.1362   7.4989  -1.1077   12.979   17.102   6.8981   19.554   8.5327 -2.451666 10.97225 
1 1 1    4   27   27 o   37.784   5.6354   30.383   7.8944   27.762   9.3527   36.878   14.722   35.472   6.6366   40.096   9.1096 -4.623604 11.27078 
1 1 1    4   27   28 o   26.737   7.3567   12.406   11.667   6.2029   19.396   15.923   14.604   25.701   10.799   27.773   9.9930 -2.072666 14.71342 
1 1 1    4   27   29 o   26.340   6.4819   12.939   7.7321   10.648   8.9295   19.806   15.458   22.738   7.8442   29.943   10.321 -7.205612 12.96376 
1 1 1    4   27   30 o   27.404   6.4741   16.660   7.9977   17.631   9.1746   13.586   16.322   27.811   7.7233   26.996   10.393 0.8148460 12.94818 
1 1 1    4   27   31 o   70.686   4.2173  107.626   11.922  107.032   15.126  108.601   19.374   70.814   5.1788   70.557   6.6574 0.2567368 8.434521 
1 1 1    4   27   32 f   32.794   7.6360   25.202   9.3791   25.884   9.8906   19.114   29.547   33.550   7.3508   32.038   13.387 1.512016 15.27207 
1 1 1    4   27   33 o   51.594   6.3413   71.703   10.782   81.545   12.603   44.832   20.824   61.689   4.9533   41.500   11.675 20.18892 12.68269 
1 1 1    4   27   34 o   25.154   6.2738   14.807   8.5131   19.419   9.6953  -0.7200   17.789   28.562   7.9422   21.747   9.7141 6.815281 12.54756 
1 1 1    4   27   35 o   42.611   6.5876   46.097   10.140   48.061   11.728   40.283   20.180   46.644   6.0964   38.579   11.680 8.065796 13.17524 
1 1 1    4   27   36 f   33.686   7.8880   28.405   14.048   11.200   19.376   47.474   20.399   25.729   10.801   41.642   11.498 -15.91335 15.77600 
1 1 1    4   27   37 o   25.147   5.7096   12.219   10.005   29.355   11.619 -36.9173   19.675   34.452   8.2798   15.843   7.8640 18.60850 11.41919 
1 1 1    4   27   38 o   28.321   6.0839   22.361   10.074   33.412   11.505 -13.9600   20.857   37.005   7.7845   19.638   9.3520 17.36704 12.16789 
1 1 1    4   27   39 o   45.609   7.1798   56.449   12.231   56.412   14.391   56.542   23.216   48.820   7.1469   42.399   12.455 6.421539 14.35961 
1 1 1    4   27   40 o   34.889   7.6111   40.710   12.239   43.833   12.807   7.8300   41.553   42.169   7.6453   27.610   13.163 14.55860 15.22212 
1 1 1    4   28    0 o   44.582   2.4258   41.765   6.2222   41.765   6.2222   41.765   6.2222   44.582   3.4306   44.582   3.4306 0.000000 0.000000 
1 1 1    4   28    1 o  181.522   2.2149  681.222   16.426  679.466   24.990  682.557   21.795  181.289   3.3422  181.756   2.9074 -0.4674530 4.429806 
1 1 1    4   28    2 o   88.561   2.8030  162.043   10.017  163.654   15.941  160.992   12.877   88.892   4.3480   88.230   3.5386 0.6619797 5.605969 
1 1 1    4   28    3 o  113.347   3.3897  277.551   12.323  248.568   27.752  284.668   13.753  109.313   6.1555  117.381   2.8407 -8.068504 6.779338 
1 1 1    4   28    4 o  281.271   7.0157  1650.27   81.388  1650.27   81.388   0.0000   0.0000  281.271   7.0157  ?   ?       ?      ? 
1 1 1    4   28    5 o   70.683   3.9481  103.246   10.374  105.080   19.550  102.528   12.239   71.006   6.6757   70.361   4.2173 0.6446228 7.896226 
1 1 1    4   28    6 o  166.183   3.8964  566.576   26.145  608.134   42.070  540.426   33.372  170.980   5.9657  161.386   5.0136 9.593903 7.792706 
1 1 1    4   28    7 o  101.908   3.2900  217.242   13.368  207.664   21.643  223.149   16.998  100.000   5.2476  103.816   3.9698 -3.815659 6.580004 
1 1 1    4   28    8 o   58.914   7.3982   76.696   15.639   79.013   18.502   70.900   29.264   61.466   7.2983   56.363   12.871 5.103497 14.79645 
1 1 1    4   28    9 o  224.915   4.2579  1058.16   38.415  1034.21   61.601  1073.40   49.140  222.551   6.7111  227.278   5.2422 -4.726974 8.515853 
1 1 1    4   28   10 o   93.121   7.0468  184.242   24.348  183.233   45.608  184.644   28.795   92.367   11.972   93.876   7.4369 -1.509232 14.09363 
1 1 1    4   28   11 o  156.677   5.9686  515.239   38.388  533.402   57.529  500.661   51.540  159.030   8.7709  154.325   8.0974 4.704529 11.93717 
1 1 1    4   28   12 o  119.201   6.0757  296.373   29.870  296.373   29.870   0.0000   0.0000  119.201   6.0757  ?   ?       ?      ? 
1 1 1    4   28   13 o   33.578   9.7348   13.728   19.883   23.132   21.763 -33.7689   48.910   34.504   12.222   32.652   15.156 1.852345 19.46950 
1 1 1    4   28   14 o  176.767   4.5100  647.236   32.312  694.318   51.360  616.394   41.569  181.812   6.8492  171.722   5.8692 10.09024 9.019927 
1 1 1    4   28   15 o   37.911   9.3962   29.188   18.500   36.896   25.042   19.928   27.448   40.932   13.110   34.891   13.464 6.040752 18.79249 
1 1 1    4   28   16 o   23.349   7.6265 -17.1851   17.028 -20.8480   22.628 -12.4024   25.857   21.540   10.099   25.158   11.431 -3.617416 15.25302 
1 1 1    4   28   17 o   39.261   10.253   28.158   21.441   19.982   26.972   42.196   35.342   34.500   13.338   44.021   15.577 -9.521191 20.50667 
1 1 1    4   28   18 o  101.113   4.5606  235.170   13.170  243.933   14.362  188.844   33.022  108.444   3.2110   93.782   8.5373 14.66231 9.121217 
1 1 1    4   28   19 o   62.682   6.8756   97.423   9.8715  100.293   10.449   73.594   30.107   69.463   3.6472   55.901   13.259 13.56200 13.75112 
1 1 1    4   28   20 o  135.170   3.8077  382.548   17.759  381.919   20.200  384.687   37.266  135.559   3.6129  134.781   6.7038 0.7788696 7.615405 
1 1 1    4   28   21 o   25.580   4.2034   14.277   4.0622   14.226   7.4995   14.299   4.8325   25.418   6.9527   25.742   4.7258 -0.3231773 8.406752 
1 1 1    4   28   22 f   35.895   4.5192   27.278   6.4336   19.809   8.5098   37.242   9.8291   29.837   7.0305   41.954   5.6803 -12.11776 9.038490 
1 1 1    4   28   23 o   71.942   3.1635  108.104   9.1656  106.654   11.725  110.381   14.696   71.447   3.9791   72.436   4.9191 -0.9895020 6.326953 
1 1 1    4   28   24 o   51.388   3.8903   53.963   8.1036   44.451   10.410   68.590   12.909   45.836   5.5067   56.940   5.4968 -11.10386 7.780646 
1 1 1    4   28   25 o   53.579   4.0505   62.210   8.3254   64.819   10.205   57.018   14.397   55.589   4.4509   51.569   6.7687 4.019650 8.100950 
1 1 1    4   28   26 o   54.316   4.9566   64.734   10.927   55.710   16.099   72.442   14.878   50.478   7.7326   58.153   6.2032 -7.675102 9.913272 
1 1 1    4   28   27 o   62.689   3.6567   77.551   8.9762   66.310   10.824  102.312   16.064   56.070   4.6803   69.308   5.6196 -13.23758 7.313390 
1 1 1    4   28   28 o   46.859   5.6729   54.455   9.2674   61.794   11.117   37.739   16.778   53.973   4.9942   39.746   10.187 14.22734 11.34574 
1 1 1    4   28   29 o   32.877   6.1807   24.825   7.8533   24.724   9.1362   25.109   15.369   33.137   6.9086   32.617   10.251 0.5199699 12.36132 
1 1 1    4   28   30 o   25.865   6.3824   11.484   7.5237   7.6648   8.6597   23.243   15.195   20.437   7.6370   31.293   10.228 -10.85542 12.76475 
1 1 1    4   28   31 o   39.735   5.9478   43.961   8.9607   53.379   10.574   19.973   16.876   49.886   5.1394   29.583   10.728 20.30235 11.89561 
1 1 1    4   28   32 o   29.072   6.4079   21.467   8.9639   26.485   10.520   8.1720   17.125   33.635   7.7437   24.509   10.212 9.125914 12.81586 
1 1 1    4   28   33 o   35.222   8.0211   29.363   10.089   28.623   10.680   35.509   30.768   34.827   7.6444   35.616   14.104 -0.7883759 16.04211 
1 1 1    4   28   34 o   32.266   5.9413   29.159   9.1076   37.553   10.558   4.7503   18.005   41.160   6.2193   23.372   10.125 17.78854 11.88264 
1 1 1    4   28   35 o   27.420   7.2561   13.912   9.5028   9.5798   10.742   29.504   20.379   21.980   8.4387   32.861   11.807 -10.88041 14.51227 
1 1 1    4   28   36 o   20.087   6.4363  -8.0439   12.501 -27.5124   18.239   9.2049   17.168   16.219   7.9586   23.954   10.118 -7.734724 12.87266 
1 1 1    4   28   37 o   24.046   6.8790   7.5908   9.3052   2.2829   10.650   24.714   19.129   18.135   7.8219   29.957   11.318 -11.82214 13.75799 
1 1 1    4   28   38 o   33.238   8.3142   30.488   12.031   28.500   13.114   41.059   30.240   32.593   9.2986   33.884   13.786 -1.290394 16.62846 
1 1 1    4   29    0 o   29.137   3.3040   18.850   5.1821   18.850   5.1821   18.850   5.1821   29.137   4.6725   29.137   4.6725 0.000000 0.000000 
1 1 1    4   29    1 o   56.391   3.0856   68.049   6.3370   61.345   11.956   70.668   7.4729   54.322   5.3365   58.459   3.0993 -4.137280 6.171268 
1 1 1    4   29    2 o  132.510   4.6022  364.288   25.152   0.0000   0.0000  364.288   25.152  ?   ?   132.510   4.6022      ?      ? 
1 1 1    4   29    3 f   95.766   3.4990  190.679   12.241  189.987   23.600  190.933   14.318   95.491   5.9922   96.041   3.6145 -0.5506134 6.997916 
1 1 1    4   29    4 o   26.951   5.9727   15.470   7.2657   11.495   12.776   17.370   8.8333   25.613   9.3272   28.288   7.4630 -2.674816 11.94539 
1 1 1    4   29    5 o  146.980   3.7686  438.303   22.375  502.422   36.309  399.043   28.411  155.357   5.6666  138.604   4.9700 16.75340 7.537272 
1 1 1    4   29    6 o   40.354   5.4392   30.782   7.9519   46.983   15.729   25.220   9.2163   46.549   8.5063   34.158   6.7810 12.39062 10.87835 
1 1 1    4   29    7 o   70.196   4.3396  107.543   11.304   91.338   20.308  114.817   13.606   65.996   7.4609   74.395   4.4344 -8.398895 8.679193 
1 1 1    4   29    8 o  110.492   4.6253  259.234   19.516  266.403   23.708  244.164   34.375  113.194   5.0780  107.789   7.7322 5.405014 9.250582 
1 1 1    4   29    9 o   81.895   5.3214  140.744   17.956  134.048   24.749  148.187   26.092   79.845   7.5152   83.946   7.5360 -4.100960 10.64288 
1 1 1    4   29   10 o   53.705   7.4360   63.690   15.758   66.079   20.300   60.067   24.996   55.785   8.8229   51.625   11.972 4.159988 14.87194 
1 1 1    4   29   11 o   97.004   6.6744  198.895   24.318  206.871   45.104  195.626   28.873   97.657   11.198   96.351   7.2657 1.306190 13.34879 
1 1 1    4   29   12 o   23.749   7.9231 -18.0442   17.264  -9.2878   19.212 -54.7790   39.351   21.876   9.9051   25.622   12.369 -3.746420 15.84612 
1 1 1    4   29   13 o   29.499   8.2636   10.200   15.809   21.393   20.154  -7.7023   25.487   33.000   11.753   25.999   11.619 7.001089 16.52724 
1 1 1    4   29   14 f  116.128   4.4725  279.746   21.271  248.396   28.169  321.332   32.444  108.678   6.2844  123.577   6.3655 -14.89861 8.945035 
1 1 1    4   29   15 o   38.002   8.9980   28.482   17.072   15.383   22.398   46.645   26.374   31.139   12.122   44.865   13.301 -13.72587 17.99603 
1 1 1    4   29   16 o   85.225   5.7280  152.948   19.920  138.445   25.963  173.705   31.060   80.504   7.8194   89.947   8.3723 -9.442818 11.45598 
1 1 1    4   29   17 o   29.470   8.9184   3.6976   19.257   3.0098   26.345   4.4866   28.218   28.850   12.371   30.090   12.850 -1.239285 17.83673 
1 1 1    4   29   18 o   69.260   10.134  114.959   25.403  108.530   48.925  117.332   29.724   65.244   17.722   73.276   9.8352 -8.031235 20.26805 
1 1 1    4   29   19 o   49.408   7.4590   71.233   10.885   77.568   11.692   30.069   29.805   60.848   4.6589   37.968   14.172 22.88091 14.91808 
1 1 1    4   29   20 o   54.460   4.1391   62.010   9.2973   62.010   9.2973   0.0000   0.0000   54.460   4.1391  ?   ?       ?      ? 
1 1 1    4   29   21 o   73.943   7.4781  109.581   10.712  107.469   11.047  142.784   43.803   71.776   3.7316   76.110   14.483 -4.334045 14.95621 
1 1 1    4   29   22 o  121.372   4.4773  368.912   17.842  214.933   33.645  429.154   21.045   99.261   8.2182  143.483   3.5561 -44.22203 8.954632 
1 1 1    4   29   23 o   84.577   2.5322  149.526   8.7808  145.216   13.039  153.102   11.878   83.403   3.7906   85.750   3.3584 -2.346825 5.064333 
1 1 1    4   29   24 o   62.538   3.5350   81.037   8.9158   75.516   11.317   90.070   14.476   59.904   4.5804   65.173   5.3855 -5.269226 7.069901 
1 1 1    4   29   25 o   33.142   5.1163   22.198   7.2659   9.7039   9.3161   41.600   11.609   22.292   7.9855   43.992   6.3984 -21.69956 10.23269 
1 1 1    4   29   26 o   47.388   4.2444   47.595   7.8900   46.388   9.7121   49.937   13.531   46.782   5.0335   47.994   6.8355 -1.211807 8.488836 
1 1 1    4   29   27 o   37.081   5.3971   35.651   7.6512   44.255   9.3468   18.174   13.321   45.658   4.9634   28.505   9.5854 17.15355 10.79420 
1 1 1    4   29   28 o   37.442   5.7933   33.486   8.0328   35.555   9.4374   28.047   15.303   40.703   5.6216   34.180   10.131 6.522991 11.58662 
1 1 1    4   29   29 o   31.344   7.2177   23.564   10.709   22.572   15.670   24.434   14.668   30.840   10.396   31.848   10.015 -1.008104 14.43534 
1 1 1    4   29   30 o   42.061   5.3904   38.139   8.3376   35.070   9.8206   46.062   15.779   40.149   5.9305   43.973   9.0030 -3.824005 10.78075 
1 1 1    4   29   31 o   30.234   6.4789   21.807   8.1299   21.875   9.3925   21.605   16.234   30.541   7.5090   29.926   10.560 0.6152439 12.95784 
1 1 1    4   29   32 o   55.978   5.4181   76.918   10.305   83.020   12.189   61.627   19.294   62.119   4.7574   49.837   9.7360 12.28286 10.83612 
1 1 1    4   29   33 f   60.090   4.8646   85.530   11.007   94.704   13.657   68.528   18.593   66.143   5.0061   54.036   8.3424 12.10614 9.729140 
1 1 1    4   29   34 o   21.134   6.7039   3.9895   8.9294   6.4133   9.3486 -21.2339   30.158   19.552   7.7641   22.716   10.931 -3.164639 13.40776 
1 1 1    4   29   35 o   43.612   9.8234   39.300   10.677   36.367   10.906  106.871   52.350   39.939   6.6207   47.286   18.498 -7.347321 19.64689 
1 1 1    4   29   36 o   21.845   7.4555 -20.8537   20.025 -33.2284   27.104  -5.9809   29.714   19.563   9.6201   24.126   11.393 -4.562332 14.91096 
1 1 1    4   29   37 o   39.360   9.8487   56.854   20.524   65.291   27.900   46.903   30.300   43.199   13.838   35.520   14.018 7.678764 19.69749 
1 1 1    4   30    0 o   31.777   2.7851   21.819   4.9490   21.819   4.9490   21.819   4.9490   31.777   3.9388   31.777   3.9388 0.000000 0.000000 
1 1 1    4   30    1 o  107.486   2.4413  240.367   10.022  236.437   17.878  242.168   12.102  106.753   4.0605  108.220   2.7113 -1.466484 4.882512 
1 1 1    4   30    2 o   81.809   2.7691  139.078   9.1211  137.531   14.529  140.085   11.718   81.381   4.3285   82.237   3.4548 -0.8553619 5.538198 
1 1 1    4   30    3 o   48.858   4.6000   49.624   9.2695   0.0000   0.0000   49.624   9.2695  ?   ?    48.858   4.6000      ?      ? 
1 1 1    4   30    4 o  183.741   3.6556  709.561   26.838  678.168   43.201  729.291   34.249  180.150   5.8143  187.332   4.4327 -7.181992 7.311255 
1 1 1    4   30    5 o   76.346   3.6384  118.734   10.570  128.674   19.415  114.546   12.601   78.418   6.0027   74.273   4.1135 4.145058 7.276862 
1 1 1    4   30    6 o   69.930   3.7755   92.583   10.039  127.470   19.235   79.523   11.769   78.038   5.9761   61.822   4.6156 16.21545 7.551060 
1 1 1    4   30    7 o   53.092   5.1343   63.107   9.5288   53.927   17.847   66.768   11.269   49.567   9.0639   56.617   4.8260 -7.050350 10.26866 
1 1 1    4   30    8 f   45.279   5.8193   54.233   9.8242   18.216   16.049   75.814   12.424   30.260   10.512   60.298   4.9955 -30.03830 11.63858 
1 1 1    4   30    9 o   54.527   7.2832   69.041   15.614   94.039   21.449   40.861   22.773   66.586   7.8100   42.467   12.296 24.11901 14.56644 
1 1 1    4   30   10 o  136.064   3.9076  389.423   21.792  434.869   30.634  342.864   31.007  144.273   5.1481  127.854   5.8800 16.41920 7.815184 
1 1 1    4   30   11 o  164.989   5.0028  569.098   30.959  593.452   57.672  559.239   36.695  166.573   8.3944  163.404   5.4448 3.168900 10.00560 
1 1 1    4   30   12 o   61.670   9.2400  104.928   20.018  120.195   22.797   53.516   41.835   75.209   7.3492   48.131   16.956 27.07844 18.48008 
1 1 1    4   30   13 o  140.738   3.9759  417.470   22.995  440.630   31.829  392.182   33.258  144.968   5.3233  136.507   5.9072 8.460815 7.951855 
1 1 1    4   30   14 o   73.542   5.8647  114.343   17.642   97.418   23.463  136.361   26.761   67.319   8.4505   79.765   8.1345 -12.44588 11.72949 
1 1 1    4   30   15 o   25.976   7.7042 -15.2566   15.837 -41.8998   20.491   24.266   24.957   16.776   8.2716   35.176   13.000 -18.39989 15.40847 
1 1 1    4   30   16 o   79.918   7.6426  153.650   21.665  172.372   26.519  116.077   37.568   89.870   7.1544   69.967   13.508 19.90256 15.28526 
1 1 1    4   30   17 o   98.417   5.7003  209.896   23.009  209.954   34.362  209.849   30.978   98.171   8.4865   98.662   7.6127 -0.4908676 11.40066 
1 1 1    4   30   18 o   38.905   9.2030   33.453   17.411   24.223   22.778   46.423   27.001   34.052   12.446   43.758   13.560 -9.705326 18.40600 
1 1 1    4   30   19 o   43.250   9.6916   44.500   19.362   36.853   25.703   54.530   29.438   39.600   13.315   46.899   14.086 -7.299198 19.38313 
1 1 1    4   30   20 o   48.948   8.6943   69.638   22.861   99.158   26.137 -26.4719   47.160   66.817   9.4841   31.079   14.575 35.73753 17.38865 
1 1 1    4   30   21 o   44.496   7.1102   59.638   8.0978   62.873   8.4185   19.596   29.621   54.891   3.7185   34.101   13.726 20.78937 14.22035 
1 1 1    4   30   22 o   55.173   7.1995   69.549   9.1971   69.461   9.6487   70.422   30.417   57.577   4.0631   52.770   13.814 4.807350 14.39907 
1 1 1    4   30   23 o   76.580   6.2371  141.972   15.405  151.353   17.527  110.113   32.299   84.571   5.0247   68.588   11.417 15.98273 12.47424 
1 1 1    4   30   24 o   23.290   4.4190   11.885   4.0913   12.102   7.4830   11.793   4.8863   23.443   7.1157   23.136   5.2420 0.3065739 8.838078 
1 1 1    4   30   25 o   69.623   3.2657  102.541   9.2864  102.939   12.326  102.018   14.122   69.902   4.2753   69.344   4.9378 0.5572586 6.531480 
1 1 1    4   30   26 o   37.580   3.8701   28.006   5.6905   37.504   10.213   23.731   6.8526   41.745   5.9319   33.414   4.9723 8.330673 7.740251 
1 1 1    4   30   27 o   99.121   3.1637  206.488   12.740  198.049   16.502  218.936   20.042   96.838   4.1317  101.405   4.7921 -4.567238 6.327331 
1 1 1    4   30   28 o   19.983   6.1685   3.7355   7.5979   7.4601   7.8562 -50.1384   29.878   19.813   7.2991   20.152   9.9460 -0.3390579 12.33693 
1 1 1    4   30   29 o   19.075   5.5690   3.6805   6.5821   2.5429   7.8497   6.3746   12.080   16.738   6.9387   21.413   8.7126 -4.675482 11.13800 
1 1 1    4   30   30 o   25.614   6.9485   13.730   10.322   11.944   15.136   15.283   14.114   24.974   9.8913   26.254   9.7616 -1.279329 13.89700 
1 1 1    4   30   31 o   29.365   6.3830   21.252   8.0980   22.288   9.4608   18.415   15.661   30.697   7.5296   28.033   10.309 2.663940 12.76591 
1 1 1    4   30   32 o   22.680   7.2411   3.5109   8.5210   3.2334   8.8861   6.6814   30.038   17.683   7.3609   27.678   12.472 -9.995100 14.48229 
1 1 1    4   30   33 o   37.629   9.5983   38.327   22.006   4.1935   29.832   79.068   32.592   26.553   12.147   48.704   14.865 -22.15062 19.19666 
1 1 1    4   30   34 o   28.956   9.7823   0.2979   32.819   0.2141   46.104   0.3841   46.727   28.900   13.802   29.013   13.867 -0.1132145 19.56464 
1 1 1    4   30   35 o   20.912   7.2227 -27.4031   20.247 -36.4477   27.322 -16.3855   30.155   19.211   9.4870   22.612   10.893 -3.400974 14.44534 
1 1 1    4   30   36 o   28.223   8.8826   18.141   20.876   7.7940   28.237   30.614   31.002   25.605   11.751   30.841   13.324 -5.236065 17.76517 
1 1 1    4   31    0 o   71.197   3.6211  106.798   14.859  106.798   14.859  106.798   14.859   71.197   5.1210   71.197   5.1210 0.000000 0.000000 
1 1 1    4   31    1 o   36.364   3.3788   26.471   4.4859   29.970   8.9158   25.285   5.1909   37.823   5.7153   34.906   3.6056 2.917343 6.757625 
1 1 1    4   31    2 o   18.114   4.5791   3.1175   4.5892   11.742   7.7363  -1.5652   5.7006   23.539   7.2524   12.689   5.5925 10.84917 9.158248 
1 1 1    4   31    3 o   40.293   5.0652   33.908   8.4176   0.0000   0.0000   33.908   8.4176  ?   ?    40.293   5.0652      ?      ? 
1 1 1    4   31    4 o   34.643   5.2649   23.618   6.8203   34.650   12.768   19.214   8.0679   39.672   8.0775   29.614   6.7549 10.05813 10.52976 
1 1 1    4   31    5 o   62.895   4.0729   86.999   9.4863   73.367   17.042   93.119   11.419   58.892   7.0162   66.898   4.1385 -8.006245 8.145811 
1 1 1    4   31    6 o   51.668   5.4357   67.961   9.2115   37.733   16.711   81.155   11.040   40.912   9.9899   62.423   4.2882 -21.51048 10.87135 
1 1 1    4   31    7 o   47.762   5.3560   52.260   8.9472   42.842   16.622   56.102   10.616   43.723   9.4898   51.800   4.9691 -8.077423 10.71207 
1 1 1    4   31    8 o   25.124   5.9004   13.395   7.9222  -6.1092   16.069   19.657   9.1057   20.419   9.1686   29.828   7.4293 -9.409491 11.80080 
1 1 1    4   31    9 o  113.045   4.0551  269.292   18.822  276.145   25.644  261.288   27.713  114.723   5.4195  111.366   6.0335 3.356750 8.110148 
1 1 1    4   31   10 o  116.949   4.0660  285.908   19.494  273.141   25.950  302.444   29.532  114.060   5.5163  119.838   5.9750 -5.778030 8.132014 
1 1 1    4   31   11 o   26.270   8.2658 -12.0298   19.845 -81.9557   40.062   10.708   22.845   22.972   11.371   29.568   12.000 -6.596254 16.53151 
1 1 1    4   31   12 o   26.129   8.5617 -17.0881   16.043 -22.0464   17.657   6.3809   38.414   17.845   8.5276   34.412   14.849 -16.56738 17.12331 
1 1 1    4   31   13 o   23.642   7.4851  -6.2521   15.115   0.0417   19.622 -15.4357   23.702   24.353   10.560   22.931   10.611 1.422304 14.97015 
1 1 1    4   31   14 o   58.218   7.6239   79.544   17.316   88.560   22.548   66.582   27.036   63.717   8.5799   52.718   12.605 10.99950 15.24783 
1 1 1    4   31   15 o   37.503   8.9315   32.537   16.590   38.173   21.351   23.951   26.352   40.204   11.979   34.802   13.251 5.402794 17.86308 
1 1 1    4   31   16 o  121.151   5.2178  302.828   24.706  276.316   29.926  359.565   43.779  113.850   6.3731  128.453   8.2634 -14.60329 10.43556 
1 1 1    4   31   17 o   48.518   8.7330   57.884   17.844   69.484   24.145   43.927   26.486   54.478   11.122   42.558   13.467 11.92043 17.46600 
1 1 1    4   31   18 o   38.287   9.3330   33.941   17.886   36.428   23.780   30.700   27.140   39.281   12.793   37.294   13.592 1.987186 18.66592 
1 1 1    4   31   19 o   68.752   10.052   97.120   24.884  173.396   50.804   73.047   28.541   82.746   15.455   54.758   12.857 27.98817 20.10355 
1 1 1    4   31   20 o   54.533   8.6123   74.865   19.192   88.896   25.025   54.829   29.905   62.793   9.6627   46.274   14.259 16.51923 17.22469 
1 1 1    4   31   21 o   63.646   7.8527   98.963   19.305  120.131   25.869   72.355   29.003   73.610   8.5208   53.683   13.193 19.92701 15.70539 
1 1 1    4   31   22 o   75.489   6.6219  128.130   20.516  123.529   27.508  133.899   30.799   74.228   8.9851   76.751   9.7295 -2.523643 13.24371 
1 1 1    4   31   23 f   19.621   6.7433  -4.1754   5.1576  -4.4537   5.2449   3.9763   28.386   10.633   4.9447   28.609   12.548 -17.97541 13.48667 
1 1 1    4   31   24 o   36.248   8.2833   23.210   7.5664   22.234   7.7472   43.386   35.235   31.627   6.1606   40.869   15.379 -9.241837 16.56664 
1 1 1    4   31   25 o   79.425   2.5200  134.309   8.0955  120.402   12.325  144.860   10.736   75.598   3.9530   83.251   3.1267 -7.653473 5.040040 
1 1 1    4   31   26 o   25.581   4.5127   14.546   4.4945   15.472   8.0651   14.128   5.4129   25.965   7.2521   25.198   5.3725 0.7678242 9.025357 
1 1 1    4   31   27 o   61.800   3.3812   83.263   8.0321   76.704   13.842   86.592   9.8621   59.505   5.6402   64.096   3.7306 -4.590897 6.762350 
1 1 1    4   31   28 o   27.999   4.7805   17.892   5.3241   18.913   8.7452   17.291   6.7112   28.408   7.3927   27.590   6.0631 0.8174458 9.561059 
1 1 1    4   31   29 o   14.763   4.4692   0.4438   4.6260   2.4522   7.8985  -0.6049   5.7073   16.615   6.9301   12.910   5.6452 3.704837 8.938357 
1 1 1    4   31   30 o   62.095   8.5341  103.585   21.306  113.020   29.419   93.177   30.899   66.919   10.659   57.271   13.331 9.648174 17.06818 
1 1 1    4   31   31 o   41.879   9.7550   58.058   22.624   79.366   28.919   24.446   36.320   51.641   13.446   32.117   14.137 19.52417 19.51009 
1 1 1    4   31   32 o   46.982   8.6541   63.483   20.723   17.877   28.273  116.425   30.463   29.085   12.644   64.879   11.820 -35.79377 17.30825 
1 1 1    4   31   33 o   23.508   7.8529 -10.9719   19.956 -24.6853   26.897   5.8208   29.764   20.631   10.022   26.385   12.093 -5.754606 15.70587 
1 1 1    4   31   34 o   34.676   10.287   45.754   24.645   46.822   29.152   43.077   46.137   36.060   13.887   33.291   15.181 2.769012 20.57473 
1 1 1    4   31   35 o   37.355   8.8013   41.998   20.674   85.776   28.843  -4.2595   29.649   50.908   13.512   23.802   11.282 27.10585 17.60254 
1 1 1    4   32    1 o   49.511   2.7590   50.614   4.9869   51.869   9.6890   50.161   5.8165   49.823   4.7150   49.199   2.8664 0.6238594 5.517922 
1 1 1    4   32    2 o   39.300   4.2195   32.942   6.2018   33.079   10.939   32.878   7.5288   38.921   7.0748   39.680   4.6003 -0.7584724 8.438992 
1 1 1    4   32    3 f   28.063   6.4277   17.276   7.2798   0.0000   0.0000   17.276   7.2798  ?   ?    28.063   6.4277      ?      ? 
1 1 1    4   32    4 o   82.368   3.4121  141.816   10.641  141.873   19.338  141.791   12.744   82.157   5.7069   82.579   3.7418 -0.4215622 6.824198 
1 1 1    4   32    5 o   36.767   5.1178   24.614   7.1439   44.237   13.636   17.190   8.3871   45.610   7.2488   27.924   7.2266 17.68572 10.23566 
1 1 1    4   32    6 o   42.908   5.3399   42.481   8.0615   34.459   15.098   45.680   9.5345   39.095   9.4645   46.721   4.9479 -7.625767 10.67984 
1 1 1    4   32    7 o   27.216   5.6929   17.778   7.4201   0.5839   14.892   23.457   8.5581   21.694   9.3015   32.738   6.5665 -11.04437 11.38579 
1 1 1    4   32    8 o   61.525   4.5964   81.119   10.469   78.329   19.529   82.243   12.401   60.386   7.8412   62.665   4.7981 -2.278912 9.192715 
1 1 1    4   32    9 o   58.935   6.2498   75.789   15.136   76.215   20.597   75.289   22.316   59.261   8.4269   58.609   9.2319 0.6520386 12.49967 
1 1 1    4   32   10 o   79.533   5.0339  133.957   16.343  124.508   21.359  147.303   25.384   76.332   6.7842   82.734   7.4389 -6.401978 10.06789 
1 1 1    4   32   11 o   30.728   9.4276   2.7768   19.312   18.191   38.756  -2.3149   22.275   36.452   15.288   25.004   11.036 11.44769 18.85528 
1 1 1    4   32   12 o   52.592   7.5742   66.411   15.663   76.737   20.163   50.694   24.875   59.372   8.2338   45.812   12.715 13.56001 15.14848 
1 1 1    4   32   13 o   32.188   8.5176   19.617   14.878   15.862   18.841   25.837   24.249   29.431   11.205   34.945   12.831 -5.513550 17.03515 
1 1 1    4   32   14 o   68.199   6.3006  102.632   17.546  104.103   23.376  100.732   26.555   69.091   8.2030   67.308   9.5656 1.783325 12.60124 
1 1 1    4   32   15 o   47.179   8.7703   53.305   17.025   51.662   21.880   55.826   27.103   46.669   11.453   47.689   13.285 -1.019585 17.54055 
1 1 1    4   32   16 o  149.093   5.3521  483.818   32.608  505.946   43.965  456.761   48.615  153.460   6.9461  144.727   8.1443 8.733536 10.70417 
1 1 1    4   32   17 o   66.530   6.8592   97.674   18.647   84.971   24.491  115.196   28.763   61.504   9.6546   71.556   9.7459 -10.05210 13.71840 
1 1 1    4   32   18 o   39.520   9.1828   36.506   17.631   24.804   23.519   51.517   26.638   33.872   12.600   45.168   13.362 -11.29652 18.36559 
1 1 1    4   32   19 o   26.996   9.1607 -39.5970   29.543 -50.2863   43.934 -30.7737   39.916   26.613   12.900   27.379   13.010 -0.7664833 18.32140 
1 1 1    4   32   20 o   23.595   7.7038 -12.5452   17.626  -5.9188   23.439 -21.1693   26.739   24.250   10.964   22.940   10.825 1.309849 15.40750 
1 1 1    4   32   21 o   40.289   9.2039   41.732   18.801   56.139   24.488   21.048   29.341   47.152   12.419   33.426   13.587 13.72667 18.40772 
1 1 1    4   32   22 o   26.762   8.3269   2.0804   17.667   0.7946   23.501   3.7515   26.792   25.706   11.341   27.818   12.196 -2.111773 16.65381 
1 1 1    4   32   23 f   35.612   9.4587   31.004   18.817   32.859   24.951   28.558   28.653   36.216   13.058   35.008   13.688 1.207729 18.91744 
1 1 1    4   32   24 o   40.414   10.073   43.898   20.987   56.365   31.495   33.941   28.147   44.406   14.736   36.422   13.737 7.983856 20.14545 
1 1 1    4   32   25 o   41.614   6.8724   52.557   8.4280   55.811   8.8515   20.980   27.575   51.321   4.1817   31.906   13.093 19.41482 13.74480 
1 1 1    4   32   26 o   41.098   8.3448   38.453   13.095   31.709   14.906   61.256   27.408   35.674   9.8204   46.522   13.495 -10.84834 16.68962 
1 1 1    4   32   27 o   35.474   10.394   33.185   22.797   31.536   26.140   38.423   46.592   34.205   13.156   36.743   16.096 -2.537781 20.78899 
1 1 1    4   32   28 o   44.204   9.7289   57.117   19.696   47.352   26.442   69.288   29.520   40.166   13.505   48.242   14.008 -8.076004 19.45784 
1 1 1    4   32   29 o   28.328   8.5541   7.9070   19.208 -16.6779   26.887   33.534   27.451   22.336   10.632   34.321   13.403 -11.98433 17.10811 
1 1 1    4   32   30 o   29.929   8.9426   19.783   19.844   33.174   26.886   3.7613   29.409   33.508   13.211   26.351   12.056 7.157143 17.88512 
1 1 1    4   32   31 o   39.683   9.8507   46.366   22.591   89.561   34.230   13.034   30.070   51.211   15.146   28.155   12.599 23.05651 19.70135 
1 1 1    4   32   32 o   41.760   9.7458   58.534   20.817   36.140   28.468   84.265   30.517   33.233   13.428   50.286   14.129 -17.05322 19.49170 
1 1 1    4   32   33 o   26.421   8.9844  -6.3452   25.870   29.555   45.513 -23.4799   31.443   30.972   14.457   21.870   10.671 9.101315 17.96889 
1 1 1    4   33    0 o   41.652   3.5864   37.674   8.3684   37.674   8.3684   37.674   8.3684   41.652   5.0719   41.652   5.0719 0.000000 0.000000 
1 1 1    4   33    1 o   25.507   6.5646   13.254   6.8185   15.051   7.0697 -10.6886   25.808   26.079   6.5746   24.936   11.364 1.142963 13.12913 
1 1 1    4   33    2 o   27.129   4.7669   16.455   5.0850   15.328   8.9797   16.986   6.1695   26.362   7.7465   27.896   5.5573 -1.534346 9.533744 
1 1 1    4   33    3 o   60.686   4.2006   78.173   10.495   83.615   14.855   72.752   14.828   62.854   5.7304   58.518   6.1436 4.336754 8.401252 
1 1 1    4   33    4 o   40.287   4.8412   35.454   7.2095   34.797   12.921   35.751   8.6875   39.368   8.2230   41.205   5.1119 -1.836903 9.682394 
1 1 1    4   33    5 o   57.405   4.1018   71.690   8.8670   64.910   15.793   74.811   10.715   55.035   6.9576   59.775   4.3463 -4.740135 8.203547 
1 1 1    4   33    6 o   36.753   5.3390   26.352   7.1215   39.935   14.094   21.695   8.2524   42.167   8.3993   31.339   6.5934 10.82786 10.67808 
1 1 1    4   33    7 o   21.242   5.8643   5.9536   6.5778   9.5639   13.278   4.7795   7.5721   24.294   9.3678   18.190   7.0573 6.104023 11.72865 
1 1 1    4   33    8 o  101.938   4.2489  219.159   17.796  246.072   26.416  196.792   24.081  107.657   5.9491   96.219   6.0680 11.43746 8.497827 
1 1 1    4   33    9 o   78.149   5.0669  131.352   16.282  145.236   23.373  118.264   22.693   82.283   6.8872   74.015   7.4338 8.268059 10.13386 
1 1 1    4   33   10 o   75.743   4.1440  126.782   11.892  107.922   20.555  136.271   14.580   70.857   7.0334   80.629   4.3842 -9.771568 8.287982 
1 1 1    4   33   11 f   55.277   9.2129   83.879   20.633   44.604   38.955   99.194   24.325   43.376   16.200   67.178   8.7793 -23.80277 18.42575 
1 1 1    4   33   12 o   64.376   6.6775   97.063   16.249  112.293   21.104   74.889   25.464   72.261   7.0810   56.491   11.323 15.76957 13.35503 
1 1 1    4   33   13 o   70.880   5.8824  108.140   17.050   94.307   22.467  126.924   26.180   65.636   8.2994   76.124   8.3385 -10.48827 11.76483 
1 1 1    4   33   14 o   52.247   7.5550   60.270   16.376   29.258   21.222  105.911   25.745   35.544   12.098   68.951   9.0529 -33.40718 15.11008 
1 1 1    4   33   15 o   55.513   8.6645   77.259   18.600   82.424   22.602   66.422   32.738   60.716   9.0255   50.311   14.793 10.40527 17.32907 
1 1 1    4   33   16 o   27.531   8.3729   3.9148   17.526   12.577   23.668  -6.5999   26.077   29.554   12.129   25.508   11.546 4.046362 16.74585 
1 1 1    4   33   17 o   23.249   7.5428  -9.8131   16.127 -10.5983   20.918  -8.6624   25.321   21.874   10.067   24.624   11.236 -2.749258 15.08557 
1 1 1    4   33   18 o   31.251   8.7739   18.416   16.800   20.701   21.778   15.058   26.402   31.580   12.041   30.921   12.764 0.6588593 17.54776 
1 1 1    4   33   19 o   76.851   9.2420  162.815   23.713  182.345   27.963  112.817   44.742   91.047   7.4466   62.654   16.918 28.39334 18.48408 
1 1 1    4   33   20 o   27.566   8.3803   6.5550   16.983   3.8496   22.317   10.278   26.179   25.929   11.253   29.203   12.422 -3.273800 16.76063 
1 1 1    4   33   21 o   35.370   9.2017   29.784   17.894   20.331   24.309   40.965   26.437   31.419   12.506   39.320   13.501 -7.901154 18.40337 
1 1 1    4   33   22 o  123.303   4.6816  333.332   23.737  323.101   32.163  345.569   35.177  121.458   6.4205  125.147   6.8151 -3.689613 9.363167 
1 1 1    4   33   23 o   36.855   9.8135   35.234   19.631   33.361   24.170   38.864   33.652   35.830   12.859   37.880   14.827 -2.049690 19.62694 
1 1 1    4   33   24 o   61.025   8.1249   96.407   19.726  116.345   27.516   75.324   28.294   69.793   9.5587   52.256   13.141 17.53709 16.24976 
1 1 1    4   33   25 o   36.493   9.4856   37.492   18.780   32.227   25.741   43.483   27.459   34.463   13.103   38.524   13.719 -4.061275 18.97110 
1 1 1    4   33   26 f   36.499   10.008   38.209   24.407   0.1383   42.760   56.606   29.724   29.943   13.989   43.054   14.317 -13.11047 20.01652 
1 1 1    4   33   27 o   35.099   9.4555   34.752   19.835   47.101   27.039   20.365   29.184   39.489   13.648   30.709   13.090 8.780062 18.91098 
1 1 1    4   33   28 o   28.560   8.5996   9.5407   19.280 -15.2253   26.528   37.271   28.070   22.167   10.554   34.953   13.580 -12.78629 17.19916 
1 1 1    4   33   29 o   23.369   7.6988 -10.1684   18.446 -28.0030   25.153   10.582   27.132   19.643   9.5758   27.095   12.058 -7.452009 15.39750 
1 1 1    4   33   30 o   20.908   7.2495 -30.7357   20.956 -21.0464   26.004 -48.6859   35.395   20.718   10.014   21.097   10.485 -0.3793564 14.49894 
1 1 1    4   33   31 o   27.937   8.6338   15.580   19.291   0.5488   26.264   33.189   28.428   23.945   11.111   31.929   13.218 -7.984734 17.26770 
1 1 1    4   33   32 o   32.038   12.916   34.256   26.274   34.256   26.274   0.0000   0.0000   32.038   12.916  ?   ?       ?      ? 
1 1 1    4   34    0 o   38.099   3.4317   31.635   7.2884   31.635   7.2884   31.635   7.2884   38.099   4.8532   38.099   4.8532 0.000000 0.000000 
1 1 1    4   34    1 f   63.717   5.0308   85.538   13.221   85.538   13.221   0.0000   0.0000   63.717   5.0308  ?   ?       ?      ? 
1 1 1    4   34    2 f   46.899   3.5841   48.403   6.2509   41.316   11.183   51.624   7.5386   44.051   6.1549   49.747   3.6742 -5.695564 7.168147 
1 1 1    4   34    3 o   61.671   4.0994   81.050   10.366   71.928   14.765   89.916   14.556   58.122   6.1593   65.219   5.4114 -7.097126 8.198815 
1 1 1    4   34    4 o   55.308   3.9742   66.665   8.2326   60.021   14.774   69.658   9.9145   52.923   6.7687   57.692   4.1666 -4.769634 7.948312 
1 1 1    4   34    5 o   22.210   5.7363   7.9380   6.4137   13.320   11.702   5.6271   7.6680   25.621   8.9717   18.798   7.1504 6.823425 11.47261 
1 1 1    4   34    6 o   22.439   5.7006   6.2917   6.1662   17.707   12.408   2.5478   7.1058   28.470   9.2394   16.409   6.6800 12.06073 11.40125 
1 1 1    4   34    7 o   58.891   4.3687   76.506   9.4956   67.552   17.339   80.342   11.349   55.889   7.5219   61.893   4.4457 -6.004143 8.737457 
1 1 1    4   34    8 o   73.102   3.8640  103.629   10.594  136.808   20.698   91.850   12.332   80.064   6.2678   66.140   4.5208 13.92432 7.728096 
1 1 1    4   34    9 o   88.316   4.6476  167.272   16.873  185.876   24.253  149.822   23.489   93.208   6.3087   83.424   6.8266 9.783676 9.295289 
1 1 1    4   34   10 o   27.477   6.0639   18.293   8.2995  -2.3080   17.649   24.142   9.4043   22.143   9.7952   32.812   7.1511 -10.66897 12.12787 
1 1 1    4   34   11 o   35.777   6.4552   24.236   8.4563   43.359   17.828   18.685   9.6058   42.841   10.230   28.712   7.8750 14.12869 12.91035 
1 1 1    4   34   12 o   69.372   6.0510  111.592   16.345  130.909   21.373   84.381   25.367   77.911   6.6510   60.832   10.110 17.07985 12.10191 
1 1 1    4   34   13 o   64.680   6.7221   97.969   16.779  111.330   22.176   80.077   25.663   71.377   7.5329   57.983   11.136 13.39322 13.44420 
1 1 1    4   34   14 o  146.078   4.0070  451.868   23.999  421.982   31.900  490.838   36.428  140.709   5.4968  151.447   5.8319 -10.73810 8.014097 
1 1 1    4   34   15 o   85.056   6.2108  163.975   20.185  166.726   24.578  158.273   35.377   87.572   6.8047   82.541   10.392 5.030693 12.42151 
1 1 1    4   34   16 o   46.745   8.9454   55.040   18.069   40.405   24.760   71.715   26.429   39.925   13.056   53.566   12.231 -13.64135 17.89072 
1 1 1    4   34   17 o   23.323   7.4602 -10.5057   15.396 -23.0146   19.921   8.0489   24.263   18.697   8.9675   27.949   11.925 -9.251781 14.92034 
1 1 1    4   34   18 o   32.331   9.7398   17.010   21.632   13.433   39.894   18.500   25.745   33.403   14.754   31.259   12.719 2.144381 19.47967 
1 1 1    4   34   19 o   29.834   9.0001   12.656   19.600   21.668   22.785 -12.9893   38.436   31.459   12.232   28.208   13.206 3.251482 18.00022 
1 1 1    4   34   20 f   29.360   8.2064   12.934   16.873   32.359   21.919 -15.3167   26.434   35.550   12.288   23.170   10.880 12.38007 16.41281 
1 1 1    4   34   21 o   51.683   8.6171   70.993   18.040   76.478   23.924   63.763   27.466   55.303   10.876   48.063   13.369 7.239857 17.23416 
1 1 1    4   34   22 o   31.739   8.9923   23.412   17.858   22.480   24.421   24.483   26.180   31.283   12.508   32.194   12.923 -0.9113579 17.98452 
1 1 1    4   34   23 o   23.911   7.9670 -17.2220   20.246 -32.8439   26.933   3.0730   30.699   20.335   9.9120   27.487   12.476 -7.152189 15.93402 
1 1 1    4   34   24 o   41.237   9.1955   50.077   18.819   64.988   25.015   30.637   28.564   48.517   12.442   33.956   13.544 14.56063 18.39093 
1 1 1    4   34   25 o   24.989   8.0126  -0.7852   18.279   9.5688   24.588 -13.5772   27.330   26.896   11.740   23.082   10.908 3.814339 16.02526 
1 1 1    4   34   26 o   28.635   9.3072   2.1478   21.757 -10.1198   25.304   36.940   42.614   22.558   10.610   34.712   15.295 -12.15408 18.61448 
1 1 1    4   34   27 o   33.765   8.5829   25.588   19.089   62.673   26.648 -13.4968   27.358   44.921   13.382   22.610   10.751 22.31078 17.16587 
1 1 1    4   34   28 o   28.445   8.7399   16.651   19.399   25.755   27.054   7.0145   27.832   30.680   12.814   26.209   11.889 4.471039 17.47976 
1 1 1    4   34   29 o   30.362   8.9273   23.560   19.450   4.5238   26.832   44.639   28.235   24.977   11.460   35.747   13.691 -10.77013 17.85467 
1 1 1    4   34   30 o   23.001   7.9057 -18.0462   23.371 -19.8502   30.595 -15.5190   36.212   21.999   10.687   24.003   11.653 -2.003826 15.81149 
1 1 1    4   35    0 o   35.410   8.9081   35.810   16.769   35.810   16.769   35.810   16.769   35.410   12.598   35.410   12.598 0.000000 0.000000 
1 1 1    4   35    1 o   39.446   6.6497   41.911   9.0310   45.852   9.8581   21.333   22.524   46.536   5.1362   32.355   12.268 14.18051 13.29948 
1 1 1    4   35    2 o   48.637   7.1658   52.002   10.533   50.741   11.442   59.007   26.973   48.807   5.6840   48.467   13.156 0.3395844 14.33154 
1 1 1    4   35    3 o   43.622   3.7774   38.127   6.3846   47.115   11.603   34.224   7.6463   46.941   5.9930   40.303   4.5999 6.638180 7.554836 
1 1 1    4   35    4 f   54.563   4.1736   62.501   9.3924   0.0000   0.0000   62.501   9.3924  ?   ?    54.563   4.1736      ?      ? 
1 1 1    4   35    5 o   88.753   3.6473  167.746   13.040  162.825   20.602  171.036   16.844   87.389   5.7160   90.116   4.5319 -2.726387 7.294592 
1 1 1    4   35    6 o   32.206   5.6016   25.002   7.0950   17.222   13.733   27.835   8.2865   28.246   9.7290   36.166   5.5552 -7.920179 11.20324 
1 1 1    4   35    7 o   98.887   4.2360  208.136   17.205  236.382   25.227  183.572   23.525  105.234   5.8123   92.541   6.1636 12.69225 8.471918 
1 1 1    4   35    8 f   45.995   6.7680   52.831   12.808   74.409   17.145   25.581   19.267   58.534   7.1016   33.456   11.523 25.07806 13.53602 
1 1 1    4   35    9 o   27.992   7.5601   13.675   12.144   8.3145   15.923   21.130   18.777   24.737   10.026   31.248   11.319 -6.510798 15.12024 
1 1 1    4   35   10 o   43.308   6.2561   48.364   9.3601   31.934   18.977   53.645   10.760   36.377   11.384   50.239   5.1928 -13.86223 12.51228 
1 1 1    4   35   11 o   50.452   6.4793   68.337   10.468   41.433   21.610   76.585   11.965   40.780   12.027   60.124   4.8250 -19.34371 12.95868 
1 1 1    4   35   12 o   77.625   5.3356  136.950   16.428  159.420   21.877  107.902   24.875   85.988   6.1687   69.262   8.7077 16.72616 10.67125 
1 1 1    4   35   13 o   48.669   7.6072   54.314   14.705   40.715   18.673   76.518   23.860   40.810   10.891   56.528   10.624 -15.71812 15.21445 
1 1 1    4   35   14 o   30.782   8.3891   17.318   14.897   9.3993   18.929   30.204   24.147   26.192   10.810   35.372   12.832 -9.179993 16.77827 
1 1 1    4   35   15 o   24.714   7.8678  -1.1279   16.009   4.7184   18.664 -17.3983   31.137   24.353   10.427   25.075   11.785 -0.7213402 15.73570 
1 1 1    4   35   16 o   33.173   8.7626   23.689   17.488   40.816   24.167   4.8608   25.338   39.289   12.902   27.056   11.861 12.23387 17.52521 
1 1 1    4   35   17 o   47.255   8.4046   55.726   16.686   38.266   21.882   79.980   25.791   38.260   12.255   56.250   11.505 -17.99021 16.80912 
1 1 1    4   35   18 o   36.415   9.3860   33.300   22.458 -21.3625   41.083   56.595   26.820   27.584   13.133   45.246   13.413 -17.66121 18.77194 
1 1 1    4   35   19 o   27.684   8.3800   9.7710   17.431   17.849   22.976  -1.1834   26.755   29.629   12.031   25.739   11.668 3.889860 16.75993 
1 1 1    4   35   20 o   23.640   7.6276  -4.1890   16.756   3.8361   22.037 -15.1872   25.798   24.846   10.971   22.434   10.600 2.411638 15.25517 
1 1 1    4   35   21 o   24.260   7.8034  -2.1498   17.192   2.9033   23.097  -8.4282   25.745   24.957   11.114   23.564   10.957 1.392756 15.60687 
1 1 1    4   35   22 f   56.039   8.3264   82.763   18.567   73.774   24.874   94.076   27.903   52.531   11.772   59.547   11.778 -7.016235 16.65273 
1 1 1    4   35   23 o   26.327   8.4668   2.5606   19.859   3.8320   30.882   1.6641   25.931   27.289   12.435   25.366   11.495 1.922865 16.93359 
1 1 1    4   35   24 f   36.131   9.5179   39.973   19.176   32.366   26.752   48.013   27.502   33.378   13.172   38.884   13.742 -5.505878 19.03572 
1 1 1    4   35   25 o   43.604   9.7981   69.532   23.525   29.643   43.681   85.828   27.919   32.943   14.924   54.264   12.700 -21.32137 19.59616 
1 1 1    4   35   26 o   28.680   9.1366   15.335   21.734   19.504   24.964   2.2816   44.175   28.717   12.169   28.642   13.632 0.7500839E-01 18.27329 
1 1 1    4   35   27 o   49.320   8.8411   75.075   19.888   40.540   26.974  116.212   29.440   34.679   13.357   63.961   11.586 -29.28250 17.68217 
1 1 1    4   35   28 o   23.900   7.8083  -0.4862   18.583   14.015   25.714 -16.3381   26.885   26.520   11.773   21.280   10.260 5.240717 15.61655 
1 1 1    4   36    1 o   53.146   6.3126   91.061   8.4989  101.831   9.2433   32.154   21.617   69.856   3.2082   36.436   12.211 33.42008 12.62528 
1 1 1    4   36    2 o   13.719   6.0250  -1.2113   6.5641  -1.2113   6.5641   0.0000   0.0000   13.719   6.0250  ?   ?       ?      ? 
1 1 1    4   36    3 o   50.051   3.4084   51.211   6.5369   58.141   11.955   48.255   7.8075   52.163   5.5567   47.938   3.9488 4.225578 6.816886 
1 1 1    4   36    4 o   26.237   8.8519   15.017   11.361   0.0000   0.0000   15.017   11.361  ?   ?    26.237   8.8519      ?      ? 
1 1 1    4   36    5 o   15.185   4.5801  -0.1736   5.3262 -15.1520   10.977   4.4391   6.0913   13.679   6.5853   16.692   6.3674 -3.013225 9.160243 
1 1 1    4   36    6 o   39.313   5.1719   31.774   7.4401   41.198   14.430   28.362   8.6833   42.263   8.5716   36.363   5.7898 5.899979 10.34380 
1 1 1    4   36    7 o   19.587   5.6517   4.0907   6.2558   6.5791   13.038   3.3465   7.1301   22.391   9.0731   16.782   6.7414 5.608496 11.30341 
1 1 1    4   36    8 o   23.888   6.1674   10.130   6.9866   14.932   14.310   8.6275   8.0055   26.923   9.8613   20.853   7.4097 6.070318 12.33482 
1 1 1    4   36    9 o   57.400   6.1897   76.540   13.936   89.987   19.203   61.580   20.255   63.931   7.2827   50.870   10.011 13.06105 12.37946 
1 1 1    4   36   10 o   47.173   6.0805   55.425   9.7249   42.519   19.113   59.934   11.297   41.381   11.007   52.964   5.1713 -11.58302 12.16104 
1 1 1    4   36   11 o   47.058   6.5013   60.949   10.902   32.712   20.322   72.358   12.918   36.065   11.830   58.050   5.3954 -21.98498 13.00263 
1 1 1    4   36   12 o   25.996   6.8019   5.4552   8.3910   31.655   19.327  -0.6300   9.3146   35.482   11.532   16.511   7.2161 18.97037 13.60388 
1 1 1    4   36   13 o   36.412   6.4594   33.446   9.2806   24.696   18.321   36.467   10.764   32.015   11.225   40.810   6.3949 -8.794922 12.91880 
1 1 1    4   36   14 o   38.228   8.4326   38.308   14.783   41.016   19.355   34.516   22.902   40.044   11.253   36.412   12.562 3.631886 16.86515 
1 1 1    4   36   15 o   56.263   8.1972   80.658   17.664   81.459   21.648   79.063   30.555   59.211   8.8643   53.315   13.791 5.896595 16.39450 
1 1 1    4   36   16 o   39.954   8.6043   41.536   15.708   30.006   20.829   56.738   23.917   34.068   11.968   45.840   12.366 -11.77162 17.20856 
1 1 1    4   36   17 o   32.012   8.4484   22.242   15.761   7.2351   20.883   42.101   24.023   25.365   10.947   38.659   12.872 -13.29346 16.89688 
1 1 1    4   36   18 o   26.257   8.4964  -0.6043   20.491 -18.1471   36.324   7.5842   24.817   25.792   12.299   26.721   11.726 -0.9295673 16.99287 
1 1 1    4   36   19 o   35.942   9.1136   35.305   16.988   30.214   22.235   42.444   26.331   33.658   12.298   38.226   13.454 -4.568798 18.22720 
1 1 1    4   36   20 o   21.100   7.0435 -13.9855   15.768 -18.7163   20.767  -7.5459   24.229   19.256   9.2146   22.943   10.655 -3.686966 14.08704 
1 1 1    4   36   21 o   21.807   7.1634 -15.9673   16.823   8.6264   22.752 -45.6348   24.989   25.872   11.293   17.742   8.8161 8.129784 14.32683 
1 1 1    4   36   22 o   27.623   8.5934   12.377   19.194   19.278   24.033   0.2220   31.894   28.908   12.075   26.339   12.230 2.568430 17.18686 
1 1 1    4   36   23 o   27.605   8.6994   11.745   20.037   9.0677   30.174   13.856   26.798   27.427   12.417   27.782   12.188 -0.3549786 17.39885 
1 1 1    4   36   24 o   39.595   7.8272   39.392   18.726   91.407   26.361 -13.5934   26.606   57.115   11.587   22.075   10.527 35.03934 15.65431 
1 1 1    4   36   25 o   32.583   9.9020   18.973   22.681   80.737   42.093  -6.2974   26.925   42.129   16.555   23.038   10.868 19.09126 19.80406 
1 1 1    4   36   26 o   33.907   9.0547   36.675   19.065   58.703   26.785   14.056   27.142   41.056   13.587   26.757   11.972 14.29961 18.10930 
1 1 1    4   36   27 o   21.801   7.3101 -16.0822   18.194 -41.4726   25.122   11.924   26.385   17.575   8.7503   26.028   11.713 -8.453430 14.62023 
1 1 1    4   37    2 o   30.497   4.8653   28.126   8.3341   41.433   9.2009 -32.6824   19.668   44.040   5.0655   16.954   8.3081 27.08549 9.730565 
1 1 1    4   37    3 o   35.343   6.5382   35.019   9.5798   40.449   10.533   9.0119   23.050   43.232   5.9069   27.454   11.666 15.77808 13.07639 
1 1 1    4   37    4 f   16.976   4.7460   1.9106   4.7021   9.0457   8.6709  -1.0617   5.5964   21.316   7.6960   12.636   5.5561 8.679978 9.492043 
1 1 1    4   37    5 o   19.302   5.2472   5.7984   5.3665   8.1456   10.265   4.9156   6.2953   21.502   8.2507   17.101   6.4852 4.401041 10.49437 
1 1 1    4   37    6 o   24.819   5.7458   10.964   6.2951   21.906   12.222   7.0134   7.3444   30.384   9.0650   19.255   7.0628 11.12829 11.49164 
1 1 1    4   37    7 f   20.675   5.7042   6.9482   6.2876   7.1003   12.839   6.9002   7.2115   22.257   9.0090   19.093   6.9993 3.163816 11.40840 
1 1 1    4   37    8 o   52.369   4.5746   56.673   9.0696   69.344   17.157   51.759   10.685   55.669   7.4723   49.068   5.2795 6.601364 9.149249 
1 1 1    4   37    9 f   21.416   5.8711   8.2838   7.0647  -0.4499   15.101   10.731   7.9934   20.629   9.0963   22.203   7.4254 -1.574741 11.74220 
1 1 1    4   37   10 o   20.974   6.1920   5.0212   7.5059   5.2518   16.843   4.9640   8.3844   23.431   9.9648   18.518   7.3531 4.912268 12.38406 
1 1 1    4   37   11 o   40.861   6.4485   37.720   9.3828   44.090   19.534   35.810   10.698   41.396   11.179   40.327   6.4318 1.068596 12.89705 
1 1 1    4   37   12 o   48.630   6.7317   58.565   10.603   54.118   23.392   59.714   11.895   44.799   12.290   52.461   5.4974 -7.661499 13.46337 
1 1 1    4   37   13 o   36.690   6.9009   37.130   10.078   20.849   23.754   40.704   11.130   30.489   12.284   42.890   6.2917 -12.40135 13.80179 
1 1 1    4   37   14 o   32.382   6.9358   21.758   8.8257   38.406   18.615   16.931   10.024   38.072   11.144   26.691   8.2605 11.38183 13.87156 
1 1 1    4   37   15 o   37.176   8.9558   37.861   15.929   36.160   19.573   41.198   27.411   36.686   11.573   37.666   13.671 -0.9800682 17.91155 
1 1 1    4   37   16 o   51.592   7.5442   68.510   15.749   77.623   21.675   58.318   22.923   56.830   9.2473   46.354   11.923 10.47635 15.08836 
1 1 1    4   37   17 f   52.367   7.6858   70.123   16.387   52.063   22.110   92.130   24.408   43.425   11.963   61.309   9.6527 -17.88393 15.37165 
1 1 1    4   37   18 o   31.204   9.3528   21.859   18.661   19.676   21.340   28.953   38.470   29.021   11.661   33.387   14.626 -4.365696 18.70560 
1 1 1    4   37   19 o   34.212   8.5786   32.927   16.623   48.941   22.659   14.266   24.460   40.827   12.380   27.598   11.879 13.22885 17.15728 
1 1 1    4   37   20 o   54.474   8.0618   83.125   17.795   99.692   24.239   63.759   26.207   63.306   9.2834   45.642   13.183 17.66416 16.12366 
1 1 1    4   37   21 o   26.281   8.1500   10.846   16.848   9.3080   22.666   12.744   25.187   25.527   11.204   27.034   11.839 -1.507252 16.30001 
1 1 1    4   37   22 o   23.925   7.7171  -3.4792   18.723   17.201   23.050 -43.5912   32.101   27.482   11.672   20.368   10.099 7.114418 15.43427 
1 1 1    4   37   23 o   23.945   7.7356   1.3605   16.890  -8.6010   22.189   15.083   26.043   20.873   9.8529   27.017   11.928 -6.144600 15.47113 
1 1 1    4   37   24 o   24.421   7.9379   1.4553   18.613 -13.1800   25.569   17.954   27.148   21.241   10.180   27.600   12.182 -6.359009 15.87586 
1 1 1    4   38    2 o   21.815   9.8838  -4.0684   19.163   0.0000   0.0000  -4.0684   19.163  ?   ?    21.815   9.8838      ?      ? 
1 1 1    4   38    3 o   30.991   6.7426   23.265   8.1642   24.108   8.8826   18.676   20.722   32.440   6.8536   29.542   11.614 2.898087 13.48516 
1 1 1    4   38    4 o   28.297   4.7045   19.002   5.1321   15.167   9.6337   20.522   6.0642   25.627   8.1232   30.966   4.7480 -5.339325 9.409068 
1 1 1    4   38    5 o   48.121   4.3574   49.305   8.6484   0.0000   0.0000   49.305   8.6484  ?   ?    48.121   4.3574      ?      ? 
1 1 1    4   38    6 o   42.649   4.9484   40.829   8.0972   42.475   13.671   39.939   10.050   42.494   8.0957   42.804   5.6925 -0.3100281 9.896757 
1 1 1    4   38    7 o   20.808   5.7442   6.1148   6.2753   12.561   12.783   4.0680   7.2030   24.568   9.2592   17.048   6.8008 7.519474 11.48842 
1 1 1    4   38    8 o   44.504   5.6306   46.630   8.7992   45.221   17.027   47.144   10.278   42.429   9.9093   46.579   5.3500 -4.149036 11.26127 
1 1 1    4   38    9 o   60.086   4.7803   82.350   10.196   77.536   19.905   84.062   11.872   57.577   8.3820   62.595   4.5986 -5.017361 9.560617 
1 1 1    4   38   10 o   64.970   4.7569   95.488   11.088   92.130   21.473   96.709   12.948   62.849   8.2837   67.092   4.6790 -4.243713 9.513824 
1 1 1    4   38   11 o   39.381   6.5126   34.248   9.0892   47.276   19.160   30.465   10.325   42.551   10.876   36.211   7.1669 6.340725 13.02517 
1 1 1    4   38   12 o   61.694   5.6294   94.093   11.468   76.274   22.337  100.470   13.363   55.064   10.212   68.325   4.7419 -13.26164 11.25890 
1 1 1    4   38   13 o   53.205   6.3169   66.366   10.810   71.252   23.757   65.090   12.140   51.799   11.426   54.611   5.3899 -2.811680 12.63389 
1 1 1    4   38   14 o   79.201   5.8283  146.664   18.952  161.357   28.518  135.043   25.362   82.564   8.3746   75.839   8.1082 6.725136 11.65667 
1 1 1    4   38   15 o   32.768   6.7786   29.051   9.5100   20.944   19.351   31.632   10.920   29.095   11.284   36.440   7.5150 -7.344671 13.55719 
1 1 1    4   38   16 o   33.547   8.3076   32.340   14.952   40.530   19.439   20.472   23.398   37.901   11.461   29.193   12.030 8.708160 16.61525 
1 1 1    4   38   17 o   24.757   7.6824   7.0900   15.283   13.119   19.597  -2.2701   24.418   25.986   10.884   23.527   10.845 2.459175 15.36482 
1 1 1    4   38   18 o   21.895   7.5440 -17.7231   17.779 -17.3465   20.085 -19.0868   38.218   18.744   8.9937   25.046   12.115 -6.302431 15.08807 
1 1 1    4   38   19 o   25.849   7.5353  -4.2311   15.304 -34.9515   19.900   40.247   23.944   16.050   7.9568   35.648   12.799 -19.59791 15.07057 
1 1 1    4   38   20 o   32.754   8.4572   27.507   16.433   5.6565   21.689   56.956   25.179   23.802   10.672   41.706   13.123 -17.90452 16.91445 
1 1 1    4   38   21 o   27.092   7.8718   13.990   16.412   34.979   21.544 -15.0332   25.335   33.255   12.112   20.929   10.058 12.32522 15.74360 
1 1 1    4   38   22 o   29.190   8.7585   23.790   19.030   10.355   28.149   35.100   25.827   26.031   11.865   32.349   12.886 -6.317945 17.51695 
1 1 1    4   39    7 o   35.953   8.2044   34.256   12.823   33.974   14.649   35.178   26.523   36.680   9.5790   35.225   13.323 1.455536 16.40884 
1 1 1    4   39    8 o   22.981   9.4271   8.4657   14.288   8.4657   14.288   0.0000   0.0000   22.981   9.4271  ?   ?       ?      ? 
1 1 1    4   39    9 f   27.324   7.9503   15.490   13.980   19.894   15.795  -0.4412   30.038   28.468   10.370   26.179   12.054 2.288361 15.90063 
1 1 1    4   39   10 o   33.938   7.5617   29.381   12.832   14.287   17.591   46.549   18.760   26.205   10.567   41.671   10.820 -15.46633 15.12345 
1 1 1    4   39   11 o   17.117   7.2188   2.5481   8.7184   0.0000   0.0000   2.5481   8.7184  ?   ?    17.117   7.2188      ?      ? 
1 1 1    4   39   12 o   29.633   6.6625   8.5645   8.5189   51.446   20.206  -0.7048   9.3946   43.110   11.246   16.156   7.1466 26.95475 13.32493 
1 1 1    4   39   13 o   26.797   7.0030   8.8967   8.7408   37.263   20.229   2.3851   9.6923   35.922   11.804   17.671   7.5382 18.25154 14.00597 
1 1 1    4   39   14 o   31.426   6.6627   28.764   10.111   8.1104   21.658   34.520   11.434   24.976   10.957   37.876   7.5838 -12.90030 13.32550 
1 1 1    4   39   15 o   28.772   7.5099   16.333   9.6348   36.426   22.409   11.777   10.672   34.645   12.388   22.898   8.4933 11.74700 15.01970 
1 1 1    4   39   16 o   26.602   7.9148   15.505   15.012   20.586   19.233   7.5815   24.015   28.116   11.145   25.089   11.241 3.026964 15.82968 
1 1 1    4   39   17 f   35.126   8.9815   42.662   20.301   3.4327   36.542   60.173   24.415   26.750   12.633   43.501   12.771 -16.75084 17.96306 
1 1 1    4   39   18 o   20.722   7.1022 -14.9885   17.266  -5.1315   19.193 -56.8052   39.532   20.218   9.4208   21.227   10.631 -1.009586 14.20439 
1 1 1    4   39   19 o   26.055   7.8586   14.313   15.708   24.394   20.411  -0.3288   24.598   29.029   11.490   23.080   10.725 5.949768 15.71719 
1 1 1    5    0    1 o  179.901   1.9393  667.956   20.339  667.956   20.339  667.956   20.339  179.901   2.7426  179.901   2.7426 0.000000 0.000000 
1 1 1    5    0    2 o  345.397   2.7363  2461.57   55.110  2461.57   55.110  2461.57   55.110  345.397   3.8697  345.397   3.8697 0.000000 0.000000 
1 1 1    5    0    3 o  279.339   2.3914  1610.06   38.952  1610.06   38.952  1610.06   38.952  279.339   3.3820  279.339   3.3820 0.000000 0.000000 
1 1 1    5    0    4 o  339.304   3.8499  2376.82   76.148  2376.82   76.148  2376.82   76.148  339.304   5.4445  339.304   5.4445 0.000000 0.000000 
1 1 1    5    0    5 o  339.742   3.8410  2383.13   76.072  2383.13   76.072  2383.13   76.072  339.742   5.4320  339.742   5.4320 0.000000 0.000000 
1 1 1    5    0    6 o  247.512   3.2117  1265.11   46.333  1265.11   46.333  1265.11   46.333  247.512   4.5421  247.512   4.5421 0.000000 0.000000 
1 1 1    5    0    7 o  395.049   3.4995  3221.73   80.609  3221.73   80.609  3221.73   80.609  395.049   4.9490  395.049   4.9490 0.000000 0.000000 
1 1 1    5    0    8 o  180.552   2.0778  672.961   21.869  672.961   21.869  672.961   21.869  180.552   2.9385  180.552   2.9385 0.000000 0.000000 
1 1 1    5    0    9 o  249.214   2.3330  1281.89   33.900  1281.89   33.900  1281.89   33.900  249.214   3.2994  249.214   3.2994 0.000000 0.000000 
1 1 1    5    0   10 o  315.747   3.7570  2059.37   69.148  2059.37   69.148  2059.37   69.148  315.747   5.3131  315.747   5.3131 0.000000 0.000000 
1 1 1    5    0   11 f  112.994   2.2514  263.995   14.812  263.995   14.812  263.995   14.812  112.994   3.1840  112.994   3.1840 0.000000 0.000000 
1 1 1    5    0   12 o  140.263   3.0471  407.038   24.876  407.038   24.876  407.038   24.876  140.263   4.3092  140.263   4.3092 0.000000 0.000000 
1 1 1    5    0   13 o  129.631   2.3461  347.288   17.713  347.288   17.713  347.288   17.713  129.631   3.3179  129.631   3.3179 0.000000 0.000000 
1 1 1    5    0   14 o  824.798   5.6773 14044.71  273.072 14044.71  273.072 14044.71  273.072  824.798   8.0289  824.798   8.0289 0.000000 0.000000 
1 1 1    5    0   15 o  144.391   2.5466  430.824   21.418  430.824   21.418  430.824   21.418  144.391   3.6014  144.391   3.6014 0.000000 0.000000 
1 1 1    5    0   16 o  118.905   2.8895  292.665   19.987  292.665   19.987  292.665   19.987  118.905   4.0864  118.905   4.0864 0.000000 0.000000 
1 1 1    5    0   17 o  221.203   3.5298  1010.96   45.491  1010.96   45.491  1010.96   45.491  221.203   4.9919  221.203   4.9919 0.000000 0.000000 
1 1 1    5    0   18 o   28.077   8.6121   23.282   14.573   23.282   14.573   23.282   14.573   28.077   12.179   28.077   12.179 0.000000 0.000000 
1 1 1    5    0   19 o  128.945   2.7667  343.916   20.766  343.916   20.766  343.916   20.766  128.945   3.9127  128.945   3.9127 0.000000 0.000000 
1 1 1    5    0   20 o  270.085   2.6933  1505.65   42.410  1505.65   42.410  1505.65   42.410  270.085   3.8089  270.085   3.8089 0.000000 0.000000 
1 1 1    5    0   21 o   83.595   6.1309  148.959   29.158  148.959   29.158  148.959   29.158   83.595   8.6705   83.595   8.6705 0.000000 0.000000 
1 1 1    5    0   22 o  411.469   3.2979  3494.97   79.127  3494.97   79.127  3494.97   79.127  411.469   4.6639  411.469   4.6639 0.000000 0.000000 
1 1 1    5    0   23 o  146.207   2.9489  442.150   25.102  442.150   25.102  442.150   25.102  146.207   4.1703  146.207   4.1703 0.000000 0.000000 
1 1 1    5    0   24 o  213.262   2.7934  939.421   34.721  939.421   34.721  939.421   34.721  213.262   3.9505  213.262   3.9505 0.000000 0.000000 
1 1 1    5    0   25 f  215.932   2.7853  963.150   35.055  963.150   35.055  963.150   35.055  215.932   3.9390  215.932   3.9390 0.000000 0.000000 
1 1 1    5    0   26 o  217.834   2.8345  980.412   35.987  980.412   35.987  980.412   35.987  217.834   4.0086  217.834   4.0086 0.000000 0.000000 
1 1 1    5    0   27 o  106.357   4.2302  235.930   26.053  235.930   26.053  235.930   26.053  106.357   5.9824  106.357   5.9824 0.000000 0.000000 
1 1 1    5    0   28 o  163.387   3.0529  552.310   29.049  552.310   29.049  552.310   29.049  163.387   4.3175  163.387   4.3175 0.000000 0.000000 
1 1 1    5    0   29 o  162.071   3.0599  543.512   28.880  543.512   28.880  543.512   28.880  162.071   4.3274  162.071   4.3274 0.000000 0.000000 
1 1 1    5    0   30 f  151.680   4.8835  479.074   43.001  479.074   43.001  479.074   43.001  151.680   6.9063  151.680   6.9063 0.000000 0.000000 
1 1 1    5    0   31 o  350.938   3.5908  2546.52   73.468  2546.52   73.468  2546.52   73.468  350.938   5.0782  350.938   5.0782 0.000000 0.000000 
1 1 1    5    0   32 o  143.341   3.4076  425.962   28.417  425.962   28.417  425.962   28.417  143.341   4.8190  143.341   4.8190 0.000000 0.000000 
1 1 1    5    0   33 f  149.162   3.5151  461.388   30.506  461.388   30.506  461.388   30.506  149.162   4.9711  149.162   4.9711 0.000000 0.000000 
1 1 1    5    0   34 o   21.504   9.3702   7.7395   22.947   7.7395   22.947   7.7395   22.947   21.504   13.252   21.504   13.252 0.000000 0.000000 
1 1 1    5    0   35 o   19.198   9.1183 -10.7964   28.889 -10.7964   28.889 -10.7964   28.889   19.198   12.895   19.198   12.895 0.000000 0.000000 
1 1 1    5    0   36 o   18.534   8.7051  -6.2157   25.068  -6.2157   25.068  -6.2157   25.068   18.534   12.311   18.534   12.311 0.000000 0.000000 
1 1 1    5    0   37 o  127.834   5.4386  344.240   40.216  344.240   40.216  344.240   40.216  127.834   7.6913  127.834   7.6913 0.000000 0.000000 
1 1 1    5    0   38 o  118.956   12.116  326.824   78.998  326.824   78.998  326.824   78.998  118.956   17.134  118.956   17.134 0.000000 0.000000 
1 1 1    5    0   39 f   79.283   7.2207  139.483   31.870  139.483   31.870  139.483   31.870   79.283   10.212   79.283   10.212 0.000000 0.000000 
1 1 1    5    0   40 o   17.526   8.3902 -10.6192   25.398 -10.6192   25.398 -10.6192   25.398   17.526   11.866   17.526   11.866 0.000000 0.000000 
1 1 1    5    0   41 o   53.272   9.4971   71.763   25.521   71.763   25.521   71.763   25.521   53.272   13.431   53.272   13.431 0.000000 0.000000 
1 1 1    5    0   42 o   19.114   8.8442  -0.4691   24.413  -0.4691   24.413  -0.4691   24.413   19.114   12.508   19.114   12.508 0.000000 0.000000 
1 1 1    5    0   43 o   24.733   10.293   18.001   25.238   18.001   25.238   18.001   25.238   24.733   14.557   24.733   14.557 0.000000 0.000000 
1 1 1    5    0   44 o   27.328   10.577   25.172   24.118   25.172   24.118   25.172   24.118   27.328   14.958   27.328   14.958 0.000000 0.000000 
1 1 1    5    0   45 o   30.917   13.162   32.753   43.052   32.753   43.052   32.753   43.052   30.917   18.614   30.917   18.614 0.000000 0.000000 
1 1 1    5    0   46 o   16.274   7.8696 -10.3662   23.552 -10.3662   23.552 -10.3662   23.552   16.274   11.129   16.274   11.129 0.000000 0.000000 
1 1 1    5    0   47 o   29.320   10.472   30.894   22.208   30.894   22.208   30.894   22.208   29.320   14.809   29.320   14.809 0.000000 0.000000 
1 1 1    5    0   48 o   34.010   10.782   40.514   22.815   40.514   22.815   40.514   22.815   34.010   15.248   34.010   15.248 0.000000 0.000000 
1 1 1    5    0   49 o   27.991   11.034   31.010   26.798   31.010   26.798   31.010   26.798   27.991   15.605   27.991   15.605 0.000000 0.000000 
1 1 1    5    0   50 f   29.056   11.330   35.309   27.914   35.309   27.914   35.309   27.914   29.056   16.024   29.056   16.024 0.000000 0.000000 
1 1 1    5    1    0 o  176.210   1.9249  640.834   19.774  640.834   19.774  640.834   19.774  176.210   2.7222  176.210   2.7222 0.000000 0.000000 
1 1 1    5    1    1 o  163.267   1.8797  549.791   12.657  552.221   17.959  547.393   17.842  163.626   2.6612  162.909   2.6554 0.7169189 3.759347 
1 1 1    5    1    2 o  254.750   2.2685  1338.56   23.834  1346.79   33.916  1330.53   33.500  255.523   3.2182  253.976   3.1980 1.546875 4.536989 
1 1 1    5    1    3 o  152.486   1.8536  479.548   11.657  475.599   16.410  483.572   16.563  151.852   2.6201  153.119   2.6227 -1.267471 3.707197 
1 1 1    5    1    4 o   75.349   2.5393  117.347   7.8647  105.926   11.098  128.871   11.147   71.657   3.7550   79.040   3.4194 -7.383133 5.078630 
1 1 1    5    1    5 o  195.391   2.4823  786.481   18.843  790.898   32.741  784.294   23.041  195.789   4.0545  194.993   2.8649 0.7958374 4.964536 
1 1 1    5    1    6 o  312.181   2.7844  2005.86   35.330  2040.34   55.061  1981.73   46.062  314.441   4.2456  309.921   3.6035 4.520569 5.568704 
1 1 1    5    1    7 o  106.705   2.0134  236.661   8.7829  252.027   11.913  218.364   13.000  110.531   2.6132  102.879   3.0637 7.652557 4.026780 
1 1 1    5    1    8 o  171.328   2.2073  606.739   15.453  613.838   20.569  597.541   23.414  172.487   2.8913  170.168   3.3360 2.318405 4.414577 
1 1 1    5    1    9 o  113.100   2.0801  263.914   9.7024  262.844   13.629  265.013   13.816  112.868   2.9277  113.332   2.9557 -0.4643250 4.160190 
1 1 1    5    1   10 o  441.630   4.7143  4030.04   85.819  4095.96  123.912  3969.27  118.971  445.085   6.7500  438.175   6.5831 6.909546 9.428652 
1 1 1    5    1   11 o  473.368   3.5194  4626.80   68.708  4606.38   96.548  4647.75   97.799  472.312   4.9562  474.423   4.9981 -2.110931 7.038781 
1 1 1    5    1   12 o  428.752   3.2761  3794.58   57.932  3781.45   81.576  3807.94   82.284  428.005   4.6211  429.500   4.6450 -1.494263 6.552191 
1 1 1    5    1   13 o  424.009   3.2638  3710.36   57.078  3707.86   80.639  3712.86   80.800  423.867   4.6127  424.152   4.6188 -0.2850952 6.527621 
1 1 1    5    1   14 o  516.066   3.7928  5496.17   80.729  5505.39  114.451  5487.05  113.888  516.496   5.3726  515.636   5.3551 0.8595581 7.585644 
1 1 1    5    1   15 o  349.634   2.9219  2521.89   42.131  2506.04   59.056  2538.31   60.121  348.517   4.1084  350.752   4.1559 -2.234558 5.843835 
1 1 1    5    1   16 o  253.149   2.7827  1319.87   28.749  1337.55   44.099  1306.80   37.913  254.613   4.1993  251.685   3.6523 2.928070 5.565398 
1 1 1    5    1   17 o   95.393   3.9156  184.723   15.244  167.527   19.877  209.279   23.753   90.094   5.3492  100.691   5.7195 -10.59720 7.831172 
1 1 1    5    1   18 o  191.958   2.6781  758.428   21.001  773.030   32.124  747.530   27.754  193.562   4.0239  190.354   3.5350 3.208221 5.356122 
1 1 1    5    1   19 o  416.780   3.2941  3584.61   56.622  3604.19   80.555  3565.50   79.605  417.904   4.6736  415.656   4.6434 2.247284 6.588167 
1 1 1    5    1   20 o  306.924   3.0318  1943.78   37.976  1941.63   50.188  1946.67   58.085  306.742   3.9670  307.107   4.5857 -0.3644409 6.063502 
1 1 1    5    1   21 o  166.134   3.1179  570.384   21.335  585.694   29.659  553.968   30.712  168.452   4.2689  163.816   4.5455 4.635468 6.235802 
1 1 1    5    1   22 o  334.195   2.9417  2304.80   40.538  2335.56   58.105  2275.62   56.585  336.365   4.1883  332.026   4.1320 4.339569 5.883485 
1 1 1    5    1   23 o  237.958   2.7445  1168.09   26.919  1189.27   38.872  1148.56   37.315  240.027   3.9265  235.889   3.8354 4.138443 5.488923 
1 1 1    5    1   24 o  271.166   2.8077  1517.78   31.395  1499.75   43.884  1536.69   44.934  269.519   3.9477  272.813   3.9934 -3.294556 5.615335 
1 1 1    5    1   25 f  267.429   2.8127  1476.81   31.021  1484.84   44.167  1469.00   43.581  268.144   3.9936  266.713   3.9617 1.431274 5.625311 
1 1 1    5    1   26 o   72.666   5.3911  110.725   15.988  123.068   21.987   96.876   23.290   77.049   6.9188   68.284   8.2695 8.765305 10.78218 
1 1 1    5    1   27 o  109.512   4.1647  247.255   18.754  276.089   27.417  221.899   25.710  115.497   5.7554  103.526   6.0213 11.97086 8.329484 
1 1 1    5    1   28 o  101.951   3.8982  215.514   16.362  202.639   23.292  228.056   22.990   98.926   5.7086  104.975   5.3098 -6.049622 7.796328 
1 1 1    5    1   29 o  103.349   3.9062  221.252   16.608  242.244   23.711  201.035   23.269  108.179   5.3142   98.519   5.7266 9.659744 7.812449 
1 1 1    5    1   30 o   32.561   9.6940   4.1581   21.913  -1.7025   34.895   7.9740   28.158   32.902   14.175   32.220   13.227 0.6826324 19.38799 
1 1 1    5    1   31 o   67.931   5.7294   97.467   15.747   76.373   22.380  118.148   22.159   60.473   8.9730   75.390   7.1265 -14.91687 11.45871 
1 1 1    5    1   32 o   60.843   6.8987   80.952   15.948  121.091   23.216   45.091   21.944   76.285   7.3788   45.401   11.658 30.88441 13.79734 
1 1 1    5    1   33 o  152.034   3.8797  481.197   23.769  488.542   30.650  470.116   37.648  153.588   4.8385  150.480   6.0660 3.107300 7.759312 
1 1 1    5    1   34 o   79.039   5.5269  130.551   17.973  119.332   25.278  142.021   25.560   75.565   8.1106   82.514   7.5104 -6.948875 11.05389 
1 1 1    5    1   35 o   81.569   7.4849  135.778   24.654  168.257   40.184  116.171   31.221   89.026   10.944   74.111   10.214 14.91542 14.96978 
1 1 1    5    1   36 o   44.650   8.8396   41.064   18.196   18.607   24.491   68.733   27.185   33.761   12.794   55.539   12.201 -21.77841 17.67917 
1 1 1    5    1   37 o   41.852   9.1464   37.455   17.891   24.650   24.656   51.695   26.001   35.917   12.976   47.788   12.894 -11.87141 18.29284 
1 1 1    5    1   38 o   61.689   10.199   70.271   23.737  144.655   47.459   45.455   27.412   78.686   15.173   44.692   13.631 33.99429 20.39717 
1 1 1    5    1   39 o   63.285   7.2601   88.665   18.476   97.455   26.355   80.170   25.908   67.010   9.5358   59.559   10.950 7.451118 14.52025 
1 1 1    5    1   40 o   41.900   9.9299   36.980   19.712   53.491   32.971   27.797   24.591   47.370   15.029   36.431   12.982 10.93921 19.85978 
1 1 1    5    1   41 o   42.800   9.3220   43.764   18.019   40.356   24.307   47.922   26.847   41.175   12.883   44.426   13.477 -3.250576 18.64392 
1 1 1    5    1   42 o   33.190   9.2830   17.210   20.097   32.019   26.015  -4.7055   31.648   37.619   13.358   28.761   12.894 8.857918 18.56606 
1 1 1    5    1   43 o   47.485   9.6118   57.421   20.126   46.207   29.964   66.638   27.166   42.973   14.376   51.997   12.762 -9.023872 19.22367 
1 1 1    5    1   44 o   42.708   9.0678   45.595   17.257   44.479   24.604   46.675   24.210   42.185   12.923   43.232   12.724 -1.047577 18.13564 
1 1 1    5    1   45 o   23.803   8.3174 -60.6306   21.680  -2.0484   43.282 -80.2515   25.048   32.142   14.675   15.465   7.8330 16.67730 16.63475 
1 1 1    5    1   46 o   52.510   8.1507   70.346   17.823   46.777   25.265   93.694   25.147   41.776   13.145   63.244   9.6405 -21.46766 16.30132 
1 1 1    5    1   47 o   52.975   7.8516   71.019   16.625   81.706   23.881   60.971   23.158   57.524   10.451   48.427   11.721 9.096653 15.70319 
1 1 1    5    1   48 o   33.383   8.2244   27.113   15.474   7.6115   22.068   45.973   21.703   25.830   11.200   40.936   12.047 -15.10596 16.44882 
1 1 1    5    1   49 o   30.738   8.8940   18.542   18.956  -0.2540   25.887   40.270   27.834   24.902   11.362   36.575   13.687 -11.67282 17.78807 
1 1 1    5    1   50 f   27.528   8.6812   11.187   20.067   6.7874   28.600   15.454   28.163   26.614   12.065   28.441   12.486 -1.826830 17.36237 
1 1 1    5    2    0 o  730.739   5.0435 11021.30  214.923 11021.30  214.923 11021.30  214.923  730.739   7.1326  730.739   7.1326 0.000000 0.000000 
1 1 1    5    2    1 o   75.286   1.7099  116.905   5.3092  115.927   7.5148  117.879   7.5019   74.972   2.4303   75.600   2.4059 -0.6286545 3.419775 
1 1 1    5    2    2 o  787.779   5.4038 12812.15  175.535 12714.19  245.142 12915.23  251.467  784.699   7.5744  790.860   7.7093 -6.161682 10.80766 
1 1 1    5    2    3 o  563.867   4.3509  6543.62   99.488  6461.60  129.002  6664.00  156.285  559.562   5.5896  568.172   6.6691 -8.610535 8.701817 
1 1 1    5    2    4 o  122.752   3.6099  310.842   18.276  310.842   18.276   0.0000   0.0000  122.752   3.6099  ?   ?       ?      ? 
1 1 1    5    2    5 o  341.832   4.3412  2402.96   48.499  2428.42  110.085  2396.83   54.024  342.825   7.7855  340.838   3.8430 1.987366 8.682343 
1 1 1    5    2    6 o  107.057   2.1451  234.422   8.6623  241.429   15.988  231.510   10.306  108.172   3.5836  105.942   2.3586 2.229668 4.290152 
1 1 1    5    2    7 o  226.644   2.3869  1060.18   22.108  1061.84   29.360  1057.99   33.598  226.858   3.1378  226.429   3.5976 0.4290924 4.773768 
1 1 1    5    2    8 o   59.236   2.5733   73.940   6.0508   78.732   7.7311   66.364   9.7212   61.772   3.0345   56.700   4.1569 5.072418 5.146636 
1 1 1    5    2    9 o  289.024   2.9034  1721.83   34.564  1771.84   50.447  1677.58   47.453  292.969   4.1749  285.079   4.0358 7.889832 5.806728 
1 1 1    5    2   10 o  160.854   2.2693  532.805   14.894  541.196   22.878  526.633   19.621  161.944   3.4253  159.763   2.9777 2.180847 4.538646 
1 1 1    5    2   11 o  325.264   3.1377  2183.43   42.081  2161.74   58.701  2206.36   60.356  323.606   4.3981  326.922   4.4762 -3.316681 6.275311 
1 1 1    5    2   12 o  432.160   3.2952  3854.18   58.718  3894.32   84.199  3816.17   81.927  434.347   4.7001  429.973   4.6197 4.373596 6.590368 
1 1 1    5    2   13 o  141.963   2.3316  415.770   13.650  416.047   19.132  415.482   19.480  142.012   3.2664  141.915   3.3282 0.9738159E-01 4.663296 
1 1 1    5    2   14 o  651.657   4.6030  8761.49  123.623  8893.43  178.846  8640.77  171.072  656.342   6.6067  646.972   6.4110 9.370056 9.205962 
1 1 1    5    2   15 o  264.012   2.5708  1437.44   27.986  1417.58   39.016  1458.48   40.164  262.135   3.6087  265.889   3.6624 -3.753448 5.141623 
1 1 1    5    2   16 o   98.332   3.5183  199.440   14.265  195.432   19.895  203.681   20.465   97.316   4.9567   99.348   4.9944 -2.032051 7.036536 
1 1 1    5    2   17 o   52.368   5.2458   56.866   11.212   58.282   14.926   55.033   16.985   53.125   6.8120   51.610   7.9793 1.515038 10.49154 
1 1 1    5    2   18 f   81.098   3.8572  137.315   12.751  121.203   18.767  151.132   17.379   76.621   5.9386   85.575   4.9240 -8.953438 7.714431 
1 1 1    5    2   19 o  139.512   2.7224  401.561   15.663  400.057   21.942  403.124   22.364  139.246   3.8206  139.778   3.8793 -0.5314941 5.444780 
1 1 1    5    2   20 o  217.020   2.9881  971.866   26.733  976.073   38.464  967.934   37.181  217.472   4.2883  216.568   4.1625 0.9036713 5.976289 
1 1 1    5    2   21 o  316.356   3.0802  2067.52   39.870  2052.24   60.194  2079.46   53.218  315.296   4.6288  317.417   4.0650 -2.121765 6.160343 
1 1 1    5    2   22 o  370.382   3.1017  2831.87   47.377  2853.05   67.544  2811.36   66.472  371.743   4.4053  369.020   4.3674 2.722382 6.203312 
1 1 1    5    2   23 o  508.778   3.8321  5347.32   80.398  5389.41  115.041  5307.14  112.405  510.727   5.4613  506.829   5.3772 3.898163 7.664242 
1 1 1    5    2   24 o   50.347   7.1742   54.616   14.379   50.987   20.419   58.187   20.253   48.600   10.494   52.095   9.7852 -3.495136 14.34840 
1 1 1    5    2   25 o  169.923   2.9192  596.328   20.459  600.996   29.022  591.717   28.844  170.584   4.1250  169.262   4.1318 1.322372 5.838439 
1 1 1    5    2   26 o  164.852   3.3427  562.026   22.719  574.614   31.949  549.149   32.313  166.727   4.6460  162.977   4.8071 3.749908 6.685325 
1 1 1    5    2   27 o   90.757   4.7375  171.305   17.664  161.626   25.671  180.009   24.342   88.290   7.0495   93.224   6.3310 -4.934486 9.475065 
1 1 1    5    2   28 o  295.239   3.2075  1804.00   38.579  1790.94   59.273  1813.59   50.816  294.250   4.8840  296.228   4.1592 -1.978180 6.415010 
1 1 1    5    2   29 o   38.091   10.048   24.041   20.990   27.683   26.790   18.252   33.778   38.476   13.567   37.707   14.826 0.7694016 20.09688 
1 1 1    5    2   30 o   99.683   4.6427  200.809   18.659  182.336   23.594  231.651   30.487   93.768   6.1008  105.598   7.0000 -11.82937 9.285460 
1 1 1    5    2   31 o   48.355   8.2017   48.423   19.470   4.1993   27.876   90.545   27.205   30.971   12.977   65.739   10.034 -34.76764 16.40339 
1 1 1    5    2   32 o  100.348   4.2469  209.017   17.556  196.410   24.751  221.780   24.904   97.285   6.1685  103.411   5.8390 -6.126205 8.493814 
1 1 1    5    2   33 o   69.147   6.2791   99.798   17.886   95.211   24.579  104.962   26.077   67.467   8.8332   70.827   8.9267 -3.360214 12.55828 
1 1 1    5    2   34 o  154.374   4.0436  498.891   25.066  475.929   39.821  513.960   32.259  151.279   6.3822  157.467   4.9671 -6.187897 8.087294 
1 1 1    5    2   35 o  162.555   3.6340  542.852   24.207  598.395   36.881  500.811   32.086  169.758   5.2675  155.352   5.0076 14.40602 7.267920 
1 1 1    5    2   36 o  115.422   4.6683  278.252   22.209  291.748   31.588  265.061   31.230  118.216   6.4786  112.628   6.7231 5.588982 9.336574 
1 1 1    5    2   37 o  135.819   4.3191  387.156   23.885  395.045   31.561  376.582   36.541  137.605   5.5610  134.032   6.6100 3.572937 8.638109 
1 1 1    5    2   38 o   63.086   7.5433   91.689   18.162   49.686   25.550  134.590   25.821   46.531   12.877   79.641   7.8610 -33.10954 15.08656 
1 1 1    5    2   39 o   59.909   8.6571   77.736   20.092   62.522   24.943  105.851   33.907   52.059   11.879   67.760   12.596 -15.70062 17.31410 
1 1 1    5    2   40 o   58.653   7.5750   79.754   17.420   42.828   24.276  118.954   25.012   42.890   12.771   74.415   8.1494 -31.52570 15.15004 
1 1 1    5    2   41 o   35.103   8.3466   20.904   16.908   50.001   24.185  -6.9173   23.648   45.612   12.489   24.595   11.076 21.01731 16.69329 
1 1 1    5    2   42 o   37.703   9.4910   31.741   18.838   39.504   26.503   23.815   26.780   40.686   13.518   34.721   13.326 5.964767 18.98192 
1 1 1    5    2   43 o   37.304   8.9183   28.180   19.087  -2.5710   27.730   55.866   26.312   27.260   12.156   47.349   13.053 -20.08939 17.83657 
1 1 1    5    2   44 o   47.151   8.9683   49.113   19.374   94.291   31.161   20.645   24.736   61.800   12.651   32.503   12.715 29.29693 17.93661 
1 1 1    5    2   45 o   66.935   8.2794  113.051   20.910  126.079   26.515   91.623   34.005   74.909   8.5821   58.960   14.161 15.94888 16.55889 
1 1 1    5    2   46 o   30.811   8.8138   18.572   17.410   15.419   24.583   21.745   24.660   29.771   12.305   31.850   12.622 -2.079193 17.62763 
1 1 1    5    2   47 o   27.797   8.2964   11.529   16.403   6.6949   24.344   15.548   22.199   26.817   11.694   28.776   11.771 -1.959101 16.59286 
1 1 1    5    2   48 o   40.827   8.3334   42.227   17.615   78.949   25.796   10.142   24.112   54.465   11.822   27.189   11.748 27.27631 16.66684 
1 1 1    5    2   49 o   30.056   9.0585   19.388   19.769   20.860   27.943   17.912   27.972   30.445   12.886   29.666   12.734 0.7785358 18.11691 
1 1 1    5    2   50 o   31.235   9.9978   20.470   28.253   3.2873   41.137   35.810   38.869   28.607   13.477   33.862   14.771 -5.255537 19.99557 
1 1 1    5    2   51 o   43.782   15.757   78.006   36.312   0.0000   0.0000   78.006   36.312  ?   ?    43.782   15.757      ?      ? 
1 1 1    5    3    0 o  502.829   3.6405  5217.25  106.747  5217.25  106.747  5217.25  106.747  502.829   5.1484  502.829   5.1484 0.000000 0.000000 
1 1 1    5    3    1 o  432.248   3.2243  3854.69   57.480  3839.00   80.847  3870.72   81.737  431.359   4.5442  433.137   4.5754 -1.777527 6.448598 
1 1 1    5    3    2 o  102.462   1.8735  215.878   7.8295  220.889   12.064  212.232   10.291  103.485   2.8266  101.439   2.4597 2.045868 3.746966 
1 1 1    5    3    3 o  381.124   3.6087  2986.65   53.118  2966.68   64.527  3028.64   93.558  379.201   4.1258  383.047   5.9219 -3.846680 7.217432 
1 1 1    5    3    4 o  458.169   4.1164  4348.17   73.966  4381.23   91.588  4286.17  125.420  460.758   4.8195  455.580   6.6747 5.177734 8.232846 
1 1 1    5    3    5 o  291.672   3.5250  1698.35   41.168  1993.31   68.801  1533.84   51.382  310.729   5.3685  272.616   4.5697 38.11359 7.050017 
1 1 1    5    3    6 o  212.376   2.7139  925.458   23.106  953.130   37.625  908.703   29.277  214.894   4.2451  209.858   3.3824 5.035461 5.427851 
1 1 1    5    3    7 o  171.072   2.8231  603.728   19.913  617.847   28.594  590.433   27.747  173.013   4.0072  169.132   3.9777 3.880814 5.646175 
1 1 1    5    3    8 o  289.233   3.5204  1727.55   41.994  1716.19   58.989  1739.22   59.795  288.271   4.9614  290.196   4.9959 -1.924713 7.040862 
1 1 1    5    3    9 o  185.092   3.0052  693.698   22.669  796.223   35.566  623.545   29.420  196.383   4.3910  173.801   4.1041 22.58252 6.010366 
1 1 1    5    3   10 o  210.666   2.2241  915.492   19.322  928.170   27.622  903.344   27.037  212.093   3.1576  209.239   3.1330 2.854721 4.448133 
1 1 1    5    3   11 o  100.931   2.7447  210.117   11.418  207.055   15.821  213.447   16.496  100.165   3.8295  101.697   3.9329 -1.532333 5.489357 
1 1 1    5    3   12 o  625.004   4.4299  8067.12  114.168  8004.66  159.528  8132.69  163.459  622.533   6.2131  627.475   6.3161 -4.942200 8.859779 
1 1 1    5    3   13 o  344.123   2.8541  2443.16   40.507  2454.59   57.615  2431.98   56.961  344.918   4.0500  343.327   4.0226 1.591064 5.708160 
1 1 1    5    3   14 o  285.456   2.6127  1680.15   30.750  1710.67   44.206  1651.54   42.801  287.966   3.7220  282.946   3.6676 5.019897 5.225374 
1 1 1    5    3   15 o  442.039   3.3929  4032.14   61.857  4046.33   87.798  4018.16   87.164  442.810   4.8073  441.267   4.7893 1.543243 6.785800 
1 1 1    5    3   16 o  158.471   2.8885  518.424   18.864  541.558   26.652  495.201   26.704  162.018   3.9885  154.925   4.1792 7.092606 5.776978 
1 1 1    5    3   17 o  279.097   2.6426  1606.71   30.412  1592.28   42.481  1621.89   43.557  277.812   3.7075  280.382   3.7665 -2.569763 5.285112 
1 1 1    5    3   18 o  367.293   3.5090  2784.09   53.156  2798.04   75.527  2770.39   74.825  368.205   4.9733  366.382   4.9516 1.822418 7.018011 
1 1 1    5    3   19 f  454.250   3.4915  4258.04   65.397  4220.13   91.264  4298.04   93.758  452.177   4.8936  456.324   4.9816 -4.147858 6.983064 
1 1 1    5    3   20 o  184.729   2.9998  704.270   22.849  705.073   32.724  703.506   31.918  184.830   4.2927  184.628   4.1916 0.2020264 5.999685 
1 1 1    5    3   21 o  270.250   2.6958  1506.81   30.044  1484.46   42.015  1530.21   42.978  268.200   3.7982  272.300   3.8268 -4.100037 5.391696 
1 1 1    5    3   22 o  150.488   3.2019  468.471   19.552  472.590   25.523  462.621   30.419  151.307   4.0898  149.669   4.9277 1.637955 6.403832 
1 1 1    5    3   23 o  231.774   2.7451  1108.75   26.240  1127.28   37.349  1090.69   36.872  233.687   3.8751  229.862   3.8893 3.824829 5.490231 
1 1 1    5    3   24 o  225.380   2.7647  1047.75   25.687  1089.18   36.988  1009.15   35.700  229.680   3.9046  221.080   3.9152 8.599350 5.529472 
1 1 1    5    3   25 o  142.322   3.5024  422.145   20.070  435.746   25.958  401.930   31.645  145.234   4.3335  139.410   5.5036 5.824158 7.004852 
1 1 1    5    3   26 o  166.512   3.9770  580.938   26.023  598.546   32.499  549.481   43.439  170.165   4.6306  162.859   6.4670 7.305450 7.953930 
1 1 1    5    3   27 o  160.449   3.7960  524.677   24.274  562.754   40.464  503.269   30.340  164.871   5.9505  156.027   4.7147 8.844086 7.591907 
1 1 1    5    3   28 o  186.569   3.6894  726.768   27.740  688.471   43.551  752.912   35.983  182.320   5.7916  190.818   4.5721 -8.496979 7.378747 
1 1 1    5    3   29 o   91.205   5.3840  173.262   20.201  160.218   28.716  186.040   28.422   87.769   7.9328   94.641   7.2815 -6.871758 10.76795 
1 1 1    5    3   30 o   83.286   4.7162  143.952   16.197  141.253   22.626  146.791   23.197   82.487   6.6504   84.085   6.6888 -1.598297 9.432312 
1 1 1    5    3   31 o   74.340   6.3127  114.783   19.297  107.241   26.081  123.906   28.684   71.668   8.8234   77.013   9.0305 -5.345032 12.62547 
1 1 1    5    3   32 o  138.537   3.4388  397.349   19.647  404.580   27.871  390.207   27.700  139.793   4.8339  137.281   4.8923 2.512039 6.877566 
1 1 1    5    3   33 o  116.680   3.9667  282.479   19.075  285.116   26.542  279.663   27.432  117.257   5.4882  116.102   5.7287 1.155495 7.933413 
1 1 1    5    3   34 o   76.251   6.1649  121.940   19.364  128.756   27.359  115.099   27.410   78.424   8.4582   74.079   8.9711 4.344757 12.32973 
1 1 1    5    3   35 o   39.715   8.9255   33.002   16.929   21.655   24.341   43.632   23.561   34.971   12.853   44.460   12.387 -9.489540 17.85090 
1 1 1    5    3   36 f  101.524   5.1526  217.445   21.413  194.376   31.007  238.478   29.607   96.222   7.8130  106.827   6.7198 -10.60474 10.30527 
1 1 1    5    3   37 o   58.194   9.4761   77.145   22.104   78.781   33.804   75.923   29.216   58.475   14.166   57.914   12.590 0.5614662 18.95215 
1 1 1    5    3   38 o   33.980   8.9736   19.812   17.342   9.6865   24.474   30.024   24.579   30.205   12.358   37.755   13.015 -7.549555 17.94730 
1 1 1    5    3   39 o   78.917   7.1170  134.602   23.015  116.102   30.917  157.594   34.467   72.797   10.297   85.037   9.8272 -12.23922 14.23399 
1 1 1    5    3   40 f   57.622   7.7095   75.072   17.882   65.442   25.298   84.687   25.279   53.086   11.854   62.159   9.8604 -9.073593 15.41891 
1 1 1    5    3   41 o   52.981   8.0725   65.735   17.632   44.912   24.661   87.510   25.219   43.204   12.874   62.759   9.7427 -19.55547 16.14497 
1 1 1    5    3   42 o   43.891   9.2291   46.360   18.984   64.821   26.633   27.293   27.066   51.761   12.595   36.022   13.493 15.73926 18.45815 
1 1 1    5    3   43 o   29.796   8.3026   2.6331   17.592 -27.1005   24.131   36.358   25.700   20.734   9.9248   38.858   13.313 -18.12403 16.60512 
1 1 1    5    3   44 f   34.786   8.8515   15.740   20.818 -32.6982   31.126   54.945   28.003   23.356   11.204   46.216   13.707 -22.85988 17.70299 
1 1 1    5    3   45 o   34.512   8.3383   18.305   17.710   55.518   25.598 -15.8637   24.528   46.438   12.902   22.587   10.566 23.85130 16.67667 
1 1 1    5    3   46 o   38.635   9.5338   40.119   19.964   53.054   25.844   20.978   31.438   44.344   13.171   32.926   13.787 11.41766 19.06752 
1 1 1    5    3   47 o   53.009   8.8144   75.632   18.661   71.892   30.015   77.989   23.826   50.218   13.978   55.800   10.742 -5.582451 17.62889 
1 1 1    5    3   48 f   34.980   9.1342   33.583   17.443   35.444   24.387   31.633   24.959   35.722   12.905   34.239   12.930 1.483177 18.26835 
1 1 1    5    3   49 o   31.155   8.9424   22.488   19.609   38.806   25.520  -1.0357   30.641   36.153   13.180   26.157   12.090 9.996229 17.88485 
1 1 1    5    3   50 o   27.638   9.2633  -2.0901   28.296 -10.2878   43.411   3.9656   37.311   27.312   13.135   27.963   13.065 -0.6516514 18.52666 
1 1 1    5    3   51 o   35.180   10.708   45.970   27.812   76.024   44.009   25.987   35.886   40.007   16.494   30.354   13.659 9.652578 21.41528 
1 1 1    5    4    0 o  709.021   4.9074 10376.95  202.908 10376.95  202.908 10376.95  202.908  709.021   6.9402  709.021   6.9402 0.000000 0.000000 
1 1 1    5    4    1 o  357.990   2.8037  2643.90   41.394  2630.52   58.163  2657.64   58.925  357.073   3.9493  358.907   3.9806 -1.834442 5.607366 
1 1 1    5    4    2 o  489.451   3.8436  4945.90   76.847  4952.96  101.904  4936.58  117.012  489.887   5.0435  489.015   5.8015 0.8721924 7.687276 
1 1 1    5    4    3 o   46.019   2.3305   43.724   4.2171   43.805   5.2294   43.573   7.1313   46.083   2.7513   45.955   3.7624 0.1274681 4.661068 
1 1 1    5    4    4 o  356.211   3.0249  2619.03   44.003  2621.93   58.297  2615.19   67.083  356.458   3.9652  355.964   4.5692 0.4945068 6.049846 
1 1 1    5    4    5 o  164.731   2.4838  547.641   16.216  603.448   27.549  518.052   20.059  171.000   3.9060  158.461   3.0692 12.53902 4.967636 
1 1 1    5    4    6 o  164.274   3.0359  553.329   15.136  562.619   37.819  551.558   16.517  165.034   5.5561  163.515   2.4490 1.519608 6.071862 
1 1 1    5    4    7 o  398.906   3.5440  3283.83   58.260  3345.19   84.416  3228.02   80.508  402.453   5.0856  395.359   4.9372 7.093964 7.087989 
1 1 1    5    4    8 o  231.438   3.1977  1081.97   30.039  1239.19   47.929  980.270   38.549  244.970   4.7437  217.906   4.2892 27.06424 6.395312 
1 1 1    5    4    9 o  320.708   3.4230  2132.45   44.807  2187.90   59.678  2060.81   67.836  325.539   4.4447  315.876   5.2069 9.662567 6.845962 
1 1 1    5    4   10 o  270.526   2.4570  1509.96   27.411  1523.32   39.144  1497.10   38.398  271.699   3.4931  269.353   3.4564 2.346741 4.914060 
1 1 1    5    4   11 o  371.446   3.4198  2848.34   52.392  2852.00   74.120  2844.68   74.067  371.685   4.8350  371.207   4.8378 0.4772644 6.839658 
1 1 1    5    4   12 o  152.991   2.4813  481.898   15.448  476.828   20.209  489.026   23.961  152.031   3.2228  153.952   3.7736 -1.921432 4.962560 
1 1 1    5    4   13 o  147.902   2.3418  450.884   14.279  469.784   20.501  433.076   19.899  150.911   3.2937  144.894   3.3298 6.016266 4.683624 
1 1 1    5    4   14 o  537.686   3.9242  5966.80   87.024  5955.37  122.729  5978.36  123.414  537.169   5.5395  538.203   5.5597 -1.034241 7.848349 
1 1 1    5    4   15 o  356.586   2.9664  2623.51   43.628  2625.55   61.689  2621.46   61.708  356.725   4.1929  356.447   4.1974 0.2781982 5.932814 
1 1 1    5    4   16 o   63.047   4.1233   82.004   10.712   77.220   14.969   87.024   15.336   61.163   5.9341   64.932   5.7264 -3.769108 8.246504 
1 1 1    5    4   17 o  350.718   2.9466  2536.65   42.598  2501.56   59.074  2574.67   61.483  348.195   4.1134  353.242   4.2200 -5.046722 5.893145 
1 1 1    5    4   18 o  212.400   2.9176  929.692   25.542  964.776   36.937  897.539   35.360  216.235   4.1416  208.565   4.1106 7.670029 5.835207 
1 1 1    5    4   19 o  338.482   3.3730  2363.95   47.073  2393.00   67.618  2336.63   65.570  340.496   4.8149  336.468   4.7250 4.028351 6.745975 
1 1 1    5    4   20 o  242.867   2.6138  1217.14   26.182  1222.14   37.128  1212.19   36.925  243.363   3.6990  242.371   3.6938 0.9923096 5.227520 
1 1 1    5    4   21 o  235.144   2.6337  1141.06   25.540  1138.73   35.870  1143.45   36.374  234.902   3.7023  235.386   3.7467 -0.4839630 5.267367 
1 1 1    5    4   22 f   84.203   4.8961  146.240   16.971  140.477   23.147  152.939   24.956   82.418   6.8095   85.987   7.0368 -3.569710 9.792150 
1 1 1    5    4   23 o   56.348   7.5470   68.658   16.209   62.896   27.592   71.695   20.029   53.870   12.637   58.826   8.2551 -4.956116 15.09403 
1 1 1    5    4   24 o  252.434   3.4325  1315.14   33.567  1320.85   58.627  1312.35   40.942  252.759   5.6237  252.108   3.9374 0.6510010 6.865095 
1 1 1    5    4   25 o  129.984   3.9231  351.202   20.763  360.975   27.479  338.199   31.695  132.137   5.0422  127.832   6.0116 4.304390 7.846215 
1 1 1    5    4   26 o  101.595   4.0194  214.487   16.722  221.959   22.580  205.411   24.884  103.587   5.2850   99.603   6.0574 3.983681 8.038831 
1 1 1    5    4   27 o  287.798   2.8937  1711.09   34.346  1727.90   48.945  1694.79   48.210  289.189   4.1036  286.407   4.0812 2.781860 5.787486 
1 1 1    5    4   28 o  231.189   3.2218  1105.09   30.701  1109.22   44.260  1101.27   42.620  231.594   4.6336  230.785   4.4776 0.8096924 6.443549 
1 1 1    5    4   29 o  217.747   3.8672  986.087   33.853  1001.37   43.466  962.519   53.970  220.007   4.7902  215.487   6.0725 4.519196 7.734419 
1 1 1    5    4   30 o  189.011   3.3140  744.656   25.321  768.807   33.006  710.111   39.474  192.831   4.1500  185.191   5.1681 7.639694 6.628072 
1 1 1    5    4   31 o  102.072   5.1831  221.519   21.330  253.200   28.798  183.013   31.748  110.450   6.3216   93.695   8.2155 16.75514 10.36613 
1 1 1    5    4   32 o   55.848   7.2139   67.830   15.942   46.863   22.389   89.396   22.707   46.251   11.722   65.446   8.4121 -19.19530 14.42782 
1 1 1    5    4   33 o  109.467   4.0877  248.583   18.453  243.828   25.857  253.518   26.343  108.400   5.7835  110.534   5.7782 -2.133606 8.175360 
1 1 1    5    4   34 o  123.824   4.3356  319.147   22.116  333.911   31.088  304.021   31.467  126.757   5.9465  120.891   6.3110 5.865181 8.671206 
1 1 1    5    4   35 o  104.515   4.4748  227.707   19.282  234.129   27.206  221.225   27.331  106.014   6.2221  103.016   6.4327 2.998428 8.949517 
1 1 1    5    4   36 o   81.662   5.8531  139.994   19.685  133.858   26.967  146.993   28.802   79.767   8.1969   83.556   8.3575 -3.789207 11.70626 
1 1 1    5    4   37 f   40.786   10.303   32.702   21.738   41.472   33.665   26.430   28.470   44.029   15.228   37.543   13.883 6.485775 20.60683 
1 1 1    5    4   38 o   28.937   8.0784  -2.1376   17.156   30.178   24.061 -35.5603   24.470   37.672   12.881   20.202   9.7527 17.46959 16.15681 
1 1 1    5    4   39 o   54.397   9.0001   63.233   21.954   26.082   28.765  115.069   33.977   36.847   13.889   71.948   11.450 -35.10155 18.00017 
1 1 1    5    4   40 o   43.101   8.8142   43.501   16.982   31.630   24.155   55.104   23.880   37.736   12.907   48.467   12.008 -10.73117 17.62847 
1 1 1    5    4   41 o   29.043   8.0274   2.7234   16.526 -26.6650   23.328   32.334   23.416   20.539   9.8112   37.547   12.708 -17.00846 16.05487 
1 1 1    5    4   42 o   27.235   8.2750   3.5633   16.731   4.8111   24.083   2.3993   23.260   27.765   11.864   26.705   11.539 1.059576 16.55001 
1 1 1    5    4   43 o   26.770   8.0294  -0.2122   16.564   19.811   23.694 -19.3531   23.166   32.065   12.472   21.476   10.116 10.58937 16.05872 
1 1 1    5    4   44 o   35.247   10.002   25.003   22.212   16.311   35.947   30.372   28.250   34.049   14.521   36.446   13.758 -2.397659 20.00344 
1 1 1    5    4   45 f   32.349   8.6052   19.005   16.920   38.718   24.347   0.5914   23.532   39.055   12.956   25.644   11.329 13.41085 17.21043 
1 1 1    5    4   46 o   49.514   9.7681   67.191   20.890   55.701   28.677   80.182   30.493   44.704   13.994   54.324   13.632 -9.619713 19.53614 
1 1 1    5    4   47 o   36.216   8.0861   30.162   16.326   0.6636   22.979   60.234   23.201   24.647   11.023   47.786   11.834 -23.13889 16.17219 
1 1 1    5    4   48 o   21.135   7.1048 -17.4294   16.880 -16.5049   23.720 -18.3780   24.026   21.219   10.067   21.051   10.028 0.1685181 14.20961 
1 1 1    5    4   49 o   22.854   7.4770  -6.8745   16.820   3.8096   24.108 -17.0081   23.479   25.027   11.235   20.682   9.8693 4.345940 14.95395 
1 1 1    5    4   50 o   38.162   10.900   49.346   27.958   86.463   41.906   19.571   37.533   45.850   16.863   30.475   13.818 15.37457 21.80081 
1 1 1    5    4   51 o   34.058   10.425   44.790   26.768   49.200   40.919   41.492   35.392   34.620   15.128   33.496   14.350 1.123920 20.85095 
1 1 1    5    5    0 o  606.529   4.2712  7593.93  151.071  7593.93  151.071  7593.93  151.071  606.529   6.0403  606.529   6.0403 0.000000 0.000000 
1 1 1    5    5    1 o  392.785   2.9973  3183.69   48.556  3172.19   68.331  3195.41   69.010  392.069   4.2256  393.500   4.2521 -1.430481 5.994667 
1 1 1    5    5    2 o  175.775   2.0812  637.131   14.934  635.619   19.744  639.152   22.828  175.535   2.7271  176.014   3.1446 -0.4783630 4.162413 
1 1 1    5    5    3 o  117.354   2.1610  286.905   9.9287  293.236   12.318  275.161   16.776  119.228   2.5048  115.479   3.5223 3.748993 4.322087 
1 1 1    5    5    4 o  257.965   2.6466  1371.90   28.135  1404.96   40.819  1341.98   38.832  260.921   3.7931  255.010   3.6921 5.910553 5.293271 
1 1 1    5    5    5 o  160.471   2.6916  512.277   17.463  636.080   28.313  436.261   22.185  175.551   3.9103  145.391   3.6997 30.15909 5.383154 
1 1 1    5    5    6 o  372.294   3.8011  2829.87   55.971  2978.87   94.638  2749.71   69.413  379.660   6.0437  364.927   4.6118 14.73300 7.602285 
1 1 1    5    5    7 o  141.201   2.5667  406.395   14.540  432.881   23.800  390.624   18.365  144.815   3.9847  137.587   3.2363 7.227951 5.133359 
1 1 1    5    5    8 o  229.564   2.8741  1094.38   27.042  1171.77   37.132  1006.97   39.460  238.274   3.7784  220.855   4.3320 17.41826 5.748260 
1 1 1    5    5    9 o  214.959   2.8259  959.715   24.838  1008.40   33.535  900.550   36.967  221.051   3.6782  208.868   4.2912 12.18274 5.651842 
1 1 1    5    5   10 o  218.462   2.3200  989.354   20.289  1004.46   25.862  965.176   32.719  220.655   2.8417  216.268   3.6681 4.386276 4.640055 
1 1 1    5    5   11 o  154.957   2.3742  496.471   15.031  487.315   22.768  503.543   20.011  153.683   3.5920  156.231   3.1056 -2.548126 4.748394 
1 1 1    5    5   12 o  119.098   2.6422  292.732   12.768  293.187   16.632  292.079   19.923  119.215   3.3826  118.980   4.0599 0.2343597 5.284406 
1 1 1    5    5   13 o  648.892   4.5827  8691.41  122.631  8743.80  175.053  8640.92  171.844  650.807   6.5215  646.976   6.4399 3.831726 9.165314 
1 1 1    5    5   14 o  359.088   2.9576  2659.65   43.791  2626.50   61.108  2694.63   62.787  356.791   4.1526  361.386   4.2124 -4.595245 5.915107 
1 1 1    5    5   15 o  478.186   4.1559  4718.46   81.936  4668.71  114.116  4771.41  117.718  475.589   5.8177  480.783   5.9365 -5.193512 8.311864 
1 1 1    5    5   16 o  204.345   2.4465  861.261   20.616  853.274   28.841  869.607   29.481  203.377   3.4383  205.313   3.4814 -1.936447 4.893070 
1 1 1    5    5   17 o  232.963   2.5184  1118.36   24.170  1094.67   33.247  1144.92   35.198  230.351   3.4994  235.575   3.6227 -5.223984 5.036815 
1 1 1    5    5   18 o   96.236   4.2056  194.706   14.919  199.209   17.639  183.383   27.969   98.254   4.3526   94.218   7.1974 4.035637 8.411151 
1 1 1    5    5   19 o  376.894   5.2928  2830.08   66.278  3117.02  150.221  2760.72   73.855  388.082   9.3851  365.705   4.8965 22.37708 10.58568 
1 1 1    5    5   20 o  184.796   3.1856  705.492   22.867  703.250   39.656  706.608   27.988  184.546   5.2101  185.046   3.6671 -0.5010071 6.371237 
1 1 1    5    5   21 o  202.450   2.8090  841.434   23.208  816.234   30.478  876.215   35.806  198.872   3.7157  206.027   4.2137 -7.155090 5.617974 
1 1 1    5    5   22 o  123.212   3.6453  313.979   18.500  297.728   26.315  329.860   26.014  120.049   5.3146  126.374   4.9909 -6.325424 7.290693 
1 1 1    5    5   23 o  108.403   3.5086  242.853   15.680  250.340   22.133  235.309   22.218  110.084   4.8747  106.722   5.0475 3.362701 7.017170 
1 1 1    5    5   24 o  140.507   3.0729  407.656   17.795  429.285   25.400  386.806   24.938  144.170   4.2716  136.844   4.4185 7.326035 6.145755 
1 1 1    5    5   25 o  156.029   3.6009  502.135   22.805  496.244   29.639  510.683   35.702  154.947   4.6378  157.111   5.5096 -2.164246 7.201731 
1 1 1    5    5   26 o  136.920   3.1416  387.473   17.685  347.563   24.697  429.472   25.336  129.671   4.6178  144.168   4.2608 -14.49677 6.283257 
1 1 1    5    5   27 o  162.729   2.9725  546.793   19.941  569.195   28.624  525.668   27.796  165.966   4.1817  159.491   4.2256 6.475433 5.944906 
1 1 1    5    5   28 o   75.348   6.9476  120.999   20.833  108.307   33.184  129.255   26.764   71.879   11.194   78.817   8.2330 -6.938820 13.89524 
1 1 1    5    5   29 o  104.795   3.9548  226.000   17.033  203.389   23.097  252.957   25.220   99.082   5.6520  110.508   5.5332 -11.42635 7.909638 
1 1 1    5    5   30 f  135.252   3.3231  378.504   18.537  380.891   26.309  376.151   26.124  135.675   4.7014  134.829   4.6977 0.8464203 6.646188 
1 1 1    5    5   31 o  179.847   3.2823  665.723   24.064  692.700   37.282  646.456   31.507  182.911   4.9419  176.783   4.3211 6.128189 6.564642 
1 1 1    5    5   32 o   53.883   7.4716   63.907   16.110   83.232   22.493   43.554   23.084   63.117   8.6404   44.650   12.192 18.46688 14.94320 
1 1 1    5    5   33 o  149.430   3.5764  462.501   21.961  465.019   32.521  460.391   29.775  149.773   5.2645  149.086   4.8423 0.6873627 7.152853 
1 1 1    5    5   34 o  144.678   4.1598  438.853   24.256  416.072   38.065  454.428   31.475  141.358   6.5289  147.997   5.1563 -6.639877 8.319530 
1 1 1    5    5   35 o   27.589   8.2956   0.9830   16.575   6.1292   23.921  -3.7688   22.987   29.280   12.124   25.897   11.327 3.383038 16.59125 
1 1 1    5    5   36 o   63.979   6.9749   88.570   17.840   99.317   25.018   77.450   25.447   68.568   8.8464   59.390   10.786 9.178741 13.94990 
1 1 1    5    5   37 o   27.553   8.4411  -0.8722   17.731  -4.0819   25.613   2.0812   24.569   27.011   11.881   28.094   11.994 -1.083929 16.88230 
1 1 1    5    5   38 f  105.185   4.5648  232.743   19.785  219.587   27.454  246.958   28.539  102.074   6.5212  108.296   6.3894 -6.221703 9.129666 
1 1 1    5    5   39 o   25.153   8.0502 -10.2587   17.980 -20.0922   27.980  -3.3417   23.467   24.580   11.427   25.727   11.342 -1.147335 16.10032 
1 1 1    5    5   40 o   38.263   8.9558   32.003   17.207   46.703   24.615   17.956   24.063   44.300   12.771   32.225   12.559 12.07525 17.91153 
1 1 1    5    5   41 o   43.783   9.3762   46.344   18.536   53.785   26.441   39.153   25.992   46.959   13.136   40.606   13.382 6.353783 18.75232 
1 1 1    5    5   42 o   32.013   8.7515   18.654   16.546   13.669   23.682   23.408   23.127   30.324   12.249   33.703   12.503 -3.378416 17.50300 
1 1 1    5    5   43 o   21.882   7.2562 -17.9764   16.523 -13.9599   23.880 -21.6649   22.884   22.873   10.607   20.890   9.9041 1.983757 14.51232 
1 1 1    5    5   44 o   35.852   8.8736   26.177   18.858  -3.7104   27.746   51.838   25.709   26.667   12.004   45.036   13.071 -18.36942 17.74726 
1 1 1    5    5   45 o   30.218   8.5893   15.237   16.784   26.026   24.102   5.0802   23.386   33.745   12.715   26.692   11.551 7.053413 17.17860 
1 1 1    5    5   46 o   31.811   8.7857   15.557   17.780   42.773   27.639  -3.6567   23.223   39.582   13.792   24.039   10.887 15.54287 17.57146 
1 1 1    5    5   47 o   29.632   8.7026   16.987   17.611   12.344   25.348   21.320   24.487   28.377   12.150   30.887   12.463 -2.510283 17.40527 
1 1 1    5    5   48 o   52.780   8.3883   74.602   17.822   71.095   25.106   78.166   25.305   51.245   12.076   54.315   11.645 -3.069607 16.77654 
1 1 1    5    5   49 o   26.979   8.2975   11.718   17.250   10.133   24.695   13.229   24.108   26.642   11.694   27.316   11.775 -0.6738625 16.59499 
1 1 1    5    5   50 o   26.909   8.9534  -0.9695   25.838 -15.1079   39.731   9.3922   34.013   25.791   12.445   28.028   12.876 -2.236521 17.90683 
1 1 1    5    5   51 o   26.252   8.8593  -1.1143   26.312   10.664   40.379  -9.8062   34.688   28.087   13.269   24.417   11.743 3.670887 17.71858 
1 1 1    5    6    0 o  383.721   2.9463  3038.86   65.926  3038.86   65.926  3038.86   65.926  383.721   4.1667  383.721   4.1667 0.000000 0.000000 
1 1 1    5    6    1 o  339.198   2.9258  2368.23   40.321  2337.55   52.510  2412.31   62.944  336.553   3.7829  341.843   4.4644 -5.290009 5.851589 
1 1 1    5    6    2 o  226.588   2.3062  1061.15   21.384  1073.92   28.602  1044.97   32.199  228.144   3.0396  225.031   3.4693 3.113266 4.612460 
1 1 1    5    6    3 o  613.114   4.6735  7761.60  116.619  7712.58  152.764  7830.06  180.543  610.916   6.0628  615.311   7.1141 -4.395081 9.347083 
1 1 1    5    6    4 o  204.579   2.3696  861.451   19.959  899.374   29.311  828.667   27.253  208.764   3.4042  200.395   3.2973 8.370087 4.739260 
1 1 1    5    6    5 o  174.819   2.4035  626.263   16.188  642.995   28.732  618.480   19.595  176.497   3.9469  173.141   2.7439 3.356171 4.807018 
1 1 1    5    6    6 o  261.204   2.7177  1408.23   29.278  1407.81   41.394  1408.64   41.416  261.166   3.8429  261.243   3.8438 -0.7681274E-01 5.435307 
1 1 1    5    6    7 o  421.912   4.5123  3673.86   78.387  3589.27  107.268  3770.79  114.829  416.729   6.2409  427.094   6.5187 -10.36484 9.024560 
1 1 1    5    6    8 o  310.002   3.3363  1993.48   42.322  2068.47   57.045  1901.66   63.120  316.544   4.3693  303.460   5.0431 13.08398 6.672672 
1 1 1    5    6    9 o  263.996   2.6003  1442.22   28.166  1482.15   38.249  1394.91   41.630  268.009   3.4603  259.983   3.8823 8.026611 5.200564 
1 1 1    5    6   10 o  468.713   3.7680  4539.55   72.239  4564.58   96.313  4507.36  109.225  470.228   4.9660  467.198   5.6684 3.029663 7.536030 
1 1 1    5    6   11 o  393.710   3.3181  3206.08   53.714  3307.25   73.841  3092.40   78.278  400.334   4.4721  387.086   4.9031 13.24765 6.636228 
1 1 1    5    6   12 o  711.619   5.7379 10460.34  168.406 10439.16  237.312 10481.82  239.020  710.896   8.0937  712.341   8.1354 -1.444946 11.47578 
1 1 1    5    6   13 o  301.377   2.9042  1871.07   35.614  1856.64   46.607  1891.33   55.211  299.993   3.7668  302.761   4.4214 -2.768097 5.808381 
1 1 1    5    6   14 o   66.619   6.4139  106.217   14.848  133.216   18.702   60.176   24.422   80.337   5.6441   52.901   11.519 27.43532 12.82773 
1 1 1    5    6   15 o  438.572   5.5398  3955.34   86.055  4008.22  174.801  3938.43   98.866  440.311   9.6254  436.833   5.4874 3.478027 11.07968 
1 1 1    5    6   16 o  480.575   4.4003  4788.06   82.993  4704.46  140.395  4832.96  102.896  477.246   7.1325  483.904   5.1555 -6.657196 8.800679 
1 1 1    5    6   17 o   75.933   3.7593  117.477   11.682  107.201   15.391  131.440   17.942   72.069   5.1779   79.798   5.4514 -7.729134 7.518566 
1 1 1    5    6   18 o  114.815   3.0390  274.753   14.220  294.556   19.149  250.408   21.232  119.480   3.8859  110.150   4.6736 9.330803 6.078040 
1 1 1    5    6   19 o  397.307   4.5170  3261.28   74.018  3236.72  104.703  3285.82  104.651  395.809   6.4137  398.806   6.3624 -2.996552 9.034090 
1 1 1    5    6   20 o  267.861   2.6730  1480.41   29.526  1497.11   42.187  1464.36   41.339  269.341   3.7976  266.380   3.7626 2.960175 5.345960 
1 1 1    5    6   21 o   72.298   4.4498  108.267   13.241  102.187   18.952  114.066   18.509   70.304   6.5358   74.292   6.0405 -3.987732 8.899654 
1 1 1    5    6   22 o   44.415   7.6673   41.642   13.961   53.106   21.158   32.802   18.579   49.628   10.655   39.201   11.028 10.42747 15.33451 
1 1 1    5    6   23 o   74.470   5.3856  116.229   16.094  121.260   20.766  108.661   25.467   76.554   6.5768   72.386   8.5301 4.168121 10.77114 
1 1 1    5    6   24 o  220.735   2.7589  1005.30   25.106  968.542   34.949  1044.50   36.090  216.568   3.9127  224.902   3.8907 -8.333618 5.517832 
1 1 1    5    6   25 o   64.931   5.8687   87.607   15.715   88.185   22.132   87.021   22.318   65.150   8.2366   64.711   8.3621 0.4388199 11.73735 
1 1 1    5    6   26 o  285.025   3.0616  1679.01   35.757  1680.90   47.932  1676.63   53.693  285.240   4.0743  284.810   4.5708 0.4297791 6.123110 
1 1 1    5    6   27 o  134.032   3.1815  371.029   17.578  388.216   25.289  354.965   24.449  137.034   4.4745  131.030   4.5241 6.003586 6.363021 
1 1 1    5    6   28 o  104.199   4.8004  225.372   20.616  228.440   28.757  222.128   29.572  104.942   6.6441  103.456   6.9304 1.486481 9.600716 
1 1 1    5    6   29 o  127.466   3.4196  336.775   17.949  320.655   25.678  352.176   25.098  124.463   5.0021  130.469   4.6641 -6.005836 6.839214 
1 1 1    5    6   30 o   48.476   7.5428   51.333   14.709   59.219   20.806   43.454   20.797   52.342   10.003   44.611   11.293 7.731205 15.08560 
1 1 1    5    6   31 f  166.323   3.1210  572.019   21.404  554.611   29.915  590.278   30.637  163.730   4.4299  168.917   4.3975 -5.186615 6.241955 
1 1 1    5    6   32 o  123.426   4.3125  314.792   21.496  309.175   27.603  323.447   34.264  122.113   5.4807  124.739   6.6598 -2.626610 8.625038 
1 1 1    5    6   33 o   79.474   5.8728  132.244   19.118  152.211   27.371  113.219   26.716   85.409   7.7699   73.539   8.8083 11.86997 11.74557 
1 1 1    5    6   34 o  126.375   3.9348  331.748   20.499  317.828   28.820  346.002   29.163  123.677   5.6498  129.072   5.4781 -5.394493 7.869555 
1 1 1    5    6   35 f  106.858   4.4186  238.279   19.447  223.646   27.467  252.989   27.539  103.531   6.4323  110.185   6.0598 -6.654564 8.837208 
1 1 1    5    6   36 o   35.526   9.7227   12.997   21.170   37.808   32.698  -4.9098   27.778   42.910   14.999   28.141   12.376 14.76862 19.44530 
1 1 1    5    6   37 o   32.272   9.0076   10.042   18.912  -8.6715   26.526   29.389   26.971   26.388   11.819   38.156   13.596 -11.76757 18.01511 
1 1 1    5    6   38 o   35.102   8.1965   19.265   16.770   49.007   23.500 -11.5985   23.939   46.089   12.179   24.114   10.973 21.97480 16.39308 
1 1 1    5    6   39 o   58.365   7.3955   75.896   17.394   81.197   24.549   70.553   24.650   61.058   9.7482   55.672   11.124 5.385956 14.79105 
1 1 1    5    6   40 o   25.678   8.2358 -19.0750   18.445 -35.2337   22.917   10.644   31.080   19.042   9.2505   32.313   13.629 -13.27099 16.47162 
1 1 1    5    6   41 o   45.094   9.3597   49.648   18.547   49.364   26.386   49.925   26.075   44.954   13.299   45.234   13.174 -0.2802620 18.71936 
1 1 1    5    6   42 o   27.680   8.3244   4.9268   16.743   11.002   23.915  -0.9135   23.449   29.497   12.159   25.863   11.372 3.633820 16.64876 
1 1 1    5    6   43 o   32.484   9.0778   12.407   20.393 -17.8155   29.847   38.871   27.930   25.123   11.720   39.844   13.866 -14.72106 18.15564 
1 1 1    5    6   44 o   23.730   7.6628 -17.9425   18.104 -46.8585   26.342   7.9428   24.923   19.137   9.4244   28.323   12.085 -9.186747 15.32568 
1 1 1    5    6   45 o   20.696   6.9774 -22.5031   16.545 -26.5601   23.479 -18.5016   23.318   20.078   9.6573   21.315   10.074 -1.237135 13.95489 
1 1 1    5    6   46 o   30.796   8.2611   15.406   16.379   39.690   23.472  -7.6453   22.868   38.639   12.716   22.954   10.549 15.68505 16.52228 
1 1 1    5    6   47 o   46.488   9.1945   60.994   18.320   60.240   26.360   61.698   25.479   45.973   13.205   47.004   12.798 -1.030815 18.38903 
1 1 1    5    6   48 o   21.225   7.1252 -17.3111   16.945  -9.7180   23.976 -24.8891   23.952   22.494   10.498   19.956   9.6374 2.538330 14.25050 
1 1 1    5    6   49 o   35.406   10.099   40.219   22.746   38.919   33.295   41.357   31.147   34.981   14.375   35.831   14.190 -0.8495750 20.19881 
1 1 1    5    6   50 o   38.858   11.165   60.937   27.990   61.474   41.915   60.505   37.603   38.514   16.006   39.202   15.570 -0.6876717 22.32949 
1 1 1    5    6   51 o   30.132   9.6953   26.257   26.642   17.795   41.917   31.992   34.509   29.098   13.676   31.166   13.746 -2.068268 19.39051 
1 1 1    5    7    0 o  259.227   2.2934  1386.86   34.665  1386.86   34.665  1386.86   34.665  259.227   3.2433  259.227   3.2433 0.000000 0.000000 
1 1 1    5    7    1 o   73.427   2.0200  110.768   6.0875  127.310   8.9040   96.249   8.3415   78.554   2.7482   68.300   2.9611 10.25410 4.039930 
1 1 1    5    7    2 o  258.397   2.9441  1382.05   30.898  1400.29   40.468  1356.56   47.844  260.471   3.7669  256.324   4.5256 4.147461 5.888194 
1 1 1    5    7    3 o  304.782   2.9164  1917.41   36.658  1930.33   52.206  1904.84   51.486  305.793   4.1393  303.770   4.1094 2.023102 5.832724 
1 1 1    5    7    4 o  243.064   2.5678  1214.55   25.665  1278.29   38.125  1161.72   34.706  248.869   3.7143  237.259   3.5466 11.61018 5.135579 
1 1 1    5    7    5 o  353.573   3.6635  2528.92   50.627  2746.29   88.430  2422.94   61.747  364.564   5.8811  342.582   4.3701 21.98169 7.327007 
1 1 1    5    7    6 o   96.368   2.3621  191.663   9.3860  196.807   13.277  186.525   13.270   97.661   3.2963   95.074   3.3841 2.586884 4.724176 
1 1 1    5    7    7 o  177.228   2.5335  650.712   17.408  640.704   30.208  655.689   21.301  176.183   4.1571  178.273   2.8970 -2.090012 5.066928 
1 1 1    5    7    8 o  226.650   3.2091  1033.35   29.446  1201.05   47.485  928.579   37.534  241.197   4.7733  212.104   4.2905 29.09401 6.418203 
1 1 1    5    7    9 o  166.403   2.5914  567.917   15.645  564.183   18.184  578.554   30.691  165.378   2.6660  167.427   4.4445 -2.049210 5.182771 
1 1 1    5    7   10 o  250.090   2.9603  1297.60   28.890  1312.59   35.616  1268.75   49.398  252.239   3.4235  247.942   4.8306 4.296814 5.920699 
1 1 1    5    7   11 o  474.550   4.6084  4621.28   87.238  4757.57  143.836  4541.97  109.723  479.989   7.2656  469.111   5.6710 10.87830 9.216744 
1 1 1    5    7   12 o  155.217   2.8722  489.317   17.094  517.902   30.832  476.632   20.539  158.427   4.7186  152.007   3.2761 6.420486 5.744376 
1 1 1    5    7   13 o   42.036   6.9015   36.209   10.981   33.452   13.094   42.746   20.163   39.497   8.3012   44.574   11.028 -5.076736 13.80305 
1 1 1    5    7   14 o  593.978   5.2107  7296.98  120.824  7319.50  148.699  7253.22  207.279  595.469   6.0546  592.487   8.4822 2.982239 10.42142 
1 1 1    5    7   15 o  317.435   2.9794  2079.18   38.664  2078.53   58.700  2079.68   51.386  317.379   4.4843  317.489   3.9242 -0.1099243 5.958841 
1 1 1    5    7   16 o  284.226   2.8779  1659.83   33.170  1629.65   42.955  1704.43   52.206  281.051   3.7056  287.401   4.4042 -6.350555 5.755751 
1 1 1    5    7   17 o   94.199   3.0533  183.064   11.861  186.393   16.926  179.852   16.627   95.041   4.3179   93.358   4.3181 1.682526 6.106564 
1 1 1    5    7   18 o  242.016   2.7985  1206.33   27.570  1222.87   42.705  1194.52   36.102  243.423   4.2535  240.609   3.6380 2.814941 5.597059 
1 1 1    5    7   19 o  218.952   2.9310  989.520   26.467  979.625   37.524  999.316   37.336  217.862   4.1760  220.043   4.1139 -2.181366 5.862049 
1 1 1    5    7   20 o  237.069   2.6162  1159.72   25.579  1148.48   35.902  1171.31   36.451  235.903   3.6900  238.236   3.7097 -2.332626 5.232365 
1 1 1    5    7   21 o   60.500   5.2127   75.760   12.999   75.048   18.678   76.428   18.101   60.220   7.5203   60.780   7.2205 -0.5593758 10.42546 
1 1 1    5    7   22 o  173.458   2.7784  621.117   19.877  626.258   28.219  616.054   28.002  174.171   3.9282  172.746   3.9302 1.424911 5.556756 
1 1 1    5    7   23 o  194.189   3.2308  779.465   25.846  790.465   35.839  767.545   37.308  195.626   4.4419  192.751   4.6928 2.874847 6.461664 
1 1 1    5    7   24 o  143.134   3.3756  423.027   19.917  410.289   27.615  436.835   28.752  140.892   4.7522  145.375   4.7952 -4.483566 6.751129 
1 1 1    5    7   25 o   87.629   4.2283  158.873   15.268  168.750   21.873  149.488   21.322   90.289   5.8735   84.968   6.0841 5.320923 8.456642 
1 1 1    5    7   26 o  215.688   2.7884  960.898   24.804  949.051   34.815  973.109   35.347  214.339   3.9382  217.038   3.9486 -2.698685 5.576845 
1 1 1    5    7   27 o   77.139   4.7074  123.082   14.915  139.600   21.678  108.235   20.553   82.056   6.4055   72.221   6.9000 9.834564 9.414860 
1 1 1    5    7   28 o  105.122   4.4187  229.078   19.064  229.458   28.409  228.767   25.714  105.174   6.5492  105.071   5.9337 0.1032639 8.837460 
1 1 1    5    7   29 o  118.344   3.8479  281.435   18.465  340.050   29.612  244.144   23.619  128.108   5.6044  108.579   5.2742 19.52916 7.695858 
1 1 1    5    7   30 o   51.014   7.4311   56.449   15.108   59.662   21.841   53.501   20.921   52.440   10.465   49.587   10.553 2.853676 14.86218 
1 1 1    5    7   31 o   71.318   5.4924  106.456   16.061   94.248   22.881  118.314   22.550   67.222   8.2526   75.414   7.2498 -8.192093 10.98479 
1 1 1    5    7   32 o  125.734   4.6121  330.024   23.753  343.061   32.160  314.377   35.232  128.544   6.0660  122.924   6.9492 5.620148 9.224262 
1 1 1    5    7   33 o  143.720   3.8805  428.333   22.986  420.915   31.821  436.427   33.240  142.431   5.4169  145.008   5.5578 -2.577530 7.760921 
1 1 1    5    7   34 o   28.254   8.3314   2.0073   16.658   13.765   23.616  -9.6357   23.500   31.747   12.423   24.762   11.105 6.985428 16.66279 
1 1 1    5    7   35 o   65.844   6.9469   94.696   17.745  124.199   25.369   66.429   24.831   76.888   7.9998   54.799   11.360 22.08875 13.89371 
1 1 1    5    7   36 o   52.657   9.7619   62.735   21.326   69.598   32.429   57.505   28.308   55.055   14.191   50.259   13.408 4.795773 19.52372 
1 1 1    5    7   37 o   44.170   9.3054   44.016   18.571   55.094   26.353   33.086   26.176   48.960   12.878   39.381   13.436 9.578651 18.61072 
1 1 1    5    7   38 o   23.064   7.4604 -16.7834   16.527 -33.2848   23.673  -1.0920   23.085   19.976   9.6305   26.152   11.397 -6.176199 14.92075 
1 1 1    5    7   39 o   31.636   8.7125   15.302   16.673   6.9582   23.443   23.842   23.718   28.601   11.935   34.671   12.696 -6.070400 17.42508 
1 1 1    5    7   40 o   31.831   9.3113   11.718   20.558   22.843   26.547  -4.9456   32.491   34.472   13.259   29.191   13.077 5.281097 18.62263 
1 1 1    5    7   41 o   42.095   9.0331   42.695   17.062   41.409   24.117   43.984   24.141   41.508   12.808   42.682   12.742 -1.173885 18.06623 
1 1 1    5    7   42 o   32.795   8.8279   20.971   16.709   14.883   23.690   26.998   23.570   30.562   12.284   35.027   12.682 -4.464903 17.65584 
1 1 1    5    7   43 o   83.089   6.4948  155.428   22.152  141.710   31.674  168.564   30.993   79.093   9.7095   87.086   8.6288 -7.993622 12.98959 
1 1 1    5    7   44 o   32.196   8.7869   18.624   17.312   4.2817   23.788   34.773   25.242   26.823   11.629   37.569   13.176 -10.74604 17.57377 
1 1 1    5    7   45 o   34.328   8.9905   27.964   17.172   35.972   24.348   20.039   24.221   37.362   12.949   31.294   12.475 6.067770 17.98091 
1 1 1    5    7   46 o   40.125   7.8236   40.315   15.801   10.385   22.558   69.142   22.139   27.373   11.582   52.877   10.521 -25.50373 15.64730 
1 1 1    5    7   47 o   35.104   9.4230   33.667   20.484   47.891   26.061   10.677   33.133   40.557   13.402   29.651   13.250 10.90654 18.84595 
1 1 1    5    7   48 o   33.831   9.1624   31.389   17.868   32.800   25.852   30.098   24.725   34.317   13.111   33.345   12.802 0.9718666 18.32480 
1 1 1    5    7   49 o   40.840   9.7357   54.215   22.598   20.051   33.278   83.446   30.783   30.311   13.428   51.368   14.101 -21.05699 19.47135 
1 1 1    5    7   50 o   35.418   10.378   44.987   24.798   34.626   33.355   57.789   37.078   32.689   13.965   38.147   15.355 -5.458416 20.75631 
1 1 1    5    7   51 o   27.460   9.1978   5.9314   27.326   27.235   41.906  -9.8297   36.044   30.342   14.064   24.577   11.858 5.765467 18.39569 
1 1 1    5    8    1 o  133.569   1.9429  367.168   10.595  361.871   13.971  374.337   16.253  132.442   2.5575  134.697   2.9256 -2.254181 3.885889 
1 1 1    5    8    2 o  148.386   2.3825  456.831   14.362  469.636   18.903  439.344   22.091  150.868   3.0378  145.904   3.6710 4.964325 4.764923 
1 1 1    5    8    3 o   87.808   2.0825  159.099   7.5407  162.261   10.659  155.932   10.669   88.682   2.9143   86.934   2.9755 1.747665 4.164932 
1 1 1    5    8    4 o  221.311   2.4601  1008.81   22.425  1046.04   32.768  976.010   30.755  225.143   3.5288  217.480   3.4287 7.662827 4.920182 
1 1 1    5    8    5 o  320.426   3.4097  2101.96   43.549  2189.01   72.129  2052.01   54.631  325.556   5.3718  315.297   4.2010 10.25888 6.819405 
1 1 1    5    8    6 o  363.184   3.0996  2723.24   45.943  2719.20   70.219  2726.27   60.752  362.922   4.6911  363.445   4.0528 -0.5222778 6.199298 
1 1 1    5    8    7 o  173.529   3.4680  635.934   19.226  599.178   44.160  644.532   21.357  170.304   6.2869  176.755   2.9295 -6.450470 6.935900 
1 1 1    5    8    8 o  195.624   2.6281  789.534   20.161  789.369   24.912  789.846   34.323  195.610   3.0878  195.637   4.2537 -0.2658081E-01 5.256250 
1 1 1    5    8    9 o  446.997   3.6297  4127.29   66.351  4150.70   88.411  4097.10  100.397  448.474   4.7797  445.520   5.4637 2.953857 7.259333 
1 1 1    5    8   10 o  385.179   3.2709  3066.07   51.627  3105.46   69.420  3017.33   77.224  387.964   4.3384  382.395   4.8964 5.569611 6.541877 
1 1 1    5    8   11 o  435.492   3.5814  3917.67   63.821  3945.98   85.248  3881.56   96.268  437.303   4.7264  433.682   5.3820 3.621765 7.162783 
1 1 1    5    8   12 o  474.513   4.1029  4647.88   80.298  4649.34  113.696  4646.43  113.421  474.587   5.8085  474.439   5.7963 0.1476440 8.205822 
1 1 1    5    8   13 o  386.450   3.3763  3056.99   52.538  2972.01   66.936  3193.35   84.789  379.534   4.2760  393.365   5.2261 -13.83145 6.752521 
1 1 1    5    8   14 o  534.041   4.5034  5888.23   99.189  5911.22  140.970  5865.69  139.590  535.071   6.3878  533.010   6.3497 2.060730 9.006804 
1 1 1    5    8   15 f  509.955   3.7690  5366.91   79.258  5327.89  110.890  5407.65  113.326  508.064   5.2918  511.846   5.3682 -3.782379 7.537959 
1 1 1    5    8   16 o  394.204   3.1370  3206.56   51.002  3192.04   71.759  3221.38   72.502  393.303   4.4237  395.105   4.4491 -1.801636 6.274007 
1 1 1    5    8   17 o  408.045   3.2275  3434.83   54.292  3389.70   75.438  3483.32   78.196  405.270   4.5132  410.821   4.6150 -5.551147 6.454970 
1 1 1    5    8   18 f  112.810   3.3687  262.357   15.626  267.095   23.108  258.366   21.211  113.743   4.9258  111.877   4.5967 1.866203 6.737478 
1 1 1    5    8   19 o  171.099   2.7568  605.156   19.332  613.259   26.019  595.171   28.884  172.388   3.6594  169.811   4.1240 2.576904 5.513513 
1 1 1    5    8   20 o   58.960   5.4908   69.851   13.130   90.581   20.509   55.452   17.093   66.164   7.5154   51.756   8.0072 14.40730 10.98162 
1 1 1    5    8   21 o  176.048   2.7391  639.677   19.887  632.858   27.909  646.711   28.345  175.096   3.8646  177.001   3.8828 -1.905228 5.478248 
1 1 1    5    8   22 o  272.213   2.7689  1529.90   31.087  1526.03   43.950  1533.78   43.977  271.868   3.9195  272.558   3.9120 -0.6898499 5.537742 
1 1 1    5    8   23 o  149.943   3.2221  464.128   19.733  467.125   30.118  461.875   26.121  150.348   4.8570  149.538   4.2352 0.8101044 6.444164 
1 1 1    5    8   24 o  288.578   3.2527  1721.41   38.704  1724.73   54.163  1717.95   55.327  288.870   4.5461  288.286   4.6532 0.5840454 6.505301 
1 1 1    5    8   25 o  337.918   3.0116  2359.42   41.973  2349.13   59.139  2369.87   59.582  337.176   4.2526  338.660   4.2656 -1.483429 6.023288 
1 1 1    5    8   26 o  119.266   3.3568  294.158   16.510  292.219   23.491  296.051   23.210  118.874   4.7912  119.657   4.7030 -0.7828522 6.713654 
1 1 1    5    8   27 o   69.174   6.0504  101.078   16.974   89.502   25.506  110.279   22.740   65.495   9.4422   72.852   7.5680 -7.357193 12.10080 
1 1 1    5    8   28 f   66.031   5.3424   91.929   14.293   73.276   20.416  109.862   20.018   59.308   8.3462   72.753   6.6712 -13.44434 10.68471 
1 1 1    5    8   29 o  233.934   3.7254  1144.90   34.811  1084.99   55.973  1182.69   44.454  228.760   5.9325  239.108   4.5076 -10.34848 7.450716 
1 1 1    5    8   30 o   57.364   6.6875   70.009   15.175   89.044   22.115   53.072   20.860   65.352   8.2046   49.375   10.563 15.97713 13.37502 
1 1 1    5    8   31 o  138.895   3.4462  399.174   19.732  417.670   28.318  381.719   27.510  142.025   4.8343  135.766   4.9128 6.258942 6.892501 
1 1 1    5    8   32 o   80.360   5.6570  134.391   18.489  137.029   28.752  132.531   24.143   80.955   8.6112   79.765   7.3386 1.190231 11.31408 
1 1 1    5    8   33 o  151.882   3.6537  478.665   22.777  479.713   30.756  477.393   33.895  152.111   4.9023  151.653   5.4189 0.4580536 7.307333 
1 1 1    5    8   34 o   23.950   7.6100 -11.9593   16.067 -23.4263   22.950  -0.9359   22.502   21.491   10.107   26.409   11.380 -4.918043 15.22004 
1 1 1    5    8   35 o  140.698   3.6363  411.460   21.100  404.436   29.707  418.612   29.975  139.482   5.1638  141.915   5.1211 -2.432938 7.272584 
1 1 1    5    8   36 o   29.085   8.5019   5.8117   16.887  -2.6833   23.747   14.502   24.019   26.381   11.526   31.789   12.501 -5.408266 17.00382 
1 1 1    5    8   37 o   92.107   5.0353  178.920   19.095  164.710   26.379  194.560   27.675   88.233   7.2488   95.981   6.9909 -7.747421 10.07063 
1 1 1    5    8   38 o   32.812   8.5373   16.474   16.590   35.539   23.594  -2.1699   23.332   39.659   12.727   25.965   11.382 13.69444 17.07462 
1 1 1    5    8   39 o   45.127   7.6767   44.702   16.937   7.8177   23.852   82.213   24.054   28.931   12.053   61.322   9.5106 -32.39034 15.35330 
1 1 1    5    8   40 o   47.835   10.100   57.486   24.555   86.888   32.307   17.264   37.786   59.742   13.437   35.929   15.084 23.81337 20.20087 
1 1 1    5    8   41 o   20.434   6.8533 -29.3158   16.226 -52.4806   23.405  -7.8774   22.516   17.177   8.5346   23.691   10.725 -6.514177 13.70667 
1 1 1    5    8   42 f   71.280   6.0851  112.173   17.828  125.600   25.935  100.146   24.546   75.465   8.3327   67.096   8.8701 8.368675 12.17011 
1 1 1    5    8   43 o   19.028   6.5477 -34.5682   16.388 -34.7209   23.919 -34.4332   22.499   19.415   9.4359   18.641   9.0805 0.7739124 13.09547 
1 1 1    5    8   44 o   31.198   8.7078   18.064   16.712   26.097   24.301   10.856   23.019   34.006   12.776   28.390   11.835 5.615723 17.41562 
1 1 1    5    8   45 o   21.150   7.1304 -23.1117   17.451 -35.2140   26.222 -13.4911   23.379   20.172   9.8213   22.128   10.340 -1.955397 14.26082 
1 1 1    5    8   46 f   24.582   7.6106  -1.3038   15.445   15.883   22.386 -16.9181   21.337   28.942   11.828   20.223   9.5808 8.719521 15.22126 
1 1 1    5    8   47 f   24.833   8.2078 -30.5840   22.009 -71.6560   29.471   21.208   33.095   17.719   8.9157   31.946   13.783 -14.22640 16.41565 
1 1 1    5    8   48 o   21.052   7.1009 -18.8235   17.265 -28.3304   24.397  -9.2858   24.436   19.537   9.5033   22.567   10.554 -3.030298 14.20179 
1 1 1    5    8   49 o   22.174   7.6378 -29.3164   22.394 -18.1036   32.615 -39.3176   30.802   23.716   11.401   20.632   10.167 3.084070 15.27566 
1 1 1    5    8   50 f   27.798   8.8511   14.572   21.217   20.901   31.790   9.4885   28.490   29.221   13.024   26.375   11.989 2.846018 17.70225 
1 1 1    5    8   51 o   29.036   9.3903   15.482   26.921 -19.3951   39.494   45.750   36.792   24.240   11.856   33.832   14.565 -9.591450 18.78069 
1 1 1    5    9    0 o  191.869   2.8309  760.488   31.651  760.488   31.651  760.488   31.651  191.869   4.0035  191.869   4.0035 0.000000 0.000000 
1 1 1    5    9    1 o  762.300   5.7129 11975.29  176.004 11783.69  226.426 12267.80  279.766  754.873   7.2726  769.727   8.8124 -14.85400 11.42576 
1 1 1    5    9    2 o  186.835   3.1697  726.236   19.756  711.055   43.289  730.230   22.204  185.535   5.6569  188.135   2.8615 -2.600021 6.339471 
1 1 1    5    9    3 o  194.747   3.3583  756.388   22.393  831.155   48.688  736.328   25.219  200.584   5.8852  188.909   3.2368 11.67442 6.716560 
1 1 1    5    9    4 o  408.453   3.9559  3459.92   66.240  3598.58   89.997  3296.00   97.850  417.459   5.2269  399.447   5.9393 18.01202 7.911767 
1 1 1    5    9    5 o  122.937   1.9384  311.525   9.8240  324.081   14.109  299.709   13.687  125.339   2.7292  120.534   2.7532 4.805397 3.876707 
1 1 1    5    9    6 f  276.817   2.6381  1580.25   29.754  1586.58   45.832  1575.63   39.118  277.285   4.0075  276.349   3.4321 0.9351501 5.276282 
1 1 1    5    9    7 o  273.079   3.1467  1524.89   34.173  1590.98   56.942  1487.68   42.722  277.638   4.9726  268.520   3.8575 9.118835 6.293453 
1 1 1    5    9    8 o  225.863   2.4602  1051.54   22.653  1046.87   29.819  1057.91   34.835  225.277   3.2093  226.450   3.7297 -1.173691 4.920390 
1 1 1    5    9    9 o  292.745   3.3628  1767.68   39.713  1765.28   51.080  1771.34   63.145  292.511   4.2340  292.979   5.2256 -0.4678955 6.725591 
1 1 1    5    9   10 o  528.632   4.6043  5826.16   97.736  6034.82  125.947  5510.30  154.959  540.723   5.6474  516.541   7.2736 24.18158 9.208549 
1 1 1    5    9   11 o  423.903   3.3736  3699.22   56.775  3675.53   71.110  3740.87   94.293  422.073   4.0849  425.733   5.3700 -3.660309 6.747116 
1 1 1    5    9   12 o  733.880   5.5199 11120.26  165.146 11094.61  217.510 11155.18  253.760  732.971   7.1949  734.789   8.3733 -1.817627 11.03988 
1 1 1    5    9   13 o  368.737   3.6957  2790.61   52.107  2765.08   62.707  2847.57   93.659  366.081   4.1531  371.392   6.1144 -5.311829 7.391474 
1 1 1    5    9   14 o  553.187   4.6314  6317.55  105.638  6384.79  151.601  6254.09  147.282  556.040   6.6104  550.334   6.4887 5.706787 9.262886 
1 1 1    5    9   15 o  188.295   2.3717  731.407   18.419  727.717   25.960  735.147   26.136  187.817   3.3513  188.773   3.3569 -0.9562378 4.743380 
1 1 1    5    9   16 o  150.768   2.4813  468.998   15.429  472.518   21.777  465.451   21.863  151.337   3.4890  150.200   3.5292 1.136688 4.962662 
1 1 1    5    9   17 f   85.016   3.3161  149.402   11.606  145.189   16.789  153.258   16.062   83.863   4.8539   86.168   4.5195 -2.305016 6.632249 
1 1 1    5    9   18 o  347.891   3.4059  2498.78   48.868  2493.17   69.398  2504.30   68.826  347.502   4.8420  348.281   4.7913 -0.7792969 6.811887 
1 1 1    5    9   19 o  274.538   2.9172  1544.31   32.485  1495.24   41.972  1617.63   51.302  269.160   3.7808  279.916   4.4436 -10.75604 5.834415 
1 1 1    5    9   20 o   64.842   5.5517   90.425   14.151   73.913   22.507  101.221   18.199   59.711   9.1389   69.973   6.3059 -10.26118 11.10336 
1 1 1    5    9   21 o  121.557   3.1221  305.140   15.653  306.884   22.147  303.399   22.125  121.904   4.4049  121.209   4.4258 0.6949005 6.244264 
1 1 1    5    9   22 o  179.379   2.7419  664.477   20.281  648.707   28.692  680.227   28.673  177.249   3.9248  181.509   3.8300 -4.260544 5.483868 
1 1 1    5    9   23 o   86.647   4.4016  153.759   15.556  166.318   24.205  144.922   20.304   89.610   6.5492   83.683   5.8826 5.927132 8.803238 
1 1 1    5    9   24 o   60.940   6.8949   74.084   16.449   55.260   20.763  105.808   26.954   50.578   10.303   71.302   9.1654 -20.72403 13.78976 
1 1 1    5    9   25 o  184.446   2.9669  700.055   22.399  680.612   29.714  725.646   34.090  181.510   3.9691  187.381   4.4110 -5.870346 5.933888 
1 1 1    5    9   26 o  135.380   3.1462  378.949   17.550  357.028   24.651  401.480   24.992  131.401   4.5485  139.358   4.3481 -7.956390 6.292421 
1 1 1    5    9   27 o   84.387   4.9307  146.088   17.058  168.610   25.718  128.397   22.794   90.130   6.9183   78.643   7.0274 11.48700 9.861399 
1 1 1    5    9   28 o  152.677   3.0307  481.876   19.073  459.480   26.722  505.134   27.232  149.056   4.3467  156.298   4.2244 -7.242035 6.061324 
1 1 1    5    9   29 o   92.989   4.3079  179.365   16.520  182.635   23.424  176.129   23.303   93.836   6.0525   92.142   6.1318 1.693436 8.615781 
1 1 1    5    9   30 o   56.927   6.4962   69.035   14.828   62.053   21.189   75.737   20.759   53.597   9.9515   60.256   8.3530 -6.658436 12.99250 
1 1 1    5    9   31 o   58.687   6.5066   72.108   15.748   70.823   22.132   73.427   22.412   58.155   9.2273   59.219   9.1761 -1.064449 13.01327 
1 1 1    5    9   32 o  133.858   4.4024  373.875   23.813  364.456   37.384  380.307   30.892  132.326   6.8498  135.390   5.5321 -3.063980 8.804746 
1 1 1    5    9   33 o   60.432   8.2112   73.436   19.529   56.321   24.201  105.382   33.065   50.458   11.834   70.406   11.387 -19.94796 16.42239 
1 1 1    5    9   34 o   41.942   8.9027   38.379   16.697   33.869   23.518   42.963   23.709   39.831   12.699   44.052   12.481 -4.221077 17.80539 
1 1 1    5    9   35 o   76.336   7.4596  131.224   21.790   97.610   32.827  157.700   29.134   66.173   12.486   86.499   8.1663 -20.32649 14.91911 
1 1 1    5    9   36 o   28.311   8.3857   4.6966   16.599  -1.1923   24.086   10.023   22.907   26.916   11.686   29.706   12.030 -2.789703 16.77137 
1 1 1    5    9   37 o   44.981   8.4010   46.019   16.925   23.779   23.869   68.508   24.002   34.886   12.742   55.076   10.952 -20.19025 16.80201 
1 1 1    5    9   38 o   35.972   8.9410   23.179   17.431   43.624   26.153   6.8379   23.382   43.377   13.330   28.567   11.920 14.81048 17.88190 
1 1 1    5    9   39 o   24.345   7.6959  -8.8010   16.247   4.6814   23.430 -21.2874   22.548   27.616   11.749   21.074   9.9431 6.542423 15.39179 
1 1 1    5    9   40 o   92.577   5.7585  185.704   21.730  192.098   33.583  181.099   28.500   93.598   8.6994   91.555   7.5472 2.042770 11.51693 
1 1 1    5    9   41 o   49.872   8.3309   59.301   17.101   44.527   23.815   75.028   24.572   42.953   12.614   56.791   10.887 -13.83796 16.66184 
1 1 1    5    9   42 o   32.492   9.2048   12.592   19.656   37.152   30.093  -5.6840   25.959   39.329   14.316   25.654   11.574 13.67482 18.40956 
1 1 1    5    9   43 o   27.513   8.1286   5.8765   16.195  -8.6471   22.989   20.185   22.818   23.353   10.675   31.673   12.261 -8.320122 16.25723 
1 1 1    5    9   44 o   22.877   7.4285  -9.6511   16.022  -4.1313   23.123 -14.7487   22.221   24.247   10.933   21.508   10.060 2.738619 14.85697 
1 1 1    5    9   45 o   28.757   8.3809   8.8103   17.558 -12.8517   25.168   29.352   24.508   23.059   10.759   34.454   12.853 -11.39501 16.76181 
1 1 1    5    9   46 o   26.812   8.2722   7.2384   17.281   10.190   24.359   4.2478   24.518   27.560   11.858   26.064   11.537 1.495558 16.54439 
1 1 1    5    9   47 o   44.143   9.6537   58.373   19.595   51.252   31.025   63.099   25.274   40.743   14.575   47.543   12.663 -6.799599 19.30740 
1 1 1    5    9   48 o   25.566   8.4732  -6.1275   22.604 -14.7067   33.873   0.7601   30.350   24.865   11.862   26.267   12.102 -1.402103 16.94639 
1 1 1    5    9   49 o   24.974   8.3190  -7.4448   21.995   6.3689   32.993 -18.4949   29.509   27.402   12.622   22.546   10.840 4.855955 16.63798 
1 1 1    5    9   50 o   36.225   10.112   48.689   22.080   56.360   33.986   43.087   29.045   37.656   14.851   34.794   13.727 2.862411 20.22316 
1 1 1    5   10    0 o  187.354   2.7963  725.075   30.528  725.075   30.528  725.075   30.528  187.354   3.9546  187.354   3.9546 0.000000 0.000000 
1 1 1    5   10    1 o  358.608   3.4286  2667.50   48.327  2611.79   81.413  2697.81   60.051  355.647   5.5502  361.568   4.0269 -5.920410 6.857159 
1 1 1    5   10    2 o   63.762   2.4262   83.434   6.3266   80.619   8.3577   87.212   9.6821   62.511   3.2416   65.014   3.6108 -2.502167 4.852389 
1 1 1    5   10    3 o  363.640   3.6619  2731.69   53.925  2739.84   69.974  2719.77   84.619  364.345   4.6565  362.935   5.6529 1.409546 7.323833 
1 1 1    5   10    4 o  262.033   2.5138  1416.74   26.894  1415.49   41.040  1417.69   35.605  261.923   3.7990  262.142   3.2931 -0.2197266 5.027627 
1 1 1    5   10    5 o  306.707   2.9489  1940.84   37.300  1952.37   53.119  1929.63   52.390  307.604   4.1869  305.809   4.1537 1.795013 5.897703 
1 1 1    5   10    6 o  318.737   3.2330  2108.83   40.461  2054.85   68.234  2138.10   50.248  315.543   5.2430  321.930   3.7843 -6.386993 6.466046 
1 1 1    5   10    7 o  406.892   4.4102  3415.00   73.959  3481.81  107.023  3353.92  102.324  410.694   6.3182  403.091   6.1547 7.603333 8.820432 
1 1 1    5   10    8 o  606.815   5.6160  7562.90  135.926  7440.26  170.968  7773.59  224.094  600.287   6.9054  613.343   8.8585 -13.05597 11.23202 
1 1 1    5   10    9 o  336.537   3.6340  2341.10   49.527  2357.19   64.335  2317.69   77.599  337.984   4.6152  335.091   5.6147 2.892822 7.268058 
1 1 1    5   10   10 o  340.442   2.9104  2391.68   39.522  2392.86   49.910  2389.68   64.714  340.576   3.5531  340.308   4.6106 0.2680359 5.820871 
1 1 1    5   10   11 o  346.565   2.9614  2477.76   41.006  2476.88   51.904  2479.23   66.888  346.503   3.6319  346.628   4.6787 -0.1242371 5.922867 
1 1 1    5   10   12 o  398.107   3.3786  3270.72   54.907  3271.29   72.637  3269.95   83.868  398.167   4.4231  398.046   5.1085 0.1207275 6.757298 
1 1 1    5   10   13 o  409.431   3.8799  3469.82   62.082  3490.42   76.548  3430.25  106.120  411.274   4.5127  407.589   6.3126 3.685608 7.759710 
1 1 1    5   10   14 f  189.142   3.1153  729.333   23.233  708.919   28.703  768.116   39.564  185.367   3.7544  192.918   4.9723 -7.550949 6.230507 
1 1 1    5   10   15 o  444.050   3.3987  4067.26   62.202  4008.26   86.093  4131.68   89.968  440.689   4.7367  447.412   4.8754 -6.722565 6.797493 
1 1 1    5   10   16 o  208.477   2.4570  896.555   21.124  882.970   29.596  910.662   30.160  206.867   3.4688  210.086   3.4807 -3.218521 4.914020 
1 1 1    5   10   17 o  325.117   3.0675  2184.69   40.803  2158.33   61.543  2205.37   54.504  323.345   4.6148  326.889   4.0426 -3.544128 6.135063 
1 1 1    5   10   18 o  385.748   3.1329  3071.68   49.841  3054.42   69.958  3089.48   71.026  384.650   4.4096  386.847   4.4516 -2.197449 6.265891 
1 1 1    5   10   19 o  123.536   2.9231  314.515   14.877  294.755   20.608  336.017   21.498  119.489   4.1816  127.582   4.0855 -8.092819 5.846113 
1 1 1    5   10   20 f  189.663   3.0910  741.350   24.128  763.773   35.497  722.092   32.896  192.318   4.4751  187.008   4.2649 5.309586 6.181911 
1 1 1    5   10   21 o  230.651   2.6674  1098.21   25.373  1078.96   35.686  1117.89   36.084  228.606   3.7848  232.695   3.7597 -4.089111 5.334826 
1 1 1    5   10   22 o  212.201   2.8793  929.897   25.025  928.888   33.468  931.178   37.688  212.089   3.8260  212.312   4.3039 -0.2230682 5.758635 
1 1 1    5   10   23 o  148.218   3.2838  452.291   20.030  426.630   27.248  482.462   29.545  143.666   4.5985  152.770   4.6891 -9.104584 6.567598 
1 1 1    5   10   24 o   68.605   6.1122   98.822   17.044  104.646   22.689   91.281   25.820   71.002   7.7478   66.208   9.4554 4.794395 12.22430 
1 1 1    5   10   25 o  162.350   2.8600  544.508   19.149  554.665   27.326  534.708   26.841  163.838   4.0438  160.863   4.0456 2.974625 5.720066 
1 1 1    5   10   26 o   91.041   3.9512  171.868   14.812  166.400   21.355  176.938   20.561   89.630   5.7766   92.451   5.3923 -2.820488 7.902321 
1 1 1    5   10   27 o   69.404   5.9325  101.748   16.589   93.058   25.758  107.907   21.685   66.750   9.3561   72.057   7.2965 -5.306831 11.86490 
1 1 1    5   10   28 o  111.622   3.6121  257.357   16.609  273.662   24.156  242.736   22.875  114.969   5.0943  108.276   5.1222 6.693115 7.224188 
1 1 1    5   10   29 o   97.419   4.3553  199.465   17.260  229.179   23.901  167.081   24.952  105.159   5.5106   89.679   6.7459 15.48035 8.710627 
1 1 1    5   10   30 o   68.307   6.0176   96.034   16.832  111.491   25.623   84.299   22.325   73.074   8.5014   63.539   8.5189 9.534878 12.03520 
1 1 1    5   10   31 o   72.071   5.4238  108.296   16.120  107.330   22.907  109.244   22.690   71.745   7.7413   72.396   7.5990 -0.6512756 10.84764 
1 1 1    5   10   32 f  109.539   4.5110  249.075   20.330  225.598   28.097  274.872   29.453  104.109   6.5434  114.970   6.2112 -10.86079 9.021965 
1 1 1    5   10   33 o   62.638   8.7983   85.556   21.771   76.966   28.707   97.185   33.402   58.975   12.204   66.301   12.677 -7.326534 17.59653 
1 1 1    5   10   34 o  138.540   3.6536  398.848   20.873  388.765   29.307  409.227   29.736  136.758   5.1959  140.323   5.1379 -3.565140 7.307240 
1 1 1    5   10   35 o   33.462   9.5616   13.483   20.351   10.477   30.847   15.800   27.079   33.410   13.795   33.513   13.244 -0.1023254 19.12323 
1 1 1    5   10   36 o  122.899   3.9854  316.099   20.195  305.109   28.417  327.313   28.704  120.718   5.7075  125.080   5.5641 -4.362053 7.970855 
1 1 1    5   10   37 o   42.957   8.7197   42.026   16.632   54.536   23.980   30.430   23.088   48.539   12.037   37.375   12.619 11.16346 17.43931 
1 1 1    5   10   38 o   88.877   5.4901  168.947   20.082  167.872   29.310  169.897   27.570   88.501   8.0296   89.253   7.4895 -0.7518845 10.98030 
1 1 1    5   10   39 o   82.861   5.2795  148.278   17.975  134.198   25.441  162.311   25.399   78.745   7.8335   86.977   7.0802 -8.232285 10.55900 
1 1 1    5   10   40 o   52.508   7.8092   64.057   16.744   82.280   24.103   47.060   23.279   60.811   9.6099   44.205   12.312 16.60608 15.61832 
1 1 1    5   10   41 o   38.627   9.3608   27.470   18.648   9.1048   23.305   60.160   31.093   28.578   11.910   48.677   14.444 -20.09936 18.72151 
1 1 1    5   10   42 o   25.809   8.3180 -10.6299   19.587   1.1715   29.190 -20.2958   26.417   28.589   12.625   23.029   10.834 5.560173 16.63604 
1 1 1    5   10   43 o   40.903   8.9797   42.305   16.733   43.891   23.970   40.797   23.369   41.577   12.759   40.229   12.640 1.347698 17.95938 
1 1 1    5   10   44 o   25.861   8.0305   2.6150   16.532  -0.9395   24.117   5.7655   22.705   25.288   11.302   26.434   11.411 -1.145960 16.06099 
1 1 1    5   10   45 o   34.193   9.1720   28.623   17.809   32.917   26.050   24.854   24.401   35.735   13.267   32.652   12.669 3.082691 18.34395 
1 1 1    5   10   46 o   25.762   8.1111   3.6817   17.400   6.0385   24.790   1.3931   24.429   26.385   11.644   25.139   11.295 1.245562 16.22221 
1 1 1    5   10   47 o   24.394   7.4588 -15.7921   17.145 -65.0464   25.010   27.875   23.549   16.150   8.1370   32.639   12.503 -16.48869 14.91768 
1 1 1    5   10   48 o   25.307   8.4058  -6.6211   22.319   3.2067   32.584 -15.3088   30.635   27.048   12.489   23.567   11.254 3.480930 16.81154 
1 1 1    5   10   49 o   27.264   8.6586  -7.7662   22.225   43.778   33.446 -48.5238   29.741   35.380   14.458   19.148   9.5317 16.23189 17.31717 
1 1 1    5   10   50 o   30.339   9.2522   27.418   21.812   12.693   32.444   39.563   29.465   27.280   12.548   33.399   13.600 -6.119139 18.50448 
1 1 1    5   11    0 o  131.316   2.5563  356.482   19.546  356.482   19.546  356.482   19.546  131.316   3.6151  131.316   3.6151 0.000000 0.000000 
1 1 1    5   11    1 o  162.545   2.3547  549.937   14.995  529.105   25.321  561.188   18.609  160.145   3.8335  164.945   2.7353 -4.800720 4.709336 
1 1 1    5   11    2 o  325.484   2.8557  2189.36   38.108  2150.48   56.812  2221.17   51.382  322.844   4.2666  328.124   3.7967 -5.280670 5.711330 
1 1 1    5   11    3 o  386.930   3.0533  3105.22   47.830  3000.68   74.515  3178.48   62.376  381.343   4.7376  392.517   3.8530 -11.17371 6.106617 
1 1 1    5   11    4 o  298.291   2.5956  1841.30   31.102  1809.83   49.799  1861.42   39.823  296.183   4.0766  300.399   3.2142 -4.215240 5.191292 
1 1 1    5   11    5 o  555.245   4.5872  6364.48  105.049  6363.19  148.624  6365.77  148.501  555.189   6.4906  555.302   6.4839 -0.1129150 9.174311 
1 1 1    5   11    6 o   97.727   2.6057  193.791   9.8015  205.955   17.568  188.294   11.811   99.911   4.2632   95.543   2.9972 4.368210 5.211331 
1 1 1    5   11    7 o  357.893   3.6600  2644.49   53.191  2649.24   69.427  2637.73   82.764  358.307   4.6979  357.479   5.6134 0.8277283 7.319914 
1 1 1    5   11    8 o  121.670   2.2922  302.958   10.957  297.605   13.510  313.246   18.729  120.118   2.7270  123.223   3.6852 -3.105202 4.584441 
1 1 1    5   11    9 o  854.201   7.6483 14992.32  259.604 15472.30  432.261 14721.53  324.679  864.480   12.123  843.922   9.3280 20.55786 15.29669 
1 1 1    5   11   10 o  175.705   2.3651  639.136   16.887  650.761   22.176  623.091   26.054  177.618   3.0272  173.791   3.6348 3.826904 4.730273 
1 1 1    5   11   11 o  293.479   2.8073  1778.03   33.681  1784.48   44.799  1769.64   51.080  294.101   3.6932  292.857   4.2289 1.244446 5.614577 
1 1 1    5   11   12 o  397.349   3.3675  3260.26   54.688  3273.13   72.693  3243.47   83.013  398.272   4.4253  396.425   5.0771 1.847015 6.735034 
1 1 1    5   11   13 o  433.069   4.2656  3872.22   74.551  3871.95   95.995  3872.63  118.338  433.103   5.3740  433.035   6.6258 0.6838989E-01 8.531139 
1 1 1    5   11   14 o  111.440   3.5373  259.369   15.598  267.629   19.648  245.292   25.648  113.883   4.1831  108.996   5.7053 4.886406 7.074512 
1 1 1    5   11   15 o  292.897   2.7256  1771.41   31.838  1774.68   40.214  1765.93   52.118  293.283   3.3245  292.511   4.3200 0.7723083 5.451131 
1 1 1    5   11   16 o  283.517   2.6406  1658.70   30.877  1650.65   43.451  1666.91   43.886  282.822   3.7250  284.211   3.7439 -1.388794 5.281296 
1 1 1    5   11   17 o  232.306   2.8909  1113.71   27.690  1121.02   39.736  1106.82   38.607  233.044   4.1341  231.568   4.0422 1.475922 5.781899 
1 1 1    5   11   18 o  158.628   2.6206  519.358   17.144  518.722   24.385  519.980   24.108  158.531   3.7294  158.725   3.6826 -0.1937256 5.241150 
1 1 1    5   11   19 o  200.154   2.5935  826.891   21.410  830.116   30.326  823.686   30.229  200.543   3.6664  199.765   3.6690 0.7783813 5.186926 
1 1 1    5   11   20 o  248.255   2.8767  1267.86   29.090  1243.44   38.080  1302.09   45.080  245.418   3.7620  251.093   4.3529 -5.675003 5.753341 
1 1 1    5   11   21 o  132.296   3.2426  357.244   17.405  385.061   27.604  338.886   22.425  136.502   4.9030  128.090   4.2448 8.411728 6.485186 
1 1 1    5   11   22 o   80.227   4.2467  135.851   13.689  101.682   19.502  169.045   19.221   70.046   6.7502   90.409   5.1547 -20.36220 8.493302 
1 1 1    5   11   23 o  173.205   3.0977  619.952   22.128  619.310   31.105  620.609   31.485  173.116   4.3563  173.293   4.4051 -0.1773987 6.195409 
1 1 1    5   11   24 o  290.288   3.0741  1742.73   36.482  1732.46   55.299  1750.65   48.544  289.488   4.6315  291.089   4.0434 -1.601074 6.148124 
1 1 1    5   11   25 o  205.002   2.9424  868.208   24.712  864.860   33.059  872.447   37.204  204.581   3.9180  205.423   4.3911 -0.8422546 5.884889 
1 1 1    5   11   26 o   76.782   5.1808  120.092   16.244  141.655   25.171  104.703   21.264   82.568   7.3912   70.996   7.2619 11.57256 10.36165 
1 1 1    5   11   27 o  131.963   3.2205  358.962   17.496  387.461   25.610  334.016   23.960  136.859   4.5370  127.067   4.5718 9.792000 6.440943 
1 1 1    5   11   28 o  239.115   3.0322  1180.48   29.619  1167.84   39.175  1197.34   45.256  237.669   3.9964  240.560   4.5613 -2.890732 6.064396 
1 1 1    5   11   29 o   57.799   6.2230   69.660   14.820   74.134   21.419   65.551   20.526   59.584   8.7157   56.015   8.8847 3.568882 12.44591 
1 1 1    5   11   30 o   73.679   6.1198  111.691   17.919  159.429   27.225   75.203   23.801   87.474   7.5461   59.884   9.6366 27.58949 12.23955 
1 1 1    5   11   31 o   69.974   5.7939  102.846   16.572   86.995   23.385  118.836   23.487   64.460   8.7961   75.488   7.5435 -11.02892 11.58778 
1 1 1    5   11   32 o   65.459   6.6304   92.246   17.074  114.738   24.361   70.532   23.936   74.036   7.9780   56.882   10.592 17.15386 13.26077 
1 1 1    5   11   33 o   50.683   9.4543   53.407   21.692   23.090   28.947   92.238   32.760   36.958   13.933   64.408   12.783 -27.44938 18.90855 
1 1 1    5   11   34 o   24.622   7.8474 -11.4446   17.015  -3.9918   23.366 -19.8579   24.826   25.979   11.389   23.265   10.798 2.713627 15.69478 
1 1 1    5   11   35 o   27.996   8.0232  -2.2362   16.423   24.555   23.617 -27.3239   22.854   35.427   12.712   20.565   9.7923 14.86279 16.04631 
1 1 1    5   11   36 o  115.211   4.1164  278.657   19.529  259.358   27.483  298.340   27.755  111.119   5.9967  119.303   5.6407 -8.183708 8.232745 
1 1 1    5   11   37 o   56.681   7.5233   72.586   16.919   72.326   24.589   72.819   23.316   56.442   10.958   56.921   10.311 -0.4787178 15.04656 
1 1 1    5   11   38 o   33.731   8.7790   21.266   16.695   9.3053   23.668   33.110   23.552   29.226   12.077   38.237   12.745 -9.011356 17.55808 
1 1 1    5   11   39 o   21.091   7.0637 -26.0909   16.644 -40.0305   23.340 -11.6682   23.741   18.611   9.1053   23.570   10.802 -4.958548 14.12736 
1 1 1    5   11   40 o   44.646   8.5268   48.149   16.517   34.743   23.766   60.675   22.972   38.538   12.801   50.754   11.268 -12.21588 17.05351 
1 1 1    5   11   41 o   59.514   8.9425   84.570   21.757   62.309   29.072  112.912   32.803   49.484   13.750   69.543   11.437 -20.05851 17.88493 
1 1 1    5   11   42 o   31.531   8.7724   17.862   16.929   26.118   24.586   10.418   23.346   34.421   12.867   28.641   11.927 5.780052 17.54474 
1 1 1    5   11   43 o   81.480   5.3904  146.656   18.098  145.912   26.113  147.343   25.104   81.153   7.8018   81.806   7.4403 -0.6536484 10.78082 
1 1 1    5   11   44 o   49.405   8.5811   63.098   17.354   63.051   24.899   63.141   24.201   49.249   12.296   49.560   11.973 -0.3107910 17.16216 
1 1 1    5   11   45 f   51.467   8.2872   68.733   17.199   71.663   23.846   65.557   24.829   53.091   11.240   49.844   12.181 3.247665 16.57447 
1 1 1    5   11   46 o   24.656   7.7884  -5.6192   17.455 -29.7129   24.820   17.957   24.552   19.756   9.6040   29.557   12.264 -9.800898 15.57680 
1 1 1    5   11   47 o   31.755   8.8594   24.836   17.666   13.035   24.926   36.748   25.042   27.844   11.988   35.666   13.048 -7.821739 17.71884 
1 1 1    5   11   48 o   27.797   9.4450  -6.3334   29.150  -7.6068   34.695  -3.2771   53.750   25.760   12.208   29.835   14.415 -4.074209 18.89003 
1 1 1    5   11   49 o   28.106   9.6362 -23.7582   27.495 -55.4467   31.908   67.626   54.185   19.205   9.6082   37.007   16.706 -17.80177 19.27235 
1 1 1    5   11   50 o   24.497   8.4551 -14.0602   26.653 -55.3957   56.375  -2.1611   30.247   24.718   12.423   24.275   11.473 0.4431515 16.91017 
1 1 1    5   12    0 o  117.101   2.2303  283.436   15.209  283.436   15.209  283.436   15.209  117.101   3.1541  117.101   3.1541 0.000000 0.000000 
1 1 1    5   12    1 o  685.777   6.1316  9739.47  171.085  9584.46  263.472  9852.48  224.968  680.930   9.3814  690.623   7.8979 -9.692688 12.26325 
1 1 1    5   12    2 o  400.749   3.9264  3325.52   64.121  3242.49   97.939  3387.80   84.828  396.329   5.9915  405.169   5.0762 -8.840027 7.852731 
1 1 1    5   12    3 o  275.691   2.7718  1548.55   31.188  1699.25   48.485  1442.19   40.733  286.984   4.0962  264.397   3.7353 22.58704 5.543580 
1 1 1    5   12    4 o  287.669   2.5397  1715.83   29.517  1663.03   46.322  1751.93   38.299  283.912   3.9558  291.425   3.1864 -7.513336 5.079493 
1 1 1    5   12    5 o  441.667   4.6527  4019.93   84.562  4138.65  124.563  3918.45  115.166  447.689   6.7460  435.645   6.4095 12.04468 9.305404 
1 1 1    5   12    6 f  700.859   6.3399 10110.64  177.696 10320.52  290.550  9985.24  224.597  706.463   9.9716  695.256   7.8324 11.20654 12.67989 
1 1 1    5   12    7 f  117.319   3.0658  283.325   14.036  281.960   17.233  286.017   24.192  116.910   3.5739  117.729   4.9823 -0.8191376 6.131543 
1 1 1    5   12    8 o  612.428   5.0187  7737.94  126.610  7890.82  184.435  7601.69  174.116  618.126   7.2344  606.729   6.9579 11.39679 10.03736 
1 1 1    5   12    9 o  274.007   2.6951  1552.98   30.300  1592.08   41.116  1506.51   44.826  277.799   3.5885  270.216   4.0221 7.582367 5.390218 
1 1 1    5   12   10 o   94.321   3.9161  184.902   15.076  215.607   21.327  154.235   21.314  102.209   5.0591   86.433   5.9789 15.77590 7.832145 
1 1 1    5   12   11 o   64.316   2.9690   83.692   7.5020   80.144   9.2013   90.727   12.957   62.327   3.5793   66.305   4.7379 -3.977501 5.937967 
1 1 1    5   12   12 o  344.819   4.2284  2493.79   46.869  2517.52   52.103  2393.19  107.300  349.318   3.6164  340.319   7.6445 8.998688 8.456732 
1 1 1    5   12   13 o  415.046   5.1963  3547.00   76.750  3534.47   88.396  3585.38  154.704  413.780   5.1796  416.312   9.0099 -2.532440 10.39258 
1 1 1    5   12   14 o  161.382   2.4835  542.597   16.283  572.443   21.614  503.431   24.760  166.572   3.1461  156.192   3.8435 10.38008 4.966919 
1 1 1    5   12   15 o  113.473   3.5046  281.872   13.909  298.137   16.161  235.399   27.317  120.206   3.2596  106.739   6.2051 13.46679 7.009195 
1 1 1    5   12   16 o  199.941   2.6723  819.719   21.780  791.920   28.483  858.861   33.798  195.896   3.5252  203.987   4.0171 -8.090973 5.344597 
1 1 1    5   12   17 o  177.730   2.6726  650.685   19.465  640.895   25.996  663.179   29.366  176.220   3.5767  179.241   3.9723 -3.021072 5.345283 
1 1 1    5   12   18 o  122.639   2.9378  310.644   14.847  294.828   20.946  326.613   21.048  119.497   4.2500  125.780   4.0573 -6.283195 5.875667 
1 1 1    5   12   19 o  270.048   2.6852  1505.46   29.906  1496.68   42.032  1514.46   42.559  269.252   3.7849  270.844   3.8098 -1.592194 5.370307 
1 1 1    5   12   20 o  213.589   2.8128  941.292   24.558  936.313   32.585  947.839   37.365  212.954   3.7099  214.223   4.2289 -1.269012 5.625587 
1 1 1    5   12   21 o  177.602   3.1017  652.597   22.692  622.709   32.350  681.550   31.839  173.582   4.5185  181.621   4.2504 -8.038528 6.203437 
1 1 1    5   12   22 o   48.643   6.7969   50.925   13.303   33.164   18.521   69.853   19.120   39.289   10.996   57.998   7.9928 -18.70961 13.59379 
1 1 1    5   12   23 o  175.036   2.9001  632.745   20.790  635.154   31.336  630.850   27.786  175.314   4.3337  174.758   3.8551 0.5569153 5.800202 
1 1 1    5   12   24 o   41.257   7.7972   36.899   13.379   36.059   21.005   37.472   17.354   40.978   11.793   41.535   10.204 -0.5568771 15.59445 
1 1 1    5   12   25 o  187.130   3.1008  722.802   23.452  718.046   30.240  729.978   37.148  186.406   3.9333  187.854   4.7946 -1.448105 6.201553 
1 1 1    5   12   26 o   91.274   4.6280  171.365   17.314  186.375   26.335  159.939   22.977   94.745   6.7392   87.803   6.3449 6.942566 9.256057 
1 1 1    5   12   27 o  178.596   2.8921  658.915   21.293  677.625   30.705  641.581   29.554  181.034   4.1123  176.158   4.0677 4.875519 5.784218 
1 1 1    5   12   28 o   79.810   4.7730  135.420   15.302  103.545   22.138  164.582   21.175   70.526   7.6106   89.094   5.7625 -18.56766 9.546071 
1 1 1    5   12   29 o  134.900   3.3769  376.839   18.786  383.545   26.528  370.094   26.606  136.110   4.7255  133.691   4.8252 2.419235 6.753702 
1 1 1    5   12   30 o   64.474   6.3495   87.314   16.810   91.055   23.049   83.063   24.570   66.007   8.4665   62.940   9.4649 3.067276 12.69905 
1 1 1    5   12   31 o  161.099   3.8663  534.290   25.403  510.659   33.217  567.584   39.427  156.906   5.1328  165.292   5.7833 -8.385818 7.732520 
1 1 1    5   12   32 o   64.099   6.3744   86.513   16.852   86.586   23.936   86.442   23.729   64.120   9.0510   64.077   8.9785 0.4280090E-01 12.74889 
1 1 1    5   12   33 o   39.002   9.1812   31.895   17.320   25.785   27.259   36.031   22.429   37.348   13.621   40.655   12.315 -3.306671 18.36235 
1 1 1    5   12   34 o   50.655   10.810   44.845   25.731   15.279   31.585  103.193   44.371   35.072   14.153   66.237   16.342 -31.16528 21.61904 
1 1 1    5   12   35 o   45.984   8.6924   48.292   16.829   51.393   23.765   45.173   23.834   47.451   12.104   44.517   12.479 2.934322 17.38489 
1 1 1    5   12   36 o   30.356   8.4921   12.574   16.105   3.8963   23.275   20.546   22.307   27.666   11.738   33.047   12.275 -5.380795 16.98420 
1 1 1    5   12   37 o   75.140   5.5701  120.825   17.245  119.078   24.832  122.452   23.968   74.546   8.0764   75.734   7.6730 -1.187523 11.14020 
1 1 1    5   12   38 o   49.793   7.8932   56.227   16.836   29.779   22.731   88.365   25.058   36.419   12.518   63.167   9.6180 -26.74817 15.78649 
1 1 1    5   12   39 o   28.537   8.4760  -4.1075   18.307   27.100   28.075 -27.1934   24.147   36.176   13.701   20.899   9.9828 15.27705 16.95203 
1 1 1    5   12   40 o   31.725   8.6928   18.219   16.293   22.682   23.405   14.022   22.696   33.421   12.542   30.029   12.040 3.392319 17.38558 
1 1 1    5   12   41 o   38.178   10.426   33.013   23.248   17.620   42.117   39.758   27.879   36.168   15.577   40.187   13.861 -4.018696 20.85119 
1 1 1    5   12   42 o   24.167   7.7067  -5.5112   16.260  -0.0227   23.825 -10.2962   22.246   25.761   11.389   22.574   10.386 3.187122 15.41348 
1 1 1    5   12   43 o   39.029   9.0077   38.804   16.996   47.729   23.972   29.783   24.100   42.925   12.669   35.134   12.808 7.791134 18.01539 
1 1 1    5   12   44 o   77.168   5.6425  134.757   17.958  135.653   25.552  133.883   25.243   77.400   8.0041   76.935   7.9552 0.4648361 11.28493 
1 1 1    5   12   45 o   27.453   8.2697   5.4186   17.491   26.808   25.503 -13.5775   24.034   32.875   12.897   22.032   10.355 10.84239 16.53940 
1 1 1    5   12   46 f   39.747   9.7414   46.757   19.414   47.434   29.395   46.233   25.854   39.635   14.186   39.858   13.354 -0.2233467 19.48282 
1 1 1    5   12   47 f   27.227   8.9831   0.4303   24.031  -9.9838   42.680   5.2641   29.077   27.687   13.238   26.767   12.146 0.9199543 17.96628 
1 1 1    5   12   48 o   32.950   10.960   9.4362   38.833 -46.5277   51.685   81.985   58.847   25.670   12.742   40.230   17.837 -14.55991 21.92095 
1 1 1    5   12   49 o   23.567   7.9296  -7.9254   21.198 -16.1373   32.286  -1.7026   28.105   23.098   11.163   24.035   11.265 -0.9370289 15.85917 
1 1 1    5   13    0 o   96.859   2.4565  194.247   13.838  194.247   13.838  194.247   13.838   96.859   3.4740   96.859   3.4740 0.000000 0.000000 
1 1 1    5   13    1 o  421.113   3.6845  3655.03   63.897  3578.90   87.610  3741.55   93.397  416.441   5.1008  425.786   5.3183 -9.344940 7.369002 
1 1 1    5   13    2 o  242.817   2.9145  1199.78   28.102  1277.04   47.195  1157.34   34.979  248.777   4.5996  236.858   3.5805 11.91916 5.828973 
1 1 1    5   13    3 o  490.324   3.8800  4946.02   77.160  5048.30  121.218  4876.35  100.047  494.537   5.9430  486.110   4.9900 8.426941 7.760096 
1 1 1    5   13    4 o  430.221   3.3035  3840.81   57.721  3688.99   88.849  3951.68   75.926  422.799   5.0951  437.642   4.2063 -14.84348 6.607085 
1 1 1    5   13    5 o  173.655   2.7664  607.407   19.571  525.485   25.405  726.978   30.693  159.596   3.8596  187.715   3.9644 -28.11835 5.532870 
1 1 1    5   13    6 o  121.844   2.6358  297.396   13.033  359.015   20.827  257.740   16.708  131.915   3.8280  111.773   3.6243 20.14161 5.271552 
1 1 1    5   13    7 o  432.089   3.5510  3829.78   61.894  3963.49   99.172  3744.46   79.216  438.196   5.4872  425.981   4.5087 12.21515 7.102004 
1 1 1    5   13    8 o  494.791   4.7230  5053.54   94.212  5045.10  121.025  5066.51  150.091  494.340   5.9358  495.242   7.3481 -0.9015808 9.446058 
1 1 1    5   13    9 o  575.493   4.2480  6848.40   97.977  6883.22  124.788  6792.44  158.205  577.482   5.2392  573.504   6.6883 3.978333 8.496076 
1 1 1    5   13   10 o  501.208   4.2687  5177.96   88.061  5318.17  129.418  5057.07  120.170  507.501   6.1829  494.915   5.8871 12.58530 8.537333 
1 1 1    5   13   11 o  246.753   2.4775  1260.18   24.423  1272.48   30.991  1240.01   39.676  248.361   3.0254  245.144   3.9241 3.217239 4.954941 
1 1 1    5   13   12 o   28.157   6.0712   16.428   7.6928   16.810   10.927   16.053   10.832   28.426   8.5920   27.887   8.5799 0.5391083 12.14239 
1 1 1    5   13   13 o  317.058   2.9251  2076.80   37.821  2088.77   49.961  2060.74   57.884  318.148   3.8075  315.967   4.4417 2.180878 5.850277 
1 1 1    5   13   14 o  261.036   2.7134  1405.47   28.857  1401.38   37.937  1411.09   44.453  260.600   3.5296  261.471   4.1221 -0.8715515 5.426731 
1 1 1    5   13   15 o  435.907   4.1380  3928.96   69.947  3934.45   85.473  3917.82  121.706  436.513   4.7475  435.301   6.7789 1.211670 8.275983 
1 1 1    5   13   16 o  233.512   2.9284  1123.89   28.180  1171.69   40.878  1080.60   38.899  238.235   4.1603  228.790   4.1223 9.445496 5.856707 
1 1 1    5   13   17 o  387.335   4.7011  3170.34   64.161  3235.56   74.014  2973.13  128.703  395.830   4.5336  378.839   8.2370 16.99030 9.402200 
1 1 1    5   13   18 o  565.630   5.0953  6568.65  110.151  6478.31  132.389  6771.86  198.565  559.776   5.7342  571.483   8.4243 -11.70697 10.19067 
1 1 1    5   13   19 o  273.968   2.7112  1549.30   30.629  1572.72   43.895  1527.07   42.759  275.983   3.8563  271.952   3.8121 4.031281 5.422489 
1 1 1    5   13   20 o  256.149   2.8494  1355.28   29.898  1356.15   44.992  1354.60   40.010  256.197   4.2579  256.101   3.7879 0.9637451E-01 5.698879 
1 1 1    5   13   21 o  170.911   3.0213  603.588   21.297  609.387   30.153  597.815   30.084  171.731   4.2572  170.090   4.2884 1.640732 6.042674 
1 1 1    5   13   22 o  101.634   3.7980  213.648   15.907  214.863   23.004  212.535   22.020  101.905   5.4733  101.364   5.2671 0.5411911 7.596021 
1 1 1    5   13   23 o  177.138   2.7282  648.364   19.931  640.657   28.258  655.993   28.115  176.088   3.8908  178.189   3.8255 -2.100861 5.456473 
1 1 1    5   13   24 o   59.774   5.4285   73.694   13.316   84.844   19.733   64.371   18.045   63.905   7.4867   55.643   7.8627 8.262489 10.85695 
1 1 1    5   13   25 o  212.037   3.0673  931.706   26.462  942.146   34.792  917.379   40.758  213.499   3.9511  210.575   4.6929 2.923553 6.134700 
1 1 1    5   13   26 o  209.137   3.3024  898.673   27.395  882.435   34.180  927.840   45.810  206.605   4.0111  211.670   5.2472 -5.064438 6.604743 
1 1 1    5   13   27 o   91.822   4.0949  175.244   15.458  159.678   21.922  190.637   21.800   87.733   6.0584   95.911   5.5109 -8.177643 8.189838 
1 1 1    5   13   28 o  120.383   3.5112  299.761   17.418  318.344   25.065  282.409   24.221  123.994   4.9012  116.773   5.0290 7.220131 7.022308 
1 1 1    5   13   29 o   42.520   8.0199   38.627   14.950   55.684   21.626   23.013   20.691   50.517   10.712   34.523   11.939 15.99430 16.03988 
1 1 1    5   13   30 o   97.452   4.5312  196.016   17.888  149.440   24.196  252.163   26.566   84.710   6.9253  110.193   5.8452 -25.48268 9.062347 
1 1 1    5   13   31 o   93.853   5.3525  180.191   20.487  213.761   31.968  156.795   26.688  101.094   7.6670   86.613   7.4707 14.48121 10.70491 
1 1 1    5   13   32 o  136.259   3.5972  385.839   20.207  373.059   28.590  398.597   28.565  133.987   5.1735  138.532   4.9995 -4.545105 7.194442 
1 1 1    5   13   33 f  152.944   3.4662  486.279   21.834  452.823   30.644  520.775   31.116  147.567   5.0349  158.321   4.7652 -10.75366 6.932349 
1 1 1    5   13   34 o   76.837   10.429  127.441   33.052  127.441   33.052   0.0000   0.0000   76.837   10.429  ?   ?       ?      ? 
1 1 1    5   13   35 o  114.146   4.0841  273.323   19.198  274.108   27.946  272.621   26.420  114.248   5.9306  114.044   5.6168 0.2044220 8.168271 
1 1 1    5   13   36 o   21.203   7.0401 -20.1830   15.646 -19.2075   22.290 -21.1304   21.966   21.486   10.058   20.920   9.8533 0.5662842 14.08022 
1 1 1    5   13   37 o   38.877   8.7265   34.292   16.197   23.319   23.101   44.904   22.717   34.052   12.521   43.701   12.159 -9.649612 17.45304 
1 1 1    5   13   38 o   59.125   7.3531   80.735   17.183   62.534   24.588   98.111   24.024   51.326   11.854   66.925   8.7033 -15.59970 14.70615 
1 1 1    5   13   39 o   58.559   7.6642   76.935   17.947   98.512   27.632   61.189   23.604   66.286   10.107   50.832   11.524 15.45387 15.32837 
1 1 1    5   13   40 o   69.064   6.2718  106.371   17.524  131.992   25.260   82.597   24.332   77.637   7.8884   60.491   9.7526 17.14598 12.54357 
1 1 1    5   13   41 o   40.162   10.422   40.425   23.074   17.135   44.358   49.065   27.017   36.410   15.833   43.914   13.557 -7.504280 20.84393 
1 1 1    5   13   42 o   45.766   9.5615   54.467   18.969   54.280   23.902   54.785   31.178   46.376   12.296   45.156   14.645 1.219883 19.12296 
1 1 1    5   13   43 o   57.538   7.7349   82.759   17.667   56.899   25.146  107.967   24.827   46.430   12.744   68.647   8.7690 -22.21682 15.46973 
1 1 1    5   13   44 o   25.400   8.0902  -1.8033   18.161   7.4489   23.157 -16.5867   29.271   26.711   11.527   24.090   11.355 2.620827 16.18042 
1 1 1    5   13   45 o   33.114   9.6680   0.1559   21.159   74.776   40.956 -27.0129   24.713   46.151   16.716   20.077   9.7184 26.07451 19.33599 
1 1 1    5   13   46 o   30.116   8.5852   9.5622   19.811 -30.5234   28.835   45.398   27.264   21.325   10.363   38.906   13.690 -17.58096 17.17040 
1 1 1    5   13   47 f   29.702   9.2863   16.793   22.428   28.505   33.229   6.9937   30.396   32.234   13.859   27.171   12.364 5.063265 18.57259 
1 1 1    5   13   48 o   25.774   8.9263 -19.3428   26.812   8.0267   51.876 -29.3192   31.320   29.944   14.391   21.605   10.565 8.338627 17.85251 
1 1 1    5   13   49 o   28.450   8.9167   14.574   21.233   42.684   32.474  -6.4167   28.062   33.806   14.072   23.095   10.955 10.71055 17.83333 
1 1 1    5   14    0 o  386.411   2.9907  3081.11   67.389  3081.11   67.389  3081.11   67.389  386.411   4.2295  386.411   4.2295 0.000000 0.000000 
1 1 1    5   14    1 o  511.196   4.2863  5391.08   90.292  5306.78  124.680  5484.04  130.935  507.007   5.9623  515.386   6.1597 -8.378998 8.572681 
1 1 1    5   14    2 o  224.314   3.0845  1037.97   28.533  1060.80   40.718  1015.94   39.995  226.737   4.3541  221.891   4.3702 4.846390 6.169025 
1 1 1    5   14    3 o  672.345   4.8673  9320.84  129.996  9392.18  215.413  9279.97  163.028  674.234   7.7463  670.457   5.8956 3.776794 9.734650 
1 1 1    5   14    4 o  285.510   2.5241  1689.72   29.102  1641.34   45.760  1722.58   37.711  282.050   3.9337  288.971   3.1641 -6.920959 5.048297 
1 1 1    5   14    5 o  469.031   4.8822  4516.42   93.783  4762.71  142.765  4329.47  124.385  480.180   7.2086  457.882   6.5864 22.29840 9.764482 
1 1 1    5   14    6 o  360.485   3.0694  2687.09   45.478  2758.81   62.281  2605.16   66.563  365.659   4.1296  355.310   4.5421 10.34882 6.138814 
1 1 1    5   14    7 o  227.222   2.8723  1056.51   26.058  1099.78   42.978  1031.36   32.768  230.857   4.5137  223.588   3.5533 7.268341 5.744535 
1 1 1    5   14    8 o  226.059   2.6472  1051.60   24.640  1100.97   36.150  1008.76   33.674  231.000   3.7943  221.118   3.6923 9.881760 5.294346 
1 1 1    5   14    9 o  463.666   3.5627  4450.57   66.368  4495.76   84.991  4379.94  106.242  466.742   4.4150  460.590   5.5926 6.152100 7.125310 
1 1 1    5   14   10 o  324.862   3.4079  2169.97   42.463  2155.54   51.267  2201.51   75.782  323.205   3.8459  326.519   5.6272 -3.314178 6.815879 
1 1 1    5   14   11 o  309.621   2.8768  1983.18   36.504  2023.53   49.225  1933.87   54.414  313.143   3.8113  306.098   4.3101 7.044281 5.753534 
1 1 1    5   14   12 o  183.597   2.8832  692.371   21.392  679.541   27.498  712.039   34.045  181.467   3.6740  185.727   4.4444 -4.260025 5.766371 
1 1 1    5   14   13 o   96.750   2.8633  192.957   11.387  190.306   15.434  196.125   16.870   96.025   3.8970   97.475   4.1962 -1.450714 5.726624 
1 1 1    5   14   14 o   90.790   2.8675  168.248   10.501  161.508   13.389  179.020   16.926   88.462   3.6698   93.118   4.4072 -4.656105 5.735086 
1 1 1    5   14   15 o  488.905   4.3480  4942.41   78.809  4944.23   92.957  4937.78  148.606  489.319   4.6060  488.491   7.3759 0.8278503 8.695919 
1 1 1    5   14   16 o  447.257   4.1844  4128.64   72.492  4116.05   88.394  4154.48  126.688  446.402   4.8010  448.111   6.8546 -1.708801 8.368714 
1 1 1    5   14   17 o  262.905   2.6700  1426.20   27.875  1424.08   34.968  1429.89   46.170  262.677   3.2276  263.133   4.2542 -0.4558716 5.340016 
1 1 1    5   14   18 o  172.889   2.5714  611.559   17.475  599.183   21.549  635.332   29.866  170.386   3.0664  175.392   4.1286 -5.006042 5.142774 
1 1 1    5   14   19 o  125.045   3.0738  325.055   15.755  356.136   21.893  291.666   22.691  131.300   4.0427  118.791   4.6314 12.50932 6.147617 
1 1 1    5   14   20 o  409.944   3.2853  3473.78   55.545  3479.81   78.936  3467.87   78.173  410.292   4.6646  409.596   4.6274 0.6965942 6.570507 
1 1 1    5   14   21 o   51.188   6.7218   57.835   13.390   45.892   20.973   66.053   17.397   45.955   11.173   56.421   7.4759 -10.46598 13.44364 
1 1 1    5   14   22 o   82.883   4.8151  140.593   15.998  150.395   26.260  134.808   20.173   85.100   7.4816   80.666   6.0635 4.434166 9.630147 
1 1 1    5   14   23 o   86.702   4.2858  154.709   15.177  148.553   19.948  163.173   23.389   84.692   5.7106   88.713   6.3922 -4.021713 8.571539 
1 1 1    5   14   24 f   29.992   8.0483   13.572   13.663   13.361   18.404   13.831   20.393   29.428   11.106   30.556   11.652 -1.127413 16.09665 
1 1 1    5   14   25 o  201.494   4.5142  829.573   32.423  868.154   65.700  817.152   37.279  204.239   7.7994  198.749   4.5477 5.490494 9.028453 
1 1 1    5   14   26 o  157.063   3.1440  508.110   20.250  530.355   30.569  490.715   27.032  160.092   4.6296  154.034   4.2550 6.058044 6.287966 
1 1 1    5   14   27 f   73.874   4.9320  114.855   14.822  102.260   22.068  125.206   20.007   70.080   7.6350   77.668   6.2454 -7.588440 9.864012 
1 1 1    5   14   28 o   45.272   7.9137   44.538   14.774   53.589   21.575   36.547   20.272   49.521   10.862   41.022   11.512 8.498863 15.82743 
1 1 1    5   14   29 o   86.841   4.6486  156.953   16.623  154.436   24.097  159.239   22.961   86.153   6.7814   87.529   6.3601 -1.376251 9.297254 
1 1 1    5   14   30 f   67.376   6.2476   96.084   17.203  107.963   23.943   83.408   24.734   71.814   8.0837   62.938   9.5281 8.875408 12.49526 
1 1 1    5   14   31 o   57.708   7.5416   72.963   17.292   65.416   26.136   78.839   23.061   54.278   11.994   61.137   9.1455 -6.858673 15.08310 
1 1 1    5   14   32 o  107.456   4.2468  242.131   18.666  207.471   26.476  276.383   26.320   99.678   6.4400  115.233   5.5378 -15.55574 8.493602 
1 1 1    5   14   33 o   64.990   8.0220   98.951   19.577   73.339   31.866  114.479   24.812   56.459   13.801   73.521   8.1825 -17.06143 16.04409 
1 1 1    5   14   34 o  170.721   4.5141  605.745   30.581  587.599   38.100  638.604   51.271  167.585   5.5122  173.857   7.1502 -6.272537 9.028236 
1 1 1    5   14   35 o   62.666   6.6801   86.904   16.673   76.542   24.255   96.186   22.956   58.367   10.460   66.965   8.3118 -8.597477 13.36015 
1 1 1    5   14   36 o  111.711   4.9301  268.312   21.860  278.523   27.749  251.610   35.488  115.023   5.8492  108.398   7.9378 6.625404 9.860127 
1 1 1    5   14   37 o   44.103   8.7038   46.501   16.473   42.733   23.302   50.267   23.291   42.316   12.491   45.890   12.124 -3.573891 17.40752 
1 1 1    5   14   38 o   25.789   8.0897  -4.2037   17.376 -12.9316   24.712   4.3304   24.437   23.792   10.946   27.786   11.914 -3.994240 16.17946 
1 1 1    5   14   39 o   35.479   9.2767   26.811   18.006   29.980   25.739   23.775   25.199   36.701   13.258   34.256   12.979 2.445297 18.55334 
1 1 1    5   14   40 o   28.414   8.3226   7.9045   16.392   20.238   23.869  -3.1038   22.551   32.235   12.523   24.593   10.965 7.641722 16.64515 
1 1 1    5   14   41 o   31.981   8.3525   18.786   15.962   0.3817   22.614   37.059   22.533   25.309   11.147   38.652   12.442 -13.34285 16.70492 
1 1 1    5   14   42 o   30.189   8.9227   5.9568   18.803 -10.4998   23.702   33.899   30.885   23.109   10.664   37.269   14.309 -14.16069 17.84537 
1 1 1    5   14   43 o   23.290   7.5477  -7.2705   16.302  -3.0856   24.323 -10.6833   21.966   24.670   11.160   21.909   10.165 2.760963 15.09537 
1 1 1    5   14   44 o   29.772   8.5913   17.874   16.874   23.203   22.794   11.413   25.099   31.393   12.226   28.151   12.073 3.241560 17.18253 
1 1 1    5   14   45 o   26.468   8.2599   6.1809   17.658   9.9461   25.430   2.6750   24.539   27.509   11.975   25.426   11.380 2.082607 16.51984 
1 1 1    5   14   46 o   38.154   9.2608   40.759   19.050   18.870   25.758   67.190   28.305   29.440   12.412   46.869   13.748 -17.42876 18.52151 
1 1 1    5   14   47 o   27.506   8.8115   8.6895   21.745   0.1489   31.694   16.285   29.889   26.123   12.150   28.888   12.765 -2.764488 17.62299 
1 1 1    5   14   48 o   24.481   8.7037 -40.2263   25.256   25.576   54.843 -57.9375   28.453   31.317   14.983   17.645   8.8622 13.67157 17.40749 
1 1 1    5   14   49 o   24.498   8.1907  -2.3712   21.801   6.9193   31.879 -10.5331   29.880   26.061   12.143   22.935   10.995 3.126602 16.38138 
1 1 1    5   15    0 o  743.810   5.9312 11426.53  257.252 11426.53  257.252 11426.53  257.252  743.810   8.3879  743.810   8.3879 0.000000 0.000000 
1 1 1    5   15    1 o  458.044   3.9265  4330.74   74.173  4316.68  104.201  4345.17  105.605  457.293   5.5247  458.795   5.5808 -1.501984 7.852940 
1 1 1    5   15    2 o  284.556   3.1453  1673.42   36.308  1656.77   56.572  1685.08   47.345  283.334   4.8411  285.778   4.0168 -2.444733 6.290514 
1 1 1    5   15    3 o  315.130   2.8150  2051.92   36.349  2022.59   54.401  2075.59   48.856  313.083   4.2129  317.178   3.7347 -4.095337 5.629965 
1 1 1    5   15    4 o  431.413   3.8081  3852.44   62.033  3815.61  113.188  3868.25   74.162  429.849   6.3844  432.976   4.1529 -3.126160 7.616251 
1 1 1    5   15    5 o  389.478   3.4690  3127.64   55.664  3196.98   80.976  3065.52   76.644  393.561   4.9886  385.396   4.8217 8.165283 6.937957 
1 1 1    5   15    6 o  107.303   2.0504  235.608   9.0200  202.390   12.214  275.453   13.377   99.050   2.9898  115.556   2.8068 -16.50591 4.100863 
1 1 1    5   15    7 o  237.428   2.7205  1162.42   26.625  1141.75   36.914  1184.83   38.440  235.231   3.8048  239.624   3.8894 -4.393784 5.440980 
1 1 1    5   15    8 o  279.909   3.2945  1597.89   36.397  1552.71   45.020  1683.14   61.844  274.302   3.9793  285.517   5.2517 -11.21548 6.589053 
1 1 1    5   15    9 o  331.099   2.9743  2265.13   40.272  2282.34   53.680  2242.97   60.907  332.558   3.9136  329.641   4.4798 2.917297 5.948571 
1 1 1    5   15   10 o  332.214   2.9838  2283.67   40.750  2363.00   56.019  2194.51   59.386  338.371   4.0140  326.057   4.4160 12.31381 5.967666 
1 1 1    5   15   11 o  163.367   2.6766  550.188   17.147  548.836   21.176  552.764   29.222  163.095   3.1480  163.640   4.3297 -0.5446930 5.353163 
1 1 1    5   15   12 o  175.452   2.8869  609.988   20.272  741.050   34.038  537.950   25.235  189.460   4.3559  161.444   3.7898 28.01569 5.773775 
1 1 1    5   15   13 o  425.658   3.3762  3751.80   57.678  3786.26   73.716  3697.39   92.622  428.256   4.1734  423.060   5.3082 5.196503 6.752327 
1 1 1    5   15   14 o  107.762   3.1814  242.148   13.970  201.353   19.926  281.582   19.591   98.735   4.8932  116.789   4.0672 -18.05351 6.362791 
1 1 1    5   15   15 o  253.655   2.9079  1328.48   30.420  1349.38   43.118  1307.76   42.923  255.643   4.0894  251.666   4.1352 3.977310 5.815737 
1 1 1    5   15   16 o  219.481   3.9373  1013.97   25.824  1022.34   28.163  969.755   64.727  222.569   3.0679  216.393   7.2523 6.175812 7.874527 
1 1 1    5   15   17 o  329.913   2.9357  2250.39   38.636  2257.13   48.833  2239.10   63.175  330.641   3.5809  329.185   4.6531 1.456116 5.871497 
1 1 1    5   15   18 o  178.232   2.7354  656.754   19.966  661.252   26.744  651.090   30.009  178.940   3.6237  177.525   4.0985 1.415375 5.470795 
1 1 1    5   15   19 o   57.915   4.5764   76.273   9.5747   86.499   11.590   54.298   16.990   64.698   4.3435   51.131   8.0565 13.56654 9.152814 
1 1 1    5   15   20 o  263.873   2.8662  1435.44   30.865  1417.78   40.678  1459.41   47.385  261.997   3.7644  265.749   4.3232 -3.752411 5.732433 
1 1 1    5   15   21 o  187.121   3.1030  715.093   22.946  694.342   28.422  753.932   38.884  183.330   3.7589  190.912   4.9382 -7.581909 6.206059 
1 1 1    5   15   22 o  118.984   3.3531  292.531   16.136  294.280   25.483  291.361   20.847  119.246   5.1814  118.721   4.2575 0.5247955 6.706232 
1 1 1    5   15   23 o  194.182   2.6834  779.113   21.483  782.180   30.841  776.221   29.942  194.548   3.8436  193.816   3.7457 0.7322845 5.366869 
1 1 1    5   15   24 o   31.048   7.7195   17.174   12.381   23.506   18.281   11.808   16.828   34.129   11.222   27.968   10.604 6.160175 15.43903 
1 1 1    5   15   25 o  220.368   3.9449  1009.84   35.697  962.405   52.239  1051.40   48.893  215.436   5.8791  225.300   5.2616 -9.863617 7.889741 
1 1 1    5   15   26 o  142.117   3.6398  420.938   20.934  432.736   27.318  404.151   32.584  144.609   4.5802  139.624   5.6583 4.984360 7.279699 
1 1 1    5   15   27 o  105.065   4.3415  231.774   18.158  218.814   29.404  239.762   23.086  102.564   6.9509  107.565   5.2037 -5.000671 8.682907 
1 1 1    5   15   28 o  106.384   4.3553  224.341   18.551  281.155   31.158  193.139   23.090  116.299   6.4957   96.469   5.8033 19.83034 8.710502 
1 1 1    5   15   29 f   87.705   5.0031  160.723   17.614  115.548   24.109  212.446   25.798   74.343   7.8628  101.067   6.1888 -26.72395 10.00621 
1 1 1    5   15   30 o   78.023   6.1026  130.524   19.218  152.820   26.356  105.211   28.082   85.466   7.4768   70.580   9.6469 14.88629 12.20510 
1 1 1    5   15   31 o  194.722   3.6823  785.338   28.583  777.227   35.983  799.208   47.054  193.558   4.5074  195.886   5.8241 -2.328369 7.364537 
1 1 1    5   15   32 o   23.486   7.5694 -15.1385   16.649 -30.1717   25.103  -3.3320   22.246   21.550   10.262   25.423   11.130 -3.872570 15.13889 
1 1 1    5   15   33 o  171.665   4.4747  621.485   31.507  583.122   46.108  655.091   43.154  166.482   6.7149  176.849   5.9163 -10.36708 8.949471 
1 1 1    5   15   34 o   26.351   7.8263  -6.7872   17.054 -46.9315   27.156   19.357   21.915   20.203   9.8707   32.500   12.148 -12.29709 15.65264 
1 1 1    5   15   35 o   49.542   9.1437   59.518   18.709   66.048   23.209   47.402   31.613   53.955   10.806   45.129   14.753 8.826302 18.28734 
1 1 1    5   15   36 o   28.390   8.1037   5.6463   15.655   23.873   22.915 -10.3051   21.437   34.120   12.481   22.660   10.339 11.45971 16.20735 
1 1 1    5   15   37 f  104.530   4.3775  232.635   18.854  228.170   27.091  236.828   26.256  103.474   6.3480  105.586   6.0292 -2.111885 8.754914 
1 1 1    5   15   38 o   39.352   9.2334   35.998   17.482   42.214   26.008   30.875   23.611   41.842   13.356   36.861   12.753 4.981815 18.46684 
1 1 1    5   15   39 o   41.900   8.8516   17.816   19.570 -16.0439   23.383   96.990   35.756   22.231   10.372   61.568   14.347 -39.33747 17.70324 
1 1 1    5   15   40 o   26.904   9.2571 -26.3433   24.206 -68.4187   62.825 -19.0086   26.231   30.711   15.006   23.098   10.844 7.612974 18.51427 
1 1 1    5   15   41 o   35.541   9.0796   29.876   17.092   26.636   23.725   33.372   24.646   34.153   12.665   36.930   13.014 -2.777550 18.15916 
1 1 1    5   15   42 o   58.552   9.0491   88.923   21.270   76.610   29.189  102.864   31.058   53.628   13.269   63.476   12.308 -9.847225 18.09817 
1 1 1    5   15   43 o   30.366   7.8166   13.930   15.399 -14.5324   21.941   41.557   21.617   21.048   9.8929   39.685   12.105 -18.63733 15.63324 
1 1 1    5   15   44 o   16.406   5.7918 -49.6064   15.960 -39.6992   22.633 -59.4053   22.509   17.414   8.6062   15.398   7.7534 2.015777 11.58364 
1 1 1    5   15   45 o   33.151   8.8887   29.204   16.850   34.414   23.821   23.986   23.837   35.097   12.743   31.205   12.396 3.891949 17.77750 
1 1 1    5   15   46 o   21.365   7.4513 -41.8545   23.584 -33.6470   31.308 -52.6208   35.858   21.486   10.519   21.243   10.557 0.2431602 14.90263 
1 1 1    5   15   47 f   21.566   7.4731 -31.2819   22.326 -31.8458   33.693 -30.8405   29.810   22.169   10.866   20.962   10.263 1.207260 14.94618 
1 1 1    5   15   48 o   23.902   7.8750  -9.6814   21.059 -54.1505   33.129   20.473   27.280   19.506   9.7635   28.297   12.359 -8.791105 15.74995 
1 1 1    5   16    1 o  206.130   2.3104  874.889   19.357  866.708   25.253  886.545   30.141  204.971   2.9871  207.289   3.5255 -2.318008 4.620833 
1 1 1    5   16    2 o  440.624   3.5553  4011.43   64.111  3978.67   96.675  4037.16   85.657  438.988   5.3394  442.260   4.6959 -3.272095 7.110613 
1 1 1    5   16    3 o  193.782   2.2456  775.950   17.835  763.357   26.649  786.166   24.003  192.351   3.3590  195.213   2.9812 -2.862381 4.491159 
1 1 1    5   16    4 o  323.001   2.7226  2158.70   35.383  2126.16   56.430  2179.78   45.420  320.966   4.2627  325.035   3.3881 -4.068817 5.445168 
1 1 1    5   16    5 o  398.823   3.0673  3269.44   50.246  3144.29   67.533  3424.63   75.199  390.320   4.1950  407.326   4.4762 -17.00604 6.134650 
1 1 1    5   16    6 o  219.631   2.5833  1010.93   23.015  1115.52   30.979  882.094   34.382  232.522   3.2302  206.740   4.0322 25.78227 5.166538 
1 1 1    5   16    7 o  254.880   2.3689  1340.41   24.902  1338.22   35.110  1342.63   35.325  254.670   3.3426  255.089   3.3576 -0.4189148 4.737765 
1 1 1    5   16    8 o  355.604   3.1312  2595.52   44.982  2539.12   57.740  2682.59   71.744  350.751   3.9913  360.457   4.8258 -9.706055 6.262464 
1 1 1    5   16    9 o  256.516   2.6370  1352.94   27.495  1329.17   35.806  1387.09   42.921  253.796   3.4206  259.236   4.0143 -5.439819 5.273973 
1 1 1    5   16   10 o  230.983   2.4163  1100.01   22.199  1097.25   27.901  1104.78   36.646  230.609   2.9334  231.357   3.8404 -0.7477417 4.832612 
1 1 1    5   16   11 o   24.382   5.1260   12.680   5.9064   17.513   7.5717   5.1687   9.4395   28.536   6.5693   20.228   7.8708 8.308388 10.25206 
1 1 1    5   16   12 o  192.285   2.6234  763.475   20.796  786.617   29.317  740.040   29.503  195.222   3.6411  189.348   3.7778 5.874100 5.246841 
1 1 1    5   16   13 o  517.325   3.8993  5552.80   81.342  5638.29  105.003  5424.50  128.629  522.446   4.8730  512.204   6.0888 10.24188 7.798667 
1 1 1    5   16   14 o  201.564   2.6071  833.032   21.388  805.314   27.856  872.841   33.383  197.522   3.4193  205.606   3.9367 -8.084000 5.214294 
1 1 1    5   16   15 o  177.296   2.9479  651.254   21.232  661.558   27.841  636.932   32.823  179.001   3.7710  175.591   4.5322 3.410080 5.895870 
1 1 1    5   16   16 o  160.395   3.3218  542.503   20.155  559.958   24.313  504.160   36.036  164.677   3.5797  156.114   5.5967 8.563446 6.643594 
1 1 1    5   16   17 o  119.042   2.9764  293.310   14.584  302.919   20.210  282.868   21.068  121.089   4.0466  116.995   4.3660 4.093513 5.952832 
1 1 1    5   16   18 o   65.433   3.7108   88.980   9.2718   89.687   11.195   87.438   16.545   65.886   4.1197   64.980   6.1732 0.9059525 7.421603 
1 1 1    5   16   19 o  265.694   2.8632  1455.07   31.012  1436.55   40.744  1480.57   47.816  263.724   3.7458  267.663   4.3314 -3.938690 5.726403 
1 1 1    5   16   20 o  167.382   2.5612  576.403   17.012  570.282   21.273  587.261   28.334  166.192   3.1035  168.572   4.0753 -2.380692 5.122480 
1 1 1    5   16   21 o  181.758   3.1924  683.765   23.597  687.073   30.935  679.160   36.490  182.326   4.1137  181.190   4.8829 1.135635 6.384745 
1 1 1    5   16   22 o  249.200   2.8701  1283.42   29.291  1281.30   39.151  1286.11   44.145  249.002   3.8122  249.399   4.2916 -0.3966522 5.740275 
1 1 1    5   16   23 o  161.173   3.3583  538.582   22.266  581.031   31.408  495.693   31.571  167.593   4.5438  154.752   4.9463 12.84047 6.716595 
1 1 1    5   16   24 o  207.116   4.0483  886.256   34.519  940.616   50.711  839.318   47.122  213.005   5.7723  201.226   5.6777 11.77901 8.096639 
1 1 1    5   16   25 o  159.954   3.1180  529.406   20.506  530.549   27.937  528.070   30.193  160.161   4.2292  159.746   4.5827 0.4153748 6.235959 
1 1 1    5   16   26 f   37.048   8.8707   26.774   15.762   24.911   19.968   29.852   25.671   35.210   11.736   38.887   13.305 -3.677708 17.74139 
1 1 1    5   16   27 o  218.707   3.0360  989.499   27.286  986.016   37.009  993.647   40.389  218.317   4.1102  219.097   4.4695 -0.7800446 6.072074 
1 1 1    5   16   28 o  125.719   3.5439  327.655   18.373  331.788   26.242  323.680   25.733  126.495   5.0299  124.944   4.9936 1.550224 7.087719 
1 1 1    5   16   29 o   61.376   6.6080   80.187   15.699  113.200   23.424   53.266   21.153   73.540   7.7229   49.213   10.725 24.32677 13.21593 
1 1 1    5   16   30 o  116.482   4.0442  283.467   19.299  272.866   28.697  292.220   26.076  114.415   6.0811  118.549   5.3331 -4.133759 8.088405 
1 1 1    5   16   31 o   85.118   5.5050  155.468   18.882  171.689   25.098  134.313   28.662   90.554   6.7201   79.683   8.7212 10.87059 11.00996 
1 1 1    5   16   32 o   88.921   5.4558  177.337   18.759  121.219   28.538  220.037   24.893   75.310   9.1876  102.532   5.8865 -27.22171 10.91162 
1 1 1    5   16   33 o   28.947   8.7333   2.3881   18.768 -12.9597   30.117   12.133   23.998   27.182   12.345   30.711   12.357 -3.528870 17.46667 
1 1 1    5   16   34 o   48.445   8.4355   66.507   20.306 -15.6223   42.161   91.313   23.171   31.774   14.498   65.115   8.6276 -33.34134 16.87101 
1 1 1    5   16   35 o   27.036   8.6271  -7.6773   19.883   2.3428   23.587 -32.2748   36.956   27.197   11.685   26.875   12.695 0.3221149 17.25418 
1 1 1    5   16   36 o   56.011   11.206   78.918   22.161   79.930   23.688   71.825   62.730   60.065   9.5620   51.956   20.270 8.109108 22.41179 
1 1 1    5   16   37 o   58.597   8.3103   79.410   20.495   32.153   27.370  139.731   30.923   37.856   13.672   79.338   9.4502 -41.48198 16.62052 
1 1 1    5   16   38 o   44.053   8.4819   48.143   17.734   18.745   26.596   71.675   23.796   32.772   13.070   55.334   10.814 -22.56194 16.96371 
1 1 1    5   16   39 o   30.495   8.1980   7.7171   16.608   38.740   24.503 -18.6454   22.587   39.731   12.988   21.259   10.007 18.47189 16.39597 
1 1 1    5   16   40 f   42.324   9.9645   38.510   20.908   77.321   35.293   17.525   25.952   53.140   15.284   31.508   12.789 21.63209 19.92900 
1 1 1    5   16   41 o   38.494   8.2224   34.052   16.309   62.156   23.608   8.3944   22.556   49.753   11.701   27.234   11.555 22.51895 16.44481 
1 1 1    5   16   42 o   46.420   9.0586   54.969   18.007   77.579   28.539   40.015   23.210   53.959   12.982   38.880   12.638 15.07903 18.11715 
1 1 1    5   16   43 o   43.251   8.1973   49.832   16.341   74.204   23.195   25.813   23.026   54.170   10.761   32.332   12.369 21.83802 16.39464 
1 1 1    5   16   44 o   21.949   7.2216 -14.4873   16.492 -33.3519   23.378   4.2024   23.270   18.562   9.0880   25.336   11.226 -6.773882 14.44327 
1 1 1    5   16   45 o   24.583   7.5120 -12.0133   16.852   29.607   23.842 -53.5650   23.822   32.750   12.572   16.416   8.2257 16.33403 15.02408 
1 1 1    5   16   46 o   23.759   7.9551 -11.8194   21.082 -25.9822   31.191   0.0923   28.605   22.233   10.799   25.284   11.684 -3.050997 15.91019 
1 1 1    5   16   47 o   25.288   8.4957 -18.6757   22.390   35.046   38.171 -46.8539   27.645   32.299   14.341   18.278   9.1131 14.02078 16.99145 
1 1 1    5   16   48 o   33.479   9.7435   41.135   21.812   36.485   31.853   45.241   29.931   32.132   13.686   34.826   13.873 -2.693878 19.48702 
1 1 1    5   17    0 o  113.856   1.9786  267.864   13.122  267.864   13.122  267.864   13.122  113.856   2.7982  113.856   2.7982 0.000000 0.000000 
1 1 1    5   17    1 o  173.339   2.6481  606.697   18.362  568.825   22.986  673.482   30.523  166.036   3.3565  180.641   4.0968 -14.60541 5.296247 
1 1 1    5   17    2 o  130.000   2.2264  347.776   11.916  319.969   16.429  378.640   17.308  124.531   3.1986  135.470   3.0977 -10.93924 4.452726 
1 1 1    5   17    3 o  376.612   3.4023  2928.36   52.848  2940.38   74.796  2916.38   74.682  377.384   4.8054  375.840   4.8178 1.544159 6.804632 
1 1 1    5   17    4 o  138.023   2.6313  380.055   14.728  482.563   23.406  312.872   18.949  152.917   3.7111  123.129   3.7312 29.78810 5.262587 
1 1 1    5   17    5 o  233.697   2.1093  1128.40   20.300  1165.67   28.244  1088.58   29.196  237.697   2.8809  229.696   3.0818 8.001617 4.218673 
1 1 1    5   17    6 o  245.938   2.5294  1217.95   24.849  1134.86   31.010  1367.01   41.536  234.520   3.2059  257.356   3.9131 -22.83562 5.058703 
1 1 1    5   17    7 o  210.902   2.2077  917.439   19.200  900.786   26.816  934.955   27.502  208.939   3.1118  212.864   3.1325 -3.925140 4.415385 
1 1 1    5   17    8 o   97.689   3.3826  205.510   11.877  215.250   13.939  179.690   22.694  102.131   3.3091   93.247   5.9008 8.884705 6.765281 
1 1 1    5   17    9 o  106.963   2.5016  236.631   10.987  242.053   14.953  230.268   16.199  108.302   3.3475  105.623   3.7184 2.678276 5.003217 
1 1 1    5   17   10 o  117.328   3.3560  296.804   14.289  312.310   16.880  257.599   26.842  123.018   3.3269  111.640   5.8294 11.37789 6.711960 
1 1 1    5   17   11 o  296.683   3.1708  1821.08   36.513  1827.56   44.681  1808.06   63.350  297.551   3.6408  295.815   5.1923 1.736206 6.341575 
1 1 1    5   17   12 o  183.847   2.3601  700.162   17.298  707.673   21.887  687.664   28.234  185.186   2.8656  182.508   3.7508 2.678452 4.720159 
1 1 1    5   17   13 o  165.298   2.7787  564.703   18.921  551.810   27.245  576.715   26.298  163.468   4.0410  167.128   3.8150 -3.660400 5.557386 
1 1 1    5   17   14 o  113.207   2.5517  267.917   11.505  278.189   14.648  251.380   18.586  116.094   3.0592  110.320   4.0848 5.773628 5.103358 
1 1 1    5   17   15 o  276.560   3.6995  1581.17   42.184  1524.23   58.987  1640.78   60.350  271.461   5.2685  281.660   5.1950 -10.19885 7.398966 
1 1 1    5   17   16 o  116.532   2.9064  279.586   13.945  261.407   19.088  300.395   20.422  112.483   4.1143  120.581   4.1063 -8.097420 5.812858 
1 1 1    5   17   17 o  145.033   3.1461  414.926   15.616  400.265   17.551  470.634   34.213  139.247   3.0560  150.819   5.5001 -11.57266 6.292111 
1 1 1    5   17   18 o  100.206   3.1408  207.478   12.978  203.339   18.149  211.809   18.567   99.184   4.4365  101.228   4.4470 -2.044090 6.281612 
1 1 1    5   17   19 o  161.037   2.7581  535.171   18.240  528.605   24.609  543.176   27.172  159.956   3.7301  162.118   4.0637 -2.162109 5.516132 
1 1 1    5   17   20 o  180.436   2.5712  674.617   18.417  680.187   23.150  665.015   30.396  181.497   3.0925  179.374   4.1086 2.123001 5.142371 
1 1 1    5   17   21 o  200.730   2.6953  836.460   21.933  854.150   28.668  811.491   34.059  203.342   3.4183  198.117   4.1682 5.225342 5.390627 
1 1 1    5   17   22 o  144.471   2.9722  431.503   17.652  430.664   23.996  432.494   26.058  144.333   4.0310  144.609   4.3690 -0.2753296 5.944478 
1 1 1    5   17   23 o   84.357   4.4272  148.707   15.235  139.656   22.899  155.894   20.406   81.993   6.7714   86.720   5.7052 -4.727097 8.854445 
1 1 1    5   17   24 o   44.919   7.9844   44.947   14.567   38.709   23.796   48.686   18.422   42.458   12.645   47.380   9.7522 -4.921452 15.96877 
1 1 1    5   17   25 o  125.805   3.7321  334.141   18.890  362.331   24.821  295.340   29.121  132.308   4.5485  119.301   5.9183 13.00729 7.464259 
1 1 1    5   17   26 o  135.304   3.6889  379.194   20.457  381.742   30.745  377.170   27.402  135.674   5.4944  134.934   4.9238 0.7404175 7.377824 
1 1 1    5   17   27 o   41.360   7.9677   39.084   16.473   61.601   20.699   0.1880   27.204   53.321   9.7721   29.399   12.587 23.92166 15.93544 
1 1 1    5   17   28 o   75.203   5.0283  117.873   15.517  120.150   23.238  116.042   20.844   75.814   7.4316   74.591   6.7754 1.222412 10.05652 
1 1 1    5   17   29 o   83.505   5.0291  146.596   17.204  165.097   24.247  127.839   24.414   88.918   6.6115   78.092   7.5800 10.82623 10.05824 
1 1 1    5   17   30 o   64.840   5.9809   88.376   15.907  102.052   23.210   76.263   21.843   69.617   8.0833   60.064   8.8174 9.553093 11.96187 
1 1 1    5   17   31 o   47.219   7.9904   51.322   15.569   37.772   23.018   62.748   21.137   41.156   12.477   53.283   9.9851 -12.12696 15.98075 
1 1 1    5   17   32 o   44.609   10.120   44.639   20.212   44.959   35.999   44.493   24.426   45.129   15.740   44.090   12.725 1.038334 20.24016 
1 1 1    5   17   33 o   28.756   8.2982   6.4453   15.990   19.598   23.738  -4.4782   21.634   33.092   12.583   24.421   10.822 8.670252 16.59633 
1 1 1    5   17   34 o   45.205   8.1637   47.937   16.602   21.878   24.055   71.642   22.942   33.978   12.722   56.431   10.234 -22.45263 16.32732 
1 1 1    5   17   35 o   29.388   9.0552   2.2231   20.606   5.4741   27.768  -1.7615   30.742   29.634   12.703   29.142   12.908 0.4915180 18.11048 
1 1 1    5   17   36 o   35.001   8.4382   22.535   16.507   0.0964   22.859   46.983   23.861   25.882   11.308   44.120   12.528 -18.23768 16.87637 
1 1 1    5   17   37 o   47.892   8.8441   55.385   18.084   71.588   25.981   40.157   25.187   54.878   11.827   40.907   13.152 13.97074 17.68813 
1 1 1    5   17   38 o   21.376   7.0608 -16.7719   15.586 -25.8561   22.652  -8.6047   21.478   20.052   9.6030   22.700   10.354 -2.647522 14.12168 
1 1 1    5   17   39 f   35.144   8.7926   28.858   16.099   23.209   23.504   33.852   22.097   33.002   12.527   37.285   12.341 -4.282310 17.58520 
1 1 1    5   17   40 o   33.058   8.9406   20.059   20.185 -28.2162   36.726   40.952   24.161   26.035   12.402   40.080   12.881 -14.04442 17.88110 
1 1 1    5   17   41 f   28.789   8.7614   7.0657   18.100   22.845   30.571  -1.4518   22.460   33.291   13.738   24.286   10.877 9.005491 17.52280 
1 1 1    5   17   42 o   30.255   8.8859   17.187   18.126   17.355   27.747   17.062   23.940   30.745   12.918   29.765   12.205 0.9798298 17.77184 
1 1 1    5   17   43 o   27.928   8.7110   5.0125   18.750  -5.8501   23.153   25.711   31.960   22.972   10.579   32.884   13.842 -9.911283 17.42195 
1 1 1    5   17   44 o   23.252   7.6768  -8.6214   18.005  -5.3352   23.344 -13.4478   28.290   23.000   10.603   23.505   11.105 -0.5048466 15.35354 
1 1 1    5   17   45 o   26.892   8.6872   5.5188   21.454   7.6374   31.238   3.6274   29.516   27.484   12.517   26.301   12.050 1.182377 17.37439 
1 1 1    5   17   46 o   29.688   9.1653   21.589   21.100   25.076   31.471   18.742   28.439   30.585   13.318   28.791   12.595 1.794426 18.33056 
1 1 1    5   17   47 o   35.266   10.499   50.657   27.010   32.771   39.742   66.011   36.820   31.329   14.210   39.203   15.459 -7.873522 20.99756 
1 1 1    5   18    0 o  692.200   4.8192  9897.48  194.533  9897.48  194.533  9897.48  194.533  692.200   6.8154  692.200   6.8154 0.000000 0.000000 
1 1 1    5   18    1 o  281.269   2.6571  1631.90   30.436  1626.91   39.964  1638.79   46.965  280.776   3.4510  281.762   4.0413 -0.9864807 5.314264 
1 1 1    5   18    2 o  215.284   3.0012  952.424   26.576  898.578   36.003  1016.90   39.396  208.632   4.1840  221.936   4.3038 -13.30446 6.002372 
1 1 1    5   18    3 o  368.572   3.5301  2821.87   51.424  2748.35   85.459  2863.61   64.385  364.704   5.6813  372.440   4.1914 -7.735596 7.060140 
1 1 1    5   18    4 o  209.296   2.1850  903.987   18.857  908.771   26.411  899.011   26.932  209.862   3.0513  208.729   3.1284 1.133041 4.370044 
1 1 1    5   18    5 o  402.033   3.3196  3341.32   54.600  3366.27   72.884  3309.42   82.427  403.781   4.3764  400.285   4.9927 3.496490 6.639298 
1 1 1    5   18    6 o  158.182   1.9473  517.378   12.642  528.709   17.163  503.937   18.693  160.083   2.5995  156.280   2.9000 3.803391 3.894537 
1 1 1    5   18    7 o  406.221   3.1263  3405.83   52.354  3454.96   75.448  3360.21   72.707  409.039   4.4721  403.404   4.3699 5.635284 6.252699 
1 1 1    5   18    8 o  176.386   2.2552  642.964   15.811  645.466   19.884  638.664   26.071  176.870   2.7258  175.902   3.5935 0.9684143 4.510363 
1 1 1    5   18    9 o   35.229   4.6334   25.853   6.3736   29.972   10.227   23.238   8.1496   37.473   6.8704   32.984   6.2186 4.489738 9.266852 
1 1 1    5   18   10 o  291.826   3.1751  1748.98   35.810  1730.49   43.491  1787.92   63.104  289.525   3.6420  294.128   5.2019 -4.602692 6.350110 
1 1 1    5   18   11 o   85.480   2.6352  150.055   9.0894  147.081   11.646  154.689   14.538   84.412   3.3451   86.548   4.0728 -2.135712 5.270474 
1 1 1    5   18   12 o  169.630   2.4696  596.132   17.177  615.737   23.304  572.807   25.419  172.706   3.2715  166.553   3.7003 6.153244 4.939143 
1 1 1    5   18   13 o  236.730   2.6190  1152.76   25.180  1131.62   32.721  1183.47   39.430  234.107   3.3888  239.352   3.9941 -5.245361 5.238004 
1 1 1    5   18   14 o   69.780   3.0827   97.378   8.7211   78.250   11.280  125.806   13.751   61.533   4.4446   78.028   4.2729 -16.49511 6.165363 
1 1 1    5   18   15 o  189.527   2.8801  730.797   21.414  706.784   26.275  778.302   36.957  185.010   3.4433  194.044   4.6177 -9.034714 5.760199 
1 1 1    5   18   16 o  209.997   2.8199  909.967   24.395  931.837   35.533  890.470   33.551  212.374   4.0567  207.619   3.9180 4.754562 5.639798 
1 1 1    5   18   17 o  310.507   3.3394  1991.31   37.836  1988.38   44.182  1999.37   73.273  310.281   3.4525  310.732   5.7173 -0.4503174 6.678860 
1 1 1    5   18   18 o   98.326   3.2089  201.046   12.880  235.663   18.305  167.099   18.127  106.778   4.1564   89.874   4.8901 16.90409 6.417852 
1 1 1    5   18   19 o  218.695   2.5586  993.910   22.401  1013.17   28.591  963.287   36.049  221.504   3.1295  215.885   4.0486 5.619629 5.117131 
1 1 1    5   18   20 o   38.919   5.7903   30.526   8.2841   27.599   9.7344   38.212   15.775   35.873   6.8288   41.966   9.3530 -6.092808 11.58057 
1 1 1    5   18   21 o  168.961   2.6244  590.567   17.634  592.268   22.189  587.651   29.051  169.339   3.1769  168.583   4.1781 0.7561493 5.248769 
1 1 1    5   18   22 o  192.053   2.8372  763.950   22.372  777.717   30.387  747.654   33.060  193.972   3.7982  190.135   4.2158 3.837112 5.674449 
1 1 1    5   18   23 f  280.157   3.0029  1625.62   34.530  1646.72   46.761  1600.31   51.208  282.203   4.0175  278.111   4.4643 4.091949 6.005871 
1 1 1    5   18   24 f  159.017   3.1572  524.941   19.680  528.583   24.356  518.090   33.404  159.904   3.6930  158.131   5.1217 1.772980 6.314306 
1 1 1    5   18   25 o  185.586   2.8483  712.778   21.785  679.022   30.782  746.650   30.834  181.169   4.1195  190.003   3.9347 -8.834213 5.696641 
1 1 1    5   18   26 o  186.466   3.3092  722.108   25.385  688.135   36.662  753.395   35.183  182.205   4.8786  190.727   4.4726 -8.521637 6.618493 
1 1 1    5   18   27 o   41.607   8.1805   39.176   16.738   60.409   21.343   5.2469   26.979   52.613   10.204   30.601   12.789 22.01210 16.36100 
1 1 1    5   18   28 f   84.663   4.5237  149.647   15.763  147.823   22.967  151.272   21.673   84.140   6.6182   85.185   6.1687 -1.044998 9.047344 
1 1 1    5   18   29 o   39.977   8.7884   34.527   15.984   36.631   23.610   32.746   21.719   41.005   12.675   38.950   12.177 2.054733 17.57671 
1 1 1    5   18   30 o   40.957   8.6437   37.422   15.711   36.992   22.491   37.831   21.956   40.773   12.327   41.141   12.120 -0.3676109 17.28743 
1 1 1    5   18   31 o   35.614   8.6666   25.671   15.879   15.571   22.755   35.258   22.169   31.497   12.230   39.732   12.283 -8.235149 17.33329 
1 1 1    5   18   32 o  107.840   8.8970  268.943   29.585  247.981   68.885  273.684   32.760  102.068   16.363  113.613   6.9913 -11.54439 17.79406 
1 1 1    5   18   33 o   27.102   7.6183  -7.3020   15.648   28.605   22.687 -39.8824   21.611   36.451   12.508   17.754   8.7017 18.69765 15.23670 
1 1 1    5   18   34 o  110.051   4.0902  256.362   18.557  250.495   26.425  262.069   26.064  108.757   5.8911  111.346   5.6756 -2.589409 8.180302 
1 1 1    5   18   35 o   53.674   8.0747   68.802   17.274   58.193   27.379   75.819   22.266   48.755   13.263   58.593   9.2136 -9.837708 16.14937 
1 1 1    5   18   36 o   35.928   9.3108   28.025   18.248   34.172   22.765   16.978   30.519   38.228   12.520   33.627   13.784 4.600922 18.62152 
1 1 1    5   18   37 f   32.796   8.2371   19.711   15.584   40.003   22.212   0.0380   21.870   40.487   12.253   25.105   11.012 15.38197 16.47421 
1 1 1    5   18   38 o   34.006   8.5323   25.174   15.615   13.698   22.106   36.602   22.059   29.298   11.834   38.714   12.294 -9.415543 17.06464 
1 1 1    5   18   39 o   41.833   9.8117   45.641   19.795   41.881   30.026   48.532   26.326   40.378   14.350   43.287   13.385 -2.909142 19.62340 
1 1 1    5   18   40 o   25.434   7.9714   0.7596   16.564  -1.9871   22.564   3.9698   24.394   24.293   10.889   26.576   11.644 -2.282938 15.94278 
1 1 1    5   18   41 f   38.740   8.6291   39.471   15.888   28.615   22.844   49.643   22.112   33.916   12.454   43.565   11.948 -9.649158 17.25817 
1 1 1    5   18   42 o   27.193   7.9549   10.705   15.181   24.018   21.785  -1.8642   21.166   31.321   12.019   23.064   10.424 8.256454 15.90980 
1 1 1    5   18   43 o   23.078   7.6704 -11.0842   17.954 -10.4845   22.437 -12.1520   29.938   21.679   10.130   24.476   11.521 -2.797480 15.34072 
1 1 1    5   18   44 o   32.016   8.7299   27.112   16.833   38.372   23.896   16.022   23.715   35.965   12.799   28.067   11.875 7.897503 17.45973 
1 1 1    5   18   45 o   37.511   9.0081   26.738   22.043   93.660   33.247 -25.7552   29.445   53.432   14.649   21.590   10.488 31.84214 18.01615 
1 1 1    5   18   46 o   28.798   8.8131   13.764   20.095   45.500   30.921  -9.4411   26.440   35.298   14.088   22.299   10.593 12.99893 17.62616 
1 1 1    5   18   47 o   29.807   9.2115   12.628   23.972 -29.4542   32.753   61.180   35.181   21.515   10.579   38.100   15.083 -16.58519 18.42309 
1 1 1    5   19    0 o  287.626   2.4822  1707.53   41.630  1707.53   41.630  1707.53   41.630  287.626   3.5104  287.626   3.5104 0.000000 0.000000 
1 1 1    5   19    1 o  323.321   2.8839  2157.16   37.986  2151.39   49.930  2165.10   58.528  322.836   3.7499  323.806   4.3824 -0.9698792 5.767764 
1 1 1    5   19    2 o  345.212   3.0108  2446.06   42.072  2535.37   66.734  2387.15   54.200  350.372   4.6180  340.052   3.8644 10.31992 6.021577 
1 1 1    5   19    3 o   84.728   5.5407  148.366   19.362   0.0000   0.0000  148.366   19.362  ?   ?    84.728   5.5407      ?      ? 
1 1 1    5   19    4 o  174.665   2.0626  629.714   14.855  641.514   20.900  617.667   21.118  176.321   2.8739  173.010   2.9594 3.311356 4.125231 
1 1 1    5   19    5 o  231.650   2.3971  1111.48   22.767  1148.22   30.872  1067.68   33.709  235.874   3.1733  227.426   3.5937 8.447739 4.794218 
1 1 1    5   19    6 o  296.634   2.6741  1807.68   31.282  1786.54   38.798  1846.97   52.880  294.214   3.1973  299.053   4.2873 -4.838562 5.348206 
1 1 1    5   19    7 o  314.485   2.5373  2020.01   32.213  1941.30   41.148  2144.61   51.771  306.685   3.2530  322.285   3.8948 -15.60022 5.074594 
1 1 1    5   19    8 o  149.889   3.0398  478.933   17.252  504.376   20.952  425.362   30.402  156.320   3.2497  143.458   5.1381 12.86182 6.079525 
1 1 1    5   19    9 o  310.765   2.7387  2001.86   34.092  2026.59   43.468  1962.34   54.954  313.321   3.3637  308.209   4.3230 5.111633 5.477499 
1 1 1    5   19   10 o  185.584   2.7302  695.354   19.653  666.289   23.786  757.895   34.891  179.653   3.2101  191.516   4.4171 -11.86241 5.460391 
1 1 1    5   19   11 o  321.794   3.1540  2140.16   41.860  2153.99   59.152  2126.27   59.246  322.838   4.4424  320.749   4.4785 2.089355 6.308063 
1 1 1    5   19   12 o   35.016   4.2020   25.452   5.9136   22.692   7.8734   29.025   8.9573   32.585   6.0821   37.447   5.7996 -4.861950 8.403939 
1 1 1    5   19   13 o  263.774   2.5921  1436.16   27.183  1434.03   34.154  1439.84   44.897  263.558   3.1420  263.989   4.1235 -0.4309692 5.184107 
1 1 1    5   19   14 o  145.325   2.6740  436.149   16.022  433.423   22.347  439.032   22.984  144.860   3.7402  145.790   3.8224 -0.9291534 5.347938 
1 1 1    5   19   15 o  200.227   2.4503  831.670   19.509  842.157   24.607  813.925   32.010  201.974   2.9539  198.480   3.9103 3.494339 4.900583 
1 1 1    5   19   16 o  103.095   2.7078  218.065   11.328  211.372   14.652  228.009   17.859  101.159   3.5118  105.032   4.1226 -3.873299 5.415551 
1 1 1    5   19   17 o  189.040   2.4570  741.787   18.516  752.713   23.453  723.707   30.169  190.937   2.9781  187.142   3.9086 3.794937 4.913923 
1 1 1    5   19   18 o  204.336   3.0441  856.995   22.054  850.968   25.334  875.853   44.815  203.002   3.0258  205.670   5.2831 -2.667938 6.088214 
1 1 1    5   19   19 o   94.178   3.3593  183.681   12.976  209.718   18.617  159.085   18.094  100.692   4.4829   87.665   5.0044 13.02618 6.718622 
1 1 1    5   19   20 o   83.473   4.0632  144.376   13.985  146.677   20.059  142.201   19.508   84.117   5.7818   82.829   5.7105 1.288147 8.126462 
1 1 1    5   19   21 o  123.691   2.8013  318.397   13.804  324.642   17.493  308.089   22.475  125.352   3.3835  122.030   4.4655 3.321968 5.602551 
1 1 1    5   19   22 o  123.168   2.8493  305.074   13.863  285.556   17.047  343.188   23.821  117.551   3.5160  128.785   4.4847 -11.23399 5.698647 
1 1 1    5   19   23 o  102.832   3.3988  222.564   14.099  239.909   18.575  198.990   21.655  107.688   4.1822   97.976   5.3588 9.712120 6.797579 
1 1 1    5   19   24 o  224.187   3.1813  1040.60   29.403  1035.39   42.149  1045.54   41.038  223.627   4.5698  224.748   4.4271 -1.121185 6.362564 
1 1 1    5   19   25 o  163.359   3.1339  551.628   21.076  536.231   28.791  569.405   30.937  160.922   4.3379  165.795   4.5241 -4.873184 6.267800 
1 1 1    5   19   26 o   46.597   7.3534   49.182   14.665   22.721   21.474   72.309   20.075   34.479   12.148   58.714   8.2899 -24.23536 14.70687 
1 1 1    5   19   27 o  142.109   3.9417  419.943   23.084  414.776   31.917  425.610   33.427  141.214   5.4799  143.004   5.6674 -1.789902 7.883436 
1 1 1    5   19   28 o   82.787   5.0644  143.287   17.269  133.950   23.813  153.646   25.082   79.938   7.2225   85.637   7.1013 -5.698830 10.12880 
1 1 1    5   19   29 o   37.026   9.0526   29.178   17.277   2.8689   34.196   38.195   20.019   32.775   14.075   41.277   11.388 -8.501888 18.10515 
1 1 1    5   19   30 o  100.863   4.3844  213.344   18.115  181.404   25.037  248.429   26.241   92.850   6.5379  108.876   5.8436 -16.02584 8.768772 
1 1 1    5   19   31 f   26.891   8.3177  -1.0758   16.417   1.1435   29.172  -2.1044   19.861   29.725   12.883   24.057   10.525 5.668571 16.63548 
1 1 1    5   19   32 o   23.692   7.3838  -6.0502   14.615 -19.1408   21.397   5.3982   20.010   20.946   9.8209   26.438   11.029 -5.491524 14.76770 
1 1 1    5   19   33 o   35.716   8.6884   26.793   15.392   36.474   24.160   20.178   19.969   39.633   12.894   31.799   11.649 7.834215 17.37680 
1 1 1    5   19   34 o   36.455   7.7391   26.497   15.222  -2.1820   21.662   54.476   21.396   24.684   10.889   48.227   11.000 -23.54282 15.47816 
1 1 1    5   19   35 o   38.254   8.6257   27.359   16.447   59.058   26.823   8.2630   20.819   49.161   13.022   27.347   11.315 21.81435 17.25135 
1 1 1    5   19   36 o   50.432   9.6846   61.264   19.858   53.885   24.419   75.669   34.120   46.857   12.431   54.006   14.854 -7.148922 19.36915 
1 1 1    5   19   37 o   40.716   8.4537   40.135   15.429   50.664   22.203   30.303   21.456   45.558   11.742   35.875   12.165 9.683731 16.90731 
1 1 1    5   19   38 o   39.345   8.8653   38.632   16.335   44.544   23.203   32.823   23.000   41.996   12.481   36.694   12.593 5.302917 17.73065 
1 1 1    5   19   39 o   42.608   7.2685   37.197   16.982  -7.1582   23.165   88.731   24.970   23.491   10.730   61.724   9.8082 -38.23291 14.53709 
1 1 1    5   19   40 o   40.273   8.9162   42.786   16.370   40.195   21.847   46.103   24.719   39.180   12.207   41.367   13.000 -2.187340 17.83238 
1 1 1    5   19   41 o   29.219   8.1220   15.539   15.768  -3.9244   23.538   31.384   21.239   23.802   10.850   34.635   12.089 -10.83269 16.24402 
1 1 1    5   19   42 o   42.964   8.4571   51.367   15.884   59.427   21.233   41.125   23.935   47.791   11.000   38.138   12.849 9.653519 16.91421 
1 1 1    5   19   43 o   33.470   9.1820   31.066   18.006   31.495   27.811   30.756   23.628   33.597   13.376   33.342   12.583 0.2551765 18.36409 
1 1 1    5   19   44 o   35.403   9.1793   37.414   17.744   27.880   24.065   48.771   26.266   31.613   12.488   39.194   13.457 -7.580944 18.35859 
1 1 1    5   19   45 o   28.475   8.9061   17.942   20.554   17.323   31.089   18.423   27.396   28.593   12.802   28.358   12.385 0.2343693 17.81227 
1 1 1    5   19   46 o   25.950   8.3265   4.7262   21.018 -26.5150   32.018   28.382   27.861   21.640   10.604   30.259   12.841 -8.619205 16.65299 
1 1 1    5   20    0 o   54.272   2.5105   61.549   7.8693   61.549   7.8693   61.549   7.8693   54.272   3.5504   54.272   3.5504 0.000000 0.000000 
1 1 1    5   20    1 o   72.878   2.4325  107.336   7.1428   99.637   9.0416  120.118   11.650   69.480   3.1551   76.276   3.7031 -6.795448 4.864961 
1 1 1    5   20    2 o  129.069   2.1282  344.165   11.269  340.246   16.777  347.386   15.210  128.394   3.1681  129.745   2.8424 -1.350967 4.256328 
1 1 1    5   20    3 f  194.390   2.5584  785.053   19.660  762.690   32.637  797.788   24.629  192.171   4.1178  196.609   3.0373 -4.437836 5.116730 
1 1 1    5   20    4 o  354.884   3.0339  2607.78   44.223  2679.97   60.365  2524.16   64.970  360.228   4.0629  349.540   4.5066 10.68808 6.067722 
1 1 1    5   20    5 o  189.336   2.4509  756.124   18.663  834.047   24.664  651.745   28.546  201.023   2.9748  177.648   3.8959 23.37521 4.901803 
1 1 1    5   20    6 o  416.317   3.2848  3591.65   54.850  3624.27   70.027  3539.88   88.228  418.876   4.0533  413.758   5.1700 5.118164 6.569545 
1 1 1    5   20    7 o  212.538   3.0386  916.788   25.182  884.336   30.680  983.794   44.085  206.939   3.5946  218.137   4.9000 -11.19797 6.077112 
1 1 1    5   20    8 o  251.498   2.8888  1287.24   24.561  1272.98   27.624  1341.05   53.665  248.353   2.6968  254.644   5.1096 -6.290970 5.777618 
1 1 1    5   20    9 o  212.283   2.3691  927.377   19.828  920.043   24.608  940.954   33.480  211.128   2.8259  213.438   3.8032 -2.310089 4.738167 
1 1 1    5   20   10 o  244.269   2.8409  1249.02   27.347  1291.18   34.298  1175.43   45.311  250.071   3.3253  238.466   4.6070 11.60460 5.681726 
1 1 1    5   20   11 o  143.023   2.4586  422.923   14.416  427.316   19.407  417.515   21.532  143.864   3.2707  142.183   3.6718 1.681076 4.917287 
1 1 1    5   20   12 o   36.676   3.9708   27.928   5.7464   20.961   7.7128   36.621   8.6151   31.271   6.1991   42.081   4.9637 -10.81054 7.941504 
1 1 1    5   20   13 o  111.096   2.6174  255.623   11.925  289.508   16.975  222.607   16.756  118.396   3.4762  103.798   3.9140 14.59805 5.234796 
1 1 1    5   20   14 o   51.191   3.4761   52.755   7.1921   47.417   9.1337   61.465   11.668   47.884   4.6248   54.498   5.1909 -6.613888 6.952268 
1 1 1    5   20   15 o  181.408   3.6872  679.793   27.551  656.911   37.797  705.734   40.244  178.166   5.1437  184.650   5.2843 -6.484344 7.374352 
1 1 1    5   20   16 o   98.089   3.0454  197.735   12.259  171.881   16.698  227.965   18.056   91.167   4.4407  105.010   4.1688 -13.84284 6.090860 
1 1 1    5   20   17 o  343.784   3.1449  2439.79   43.965  2416.59   57.422  2472.66   68.346  341.895   4.0721  345.673   4.7938 -3.777771 6.289899 
1 1 1    5   20   18 o  134.580   2.5864  376.742   13.780  383.344   17.303  365.294   22.786  136.242   3.0792  132.917   4.1564 3.325180 5.172793 
1 1 1    5   20   19 o   34.678   7.4969   28.053   9.1694   31.012   9.4799 -14.9170   36.126   38.670   5.9438   30.687   13.765 7.982950 14.99387 
1 1 1    5   20   20 o  174.757   2.9299  631.685   21.115  621.978   29.973  641.248   29.749  173.418   4.1905  176.095   4.0960 -2.677261 5.859855 
1 1 1    5   20   21 o  146.501   3.2623  445.951   19.596  426.185   28.953  462.659   26.620  143.460   4.8933  149.542   4.3159 -6.081390 6.524670 
1 1 1    5   20   22 o   32.311   6.3561   22.548   8.4974   23.271   10.416   21.110   14.694   32.761   7.8173   31.862   10.024 0.8991966 12.71222 
1 1 1    5   20   23 o  153.023   3.6177  485.179   22.828  495.890   32.661  474.949   31.920  154.673   5.1198  151.373   5.1127 3.300034 7.235488 
1 1 1    5   20   24 o   48.371   7.6975   45.586   11.084   43.765   11.900   57.520   30.458   45.863   6.2908   50.878   14.051 -5.014885 15.39499 
1 1 1    5   20   25 o   85.172   4.7367  151.174   16.412  152.143   25.425  150.483   21.488   85.327   7.2244   85.017   6.1281 0.3101425 9.473430 
1 1 1    5   20   26 f  145.172   3.7065  442.046   21.866  411.864   33.250  465.045   29.025  140.654   5.7315  149.690   4.7012 -9.036301 7.412978 
1 1 1    5   20   27 o   49.164   6.2441   53.457   11.077   55.444   13.158   48.623   20.523   51.534   6.1906   46.793   10.846 4.740887 12.48825 
1 1 1    5   20   28 o   43.052   10.003   43.058   20.585   52.357   23.269   9.5889   44.147   48.106   11.814   37.997   16.146 10.10958 20.00623 
1 1 1    5   20   29 o   46.691   7.7124   48.527   14.633   60.321   21.837   38.915   19.715   51.891   10.562   41.490   11.241 10.40076 15.42486 
1 1 1    5   20   30 o   69.633   5.4695  104.469   15.527   92.145   22.760  115.198   21.236   65.539   8.4197   73.727   6.9837 -8.187592 10.93908 
1 1 1    5   20   31 o   74.304   6.1505  115.661   18.498  136.360   29.870  102.784   23.560   79.389   9.1224   69.220   8.2522 10.16830 12.30110 
1 1 1    5   20   32 o   25.929   7.6170   4.1106   14.023  -7.9184   20.688   14.335   19.074   22.789   10.302   29.069   11.222 -6.279751 15.23395 
1 1 1    5   20   33 o   26.991   7.9087   7.1781   14.503   11.921   20.719   2.6213   20.309   28.640   11.496   25.343   10.864 3.296919 15.81737 
1 1 1    5   20   34 o   34.798   7.8745   22.458   14.360   47.955   21.815   2.9618   19.076   44.849   11.678   24.746   10.566 20.10238 15.74904 
1 1 1    5   20   35 o   28.778   7.9007   10.543   14.758  -7.4297   21.359   26.965   20.416   23.041   10.437   34.515   11.864 -11.47347 15.80142 
1 1 1    5   20   36 o   27.084   8.2712  -0.9815   16.467   18.483   27.808 -11.4938   20.436   32.718   13.253   21.451   9.8999 11.26677 16.54232 
1 1 1    5   20   37 o   27.691   7.9978   8.2030   15.101   22.214   21.978  -4.3282   20.784   32.209   12.141   23.173   10.415 9.036070 15.99562 
1 1 1    5   20   38 o   46.690   9.2109   55.406   18.360   68.613   28.258   45.757   24.153   51.262   13.264   42.118   12.784 9.143974 18.42172 
1 1 1    5   20   39 o   30.698   8.4059   20.180   15.313   14.917   21.804   25.302   21.511   28.773   11.706   32.624   12.067 -3.851900 16.81188 
1 1 1    5   20   40 o   35.716   8.3999   32.684   14.893   42.850   21.255   22.879   20.874   40.231   11.944   31.200   11.815 9.031038 16.79989 
1 1 1    5   20   41 o   26.321   7.8882   2.5318   16.500 -21.6390   23.238   27.105   23.431   20.148   9.6693   32.493   12.466 -12.34531 15.77640 
1 1 1    5   20   42 o   38.261   8.8143   41.376   16.320   50.957   23.163   31.930   22.999   42.451   12.432   34.071   12.498 8.379211 17.62854 
1 1 1    5   20   43 o   34.040   9.3542   34.285   18.512   38.802   29.638   31.395   23.705   35.101   13.860   32.980   12.566 2.120983 18.70839 
1 1 1    5   20   44 f   32.045   9.9868   29.769   26.508   39.145   31.216   5.5264   50.193   34.375   13.998   29.716   14.248 4.659103 19.97352 
1 1 1    5   20   45 o   27.423   8.7517   15.079   20.917   16.197   31.301   14.176   28.116   27.853   12.625   26.994   12.124 0.8598328 17.50336 
1 1 1    5   21    0 o   60.411   2.4019   76.019   8.4024   76.019   8.4024   76.019   8.4024   60.411   3.3968   60.411   3.3968 0.000000 0.000000 
1 1 1    5   21    1 o  185.620   2.0860  710.352   15.957  690.799   22.030  731.931   23.144  182.938   2.9197  188.302   2.9800 -5.363892 4.171924 
1 1 1    5   21    2 o  136.313   2.1425  385.205   11.988  362.123   17.494  405.644   16.461  132.439   3.2026  140.188   2.8470 -7.749222 4.285077 
1 1 1    5   21    3 o  199.872   3.0932  816.773   25.178  773.674   32.739  879.159   39.389  193.513   4.1019  206.231   4.6308 -12.71844 6.186313 
1 1 1    5   21    4 o  200.792   2.2815  824.532   18.515  794.915   23.720  870.722   29.622  196.240   2.9306  205.343   3.4976 -9.103119 4.563074 
1 1 1    5   21    5 o  240.656   2.2785  1195.80   22.614  1212.99   31.953  1178.54   32.008  242.392   3.1962  238.921   3.2482 3.471161 4.557014 
1 1 1    5   21    6 o  248.051   2.3402  1270.39   23.942  1275.34   33.854  1265.44   33.864  248.535   3.3026  247.567   3.3165 0.9681244 4.680403 
1 1 1    5   21    7 o  214.391   2.8839  936.190   23.013  919.021   27.091  980.690   43.615  210.992   3.1131  217.791   4.8554 -6.799210 5.767746 
1 1 1    5   21    8 o  203.769   3.3825  855.107   28.340  818.875   38.304  898.926   42.124  199.031   4.6662  208.507   4.8983 -9.476227 6.765062 
1 1 1    5   21    9 o   40.869   7.5660   29.138   6.6153   28.562   6.7773   40.743   30.440   37.175   4.4202   44.563   14.472 -7.388046 15.13209 
1 1 1    5   21   10 o  113.168   2.3545  261.546   10.671  252.768   13.453  276.436   17.521  110.653   2.9478  115.684   3.6722 -5.030876 4.708969 
1 1 1    5   21   11 o   97.504   3.3724  177.434   10.293  168.230   11.202  227.313   26.078   90.267   3.0089  104.742   6.0365 -14.47495 6.744822 
1 1 1    5   21   12 o   67.574   3.0592   94.442   8.5118   93.646   12.374   95.157   11.727   67.299   4.4578   67.850   4.1907 -0.5511169 6.118353 
1 1 1    5   21   13 o  162.926   2.4334  546.860   16.069  540.735   20.821  555.883   25.271  161.824   3.1196  164.028   3.7354 -2.204758 4.866716 
1 1 1    5   21   14 o   92.695   3.0455  174.365   11.535  149.826   15.182  207.870   17.740   85.123   4.3243  100.267   4.2897 -15.14420 6.091064 
1 1 1    5   21   15 f  106.146   2.8384  232.148   12.405  216.456   17.010  249.976   18.131  102.326   4.0305  109.966   3.9976 -7.640137 5.676765 
1 1 1    5   21   16 o  126.066   2.9424  320.392   15.078  378.916   23.935  281.882   19.416  135.362   4.2871  116.769   4.0314 18.59255 5.884859 
1 1 1    5   21   17 o   50.585   3.8899   50.626   7.9124   42.548   9.9329   64.652   13.089   45.321   5.3138   55.849   5.6823 -10.52772 7.779783 
1 1 1    5   21   18 o  209.573   2.7179  899.621   23.228  855.967   30.341  961.444   36.106  203.516   3.6146  215.630   4.0598 -12.11479 5.435767 
1 1 1    5   21   19 o   95.348   5.7206  168.935   17.131  158.964   18.643  223.022   43.421   87.602   5.1599  103.095   10.212 -15.49294 11.44126 
1 1 1    5   21   20 o  102.078   2.9796  214.003   12.018  210.218   14.922  220.992   20.275  100.847   3.5875  103.309   4.7584 -2.461494 5.959273 
1 1 1    5   21   21 o  117.098   3.9973  284.263   15.232  284.142   16.958  284.766   34.654  117.247   3.5067  116.949   7.1845 0.2984085 7.994597 
1 1 1    5   21   22 o   51.985   5.1982   56.040   10.597   40.695   14.063   76.200   16.119   43.444   8.1480   60.526   6.4571 -17.08217 10.39634 
1 1 1    5   21   23 o  155.210   3.3525  496.354   21.192  480.950   27.663  518.234   32.969  152.369   4.4019  158.050   5.0577 -5.681076 6.704984 
1 1 1    5   21   24 o  114.770   3.0207  270.574   13.786  264.220   17.241  281.842   22.959  112.986   3.6996  116.553   4.7761 -3.566200 6.041363 
1 1 1    5   21   25 f  247.375   2.9246  1254.54   29.127  1207.83   37.034  1330.31   47.165  241.521   3.7177  253.228   4.5158 -11.70699 5.849278 
1 1 1    5   21   26 o  173.191   3.1213  620.374   22.230  594.921   30.082  650.998   32.997  169.319   4.3076  177.064   4.5183 -7.745102 6.242640 
1 1 1    5   21   27 o  137.547   3.7394  397.655   20.983  372.002   31.479  418.164   28.147  133.389   5.7219  141.706   4.8159 -8.316467 7.478861 
1 1 1    5   21   28 o   68.004   4.4832   96.579   11.431   95.669   13.565   98.806   21.227   67.724   4.8565   68.283   7.5373 -0.5589523 8.966406 
1 1 1    5   21   29 o   58.443   4.9900   71.566   10.751   70.488   12.608   74.439   20.582   58.005   5.2701   58.881   8.4750 -0.8767014 9.979948 
1 1 1    5   21   30 o  104.148   3.4229  218.371   13.757  204.198   16.503  250.650   24.905   99.031   4.0404  109.265   5.5265 -10.23370 6.845890 
1 1 1    5   21   31 o   39.253   8.6440   35.823   15.787   43.193   21.643   27.443   23.079   42.859   11.848   35.647   12.590 7.212025 17.28805 
1 1 1    5   21   32 o   34.204   8.1969   25.221   13.969   33.598   20.555   18.032   19.042   37.950   11.843   30.458   11.336 7.491547 16.39370 
1 1 1    5   21   33 o   24.342   7.5082  -1.9631   14.522   7.2877   20.597 -11.1087   20.479   26.917   11.206   21.767   9.9963 5.149433 15.01648 
1 1 1    5   21   34 o  109.678   4.0677  254.082   18.292  268.733   27.686  242.731   24.369  112.341   5.9752  107.015   5.5211 5.326248 8.135473 
1 1 1    5   21   35 f   36.145   8.2615   29.879   14.990   14.930   21.338   44.444   21.062   29.550   11.731   42.740   11.635 -13.18929 16.52293 
1 1 1    5   21   36 o   38.542   8.7090   37.863   16.577   20.191   27.550   47.891   20.754   32.852   13.232   44.231   11.327 -11.37881 17.41797 
1 1 1    5   21   37 o   38.450   9.1367   37.834   17.798   46.628   22.859   24.294   28.363   42.866   12.292   34.034   13.521 8.832272 18.27333 
1 1 1    5   21   38 o   21.026   7.1461 -26.2806   17.955 -28.8765   27.320 -24.3070   23.822   21.559   10.382   20.492   9.8227 1.066816 14.29213 
1 1 1    5   21   39 o   19.489   6.5642 -18.9953   14.553 -21.2570   20.532 -16.7123   20.629   19.061   9.1318   19.918   9.4320 -0.8577499 13.12830 
1 1 1    5   21   40 o   22.178   7.1764  -4.9643   14.757  -2.1002   21.122  -7.6955   20.626   22.934   10.385   21.423   9.9076 1.511101 14.35288 
1 1 1    5   21   41 o   39.680   8.3203   42.040   15.563   24.609   21.312   61.954   22.779   31.277   11.915   48.084   11.616 -16.80654 16.64060 
1 1 1    5   21   42 o   24.310   7.6514   2.8916   15.824  -7.4902   22.680   12.739   22.088   21.951   10.233   26.670   11.379 -4.718769 15.30280 
1 1 1    5   21   43 o   31.316   8.7127   27.250   16.785   19.810   24.083   34.278   23.406   28.815   12.067   33.818   12.571 -5.002367 17.42546 
1 1 1    5   21   44 o   26.048   8.7353  -2.8897   26.306   15.505   31.520 -45.1035   47.750   27.941   12.666   24.156   12.033 3.785439 17.47066 
1 1 1    5   21   45 o   28.266   8.8493   13.164   21.396   44.150   31.906 -12.1580   28.843   34.126   14.053   22.407   10.758 11.71988 17.69855 
1 1 1    5   22    0 o  228.106   2.2214  1074.22   29.543  1074.22   29.543  1074.22   29.543  228.106   3.1416  228.106   3.1416 0.000000 0.000000 
1 1 1    5   22    1 f  165.060   2.3782  562.965   16.176  587.514   22.810  538.131   22.943  168.688   3.2786  161.432   3.4458 7.255066 4.756338 
1 1 1    5   22    2 o  211.841   2.6204  927.695   21.787  924.171   36.980  929.568   26.964  211.483   4.2396  212.199   3.0809 -0.7164459 5.240839 
1 1 1    5   22    3 o  121.120   2.0984  302.979   10.445  301.045   15.417  304.620   14.200  120.758   3.0955  121.483   2.8340 -0.7255020 4.196833 
1 1 1    5   22    4 o  116.222   2.2605  287.839   10.423  320.605   13.533  240.046   16.343  124.637   2.6325  107.807   3.6756 16.83012 4.521077 
1 1 1    5   22    5 o  368.354   3.1373  2808.13   47.355  2772.70   70.891  2836.68   63.635  366.203   4.6936  370.505   4.1642 -4.302673 6.274611 
1 1 1    5   22    6 o  181.639   2.5540  687.880   18.365  658.112   30.260  705.239   23.107  178.456   4.1112  184.822   3.0313 -6.366714 5.107902 
1 1 1    5   22    7 o  417.003   3.9665  3602.14   64.084  3605.38   78.240  3595.54  111.701  417.575   4.5429  416.430   6.5036 1.145477 7.933076 
1 1 1    5   22    8 o  117.743   3.0622  275.701   12.731  266.122   14.504  307.861   26.576  113.527   3.0976  121.959   5.2833 -8.431908 6.124462 
1 1 1    5   22    9 o  332.714   4.4937  2296.01   48.465  2296.64   53.898  2293.35  110.761  333.380   3.9199  332.049   8.0876 1.330933 8.987459 
1 1 1    5   22   10 o  339.574   3.6761  2390.61   50.093  2404.42   63.952  2368.70   80.579  340.988   4.5472  338.160   5.7774 2.828033 7.352277 
1 1 1    5   22   11 o  130.083   3.2095  362.266   15.010  376.233   17.574  324.603   28.858  134.977   3.1567  125.188   5.5891 9.788223 6.418966 
1 1 1    5   22   12 o  165.936   2.4679  568.183   16.717  564.234   22.078  573.490   25.592  165.282   3.2387  166.591   3.7247 -1.308701 4.935897 
1 1 1    5   22   13 o   72.489   3.3354  108.491   9.7990  109.986   15.404  107.475   12.700   72.886   5.1244   72.092   4.2710 0.7931213 6.670897 
1 1 1    5   22   14 o  147.656   2.5669  442.651   15.439  403.611   20.015  500.010   24.261  139.770   3.4720  155.542   3.7818 -15.77182 5.133889 
1 1 1    5   22   15 o  250.936   2.7160  1296.36   27.647  1273.39   35.835  1330.15   43.454  248.251   3.4998  253.622   4.1541 -5.371704 5.431911 
1 1 1    5   22   16 o  137.173   2.5574  386.357   14.273  374.289   18.580  403.727   22.292  134.598   3.3469  139.748   3.8676 -5.150192 5.114717 
1 1 1    5   22   17 o  182.935   3.2467  698.070   21.717  704.631   25.462  680.557   41.602  184.676   3.3429  181.195   5.5667 3.480118 6.493327 
1 1 1    5   22   18 o  127.064   3.0768  334.110   15.936  334.327   21.001  333.815   24.470  127.145   4.0047  126.983   4.6722 0.1624527 6.153629 
1 1 1    5   22   19 o   24.971   7.6266   3.1856   10.515  -8.1119   29.480   4.8325   11.256   28.640   12.665   21.303   8.5003 7.337360 15.25315 
1 1 1    5   22   20 o   32.327   6.8608   24.861   9.0375   28.920   9.5317 -11.2682   28.437   37.308   6.1944   27.346   12.244 9.962008 13.72153 
1 1 1    5   22   21 o   91.853   3.1082  170.711   11.333  160.769   14.040  189.301   19.199   88.149   3.8618   95.558   4.8713 -7.409477 6.216367 
1 1 1    5   22   22 o  197.953   3.4259  808.135   27.827  769.928   37.178  856.804   41.961  192.702   4.6777  203.204   5.0066 -10.50185 6.851827 
1 1 1    5   22   23 o  191.164   2.8008  755.017   21.690  746.907   28.077  767.022   34.159  189.970   3.5834  192.359   4.3055 -2.388229 5.601661 
1 1 1    5   22   24 o  201.648   2.9572  842.994   24.486  843.538   33.120  842.339   36.365  201.770   3.9798  201.527   4.3750 0.2426758 5.914361 
1 1 1    5   22   25 o   87.998   3.5350  165.626   12.160  176.956   15.278  146.048   20.084   92.360   4.0108   83.636   5.8222 8.724655 7.069959 
1 1 1    5   22   26 o  117.035   3.4495  284.523   15.688  282.822   19.183  287.959   27.260  116.707   3.9852  117.363   5.6316 -0.6554794 6.899044 
1 1 1    5   22   27 o   58.975   4.8341   61.763   10.598   48.251   12.177  103.967   21.521   47.916   6.1615   70.034   7.4504 -22.11754 9.668127 
1 1 1    5   22   28 o   46.973   5.7228   42.494   10.100   34.762   11.847   63.061   19.323   39.817   7.4892   54.130   8.6552 -14.31318 11.44553 
1 1 1    5   22   29 o   50.205   7.6264   46.306   10.711   42.935   11.372   72.803   31.883   45.130   6.1093   55.279   13.976 -10.14906 15.25282 
1 1 1    5   22   30 o   40.626   6.8317   37.304   10.327   37.148   12.057   37.736   20.006   41.052   7.3929   40.200   11.491 0.8520546 13.66333 
1 1 1    5   22   31 o  134.196   3.5383  376.287   19.510  346.922   26.247  412.547   29.166  128.413   4.9556  139.979   5.0518 -11.56554 7.076621 
1 1 1    5   22   32 o   81.018   4.9735  140.476   16.484  117.668   22.574  166.528   24.126   73.820   7.4144   88.217   6.6309 -14.39688 9.946972 
1 1 1    5   22   33 o   45.200   8.0911   48.913   15.224   40.825   21.572   56.938   21.489   41.221   11.976   49.179   10.882 -7.957272 16.18213 
1 1 1    5   22   34 f   46.709   7.6028   53.983   15.755   23.727   23.130   80.168   21.518   33.369   12.479   60.048   8.6884 -26.67916 15.20565 
1 1 1    5   22   35 o   37.568   8.4279   34.431   15.439   20.737   22.835   45.962   20.955   31.899   12.289   43.237   11.537 -11.33817 16.85573 
1 1 1    5   22   36 o   52.547   7.4119   69.658   15.683   38.126   22.974   97.171   21.460   38.924   12.566   66.171   7.8632 -27.24700 14.82378 
1 1 1    5   22   37 o   21.758   7.3712 -35.0989   19.808  -6.2050   27.304 -67.2007   28.780   25.383   11.615   18.133   9.0795 7.250391 14.74233 
1 1 1    5   22   38 o   71.292   5.3844  114.637   15.775  111.271   23.055  117.600   21.631   70.009   7.9844   72.576   7.2262 -2.567551 10.76888 
1 1 1    5   22   39 o   70.947   5.4839  115.486   16.040  114.300   22.936  116.620   22.439   70.463   7.8919   71.430   7.6166 -0.9670029 10.96789 
1 1 1    5   22   40 o   41.854   8.2185   47.484   14.778   42.630   21.301   51.989   20.520   39.370   12.018   44.339   11.214 -4.969128 16.43692 
1 1 1    5   22   41 o   20.552   6.8079 -14.7615   15.055 -32.5526   21.424   2.5943   21.161   17.418   8.5628   23.685   10.586 -6.266922 13.61581 
1 1 1    5   22   42 o   52.226   8.6739   77.502   18.226   85.376   27.896   71.638   24.074   53.991   12.734   50.462   11.781 3.528587 17.34781 
1 1 1    5   22   43 o   22.817   7.6267  -6.5121   18.043  -5.5595   30.756  -7.0120   22.280   24.318   11.516   21.315   10.003 3.003542 15.25335 
1 1 1    5   22   44 o   26.911   8.9010   9.7025   23.856 -14.6293   50.122   16.829   27.126   26.532   13.054   27.289   12.104 -0.7564888 17.80204 
1 1 1    5   23    0 o   33.979   3.3756   25.212   6.3110   25.212   6.3110   25.212   6.3110   33.979   4.7739   33.979   4.7739 0.000000 0.000000 
1 1 1    5   23    1 o  120.891   1.9752  301.485   9.8446  294.268   13.688  309.220   14.169  119.394   2.7797  122.388   2.8070 -2.994461 3.950410 
1 1 1    5   23    2 o  304.240   3.1173  1921.78   37.314  1886.68   62.763  1940.97   46.406  301.963   5.0395  306.517   3.6707 -4.554199 6.234618 
1 1 1    5   23    3 o   85.237   2.1499  149.516   7.5450  158.790   11.074  141.483   10.307   87.695   3.0618   82.780   3.0190 4.915337 4.299887 
1 1 1    5   23    4 o  165.609   2.1506  569.542   14.542  592.349   19.473  540.790   21.865  169.394   2.7872  161.823   3.2759 7.571487 4.301180 
1 1 1    5   23    5 o  133.155   2.4481  358.798   12.684  388.354   22.344  344.744   15.408  137.087   3.9518  129.223   2.8909 7.864182 4.896290 
1 1 1    5   23    6 o   84.737   2.7315  154.399   9.0056  128.197   14.741  170.003   11.375   78.736   4.5392   90.738   3.0395 -12.00272 5.462921 
1 1 1    5   23    7 o  150.917   3.0328  464.930   17.741  453.884   21.542  488.218   31.279  148.229   3.5236  153.606   4.9372 -5.377289 6.065588 
1 1 1    5   23    8 o  321.852   3.4159  2135.06   41.885  2121.68   50.300  2165.31   75.647  320.419   3.8061  323.285   5.6733 -2.865997 6.831769 
1 1 1    5   23    9 o  222.954   3.9214  1040.47   27.518  1046.44   30.383  1013.21   64.914  225.084   3.2728  220.824   7.1273 4.259460 7.842840 
1 1 1    5   23   10 o  123.228   3.2840  306.810   14.635  299.190   16.911  329.538   29.207  120.344   3.4071  126.112   5.6153 -5.767143 6.568053 
1 1 1    5   23   11 o  271.631   3.1970  1524.38   32.995  1521.34   39.580  1531.31   59.740  271.351   3.5366  271.911   5.3268 -0.5603638 6.393935 
1 1 1    5   23   12 o   81.409   3.7244  136.967   12.505  136.967   12.505   0.0000   0.0000   81.409   3.7244  ?   ?       ?      ? 
1 1 1    5   23   13 f  139.133   4.2477  376.297   17.071  366.800   18.338  437.968   46.729  133.247   3.3368  145.019   7.8126 -11.77225 8.495369 
1 1 1    5   23   14 o   48.994   5.0928   60.543   8.5555   20.693   12.869   92.110   11.453   31.250   9.2970   66.738   4.1610 -35.48800 10.18565 
1 1 1    5   23   15 o  135.821   3.3214  375.529   17.399  399.530   31.062  364.556   21.003  138.848   5.4241  132.794   3.8347 6.053238 6.642742 
1 1 1    5   23   16 o   55.397   3.2799   62.489   7.4236   56.170   9.7190   71.339   11.502   52.095   4.5233   58.698   4.7509 -6.603600 6.559825 
1 1 1    5   23   17 o   59.234   3.5870   74.711   8.5219   87.630   11.528   59.146   12.654   65.076   4.2952   53.392   5.7461 11.68418 7.173950 
1 1 1    5   23   18 o  216.856   3.0098  950.198   25.459  905.733   30.957  1043.11   44.748  209.313   3.5859  224.400   4.8349 -15.08682 6.019547 
1 1 1    5   23   19 o  183.916   3.0676  700.106   23.162  703.150   34.490  697.607   31.259  184.245   4.5387  183.587   4.1282 0.6576385 6.135285 
1 1 1    5   23   20 o  136.367   2.6407  383.760   14.326  380.975   17.993  388.582   23.679  135.752   3.2136  136.983   4.1912 -1.230713 5.281394 
1 1 1    5   23   21 o  204.350   3.6378  869.223   29.527  874.760   37.135  859.704   48.688  205.433   4.3828  203.267   5.8075 2.165894 7.275667 
1 1 1    5   23   22 o   75.055   3.7165  116.685   10.823  115.865   13.210  118.360   18.878   74.756   4.2843   75.354   6.0741 -0.5980453 7.433044 
1 1 1    5   23   23 o   59.809   4.4547   81.050   9.8444   92.633   12.121   58.603   16.874   66.815   4.3984   52.803   7.7479 14.01176 8.909348 
1 1 1    5   23   24 o   61.444   5.0863   79.057   12.799   82.904   19.462   76.124   16.990   62.695   7.5265   60.193   6.8435 2.502007 10.17260 
1 1 1    5   23   25 o   44.190   5.7733   47.609   9.3011   57.249   11.439   28.799   15.979   52.357   5.2971   36.022   10.260 16.33467 11.54659 
1 1 1    5   23   26 o   22.230   5.7396   5.8905   8.3814   16.588   10.140 -17.1859   14.893   27.657   8.2581   16.803   7.9734 10.85328 11.47918 
1 1 1    5   23   27 o   55.621   4.7998   63.660   10.228   60.627   12.238   70.686   18.624   53.737   5.5218   57.504   7.8525 -3.767181 9.599582 
1 1 1    5   23   28 o   53.019   5.9755   69.843   10.889   82.635   13.215   42.791   19.218   62.806   5.1017   43.232   10.807 19.57342 11.95093 
1 1 1    5   23   29 o   37.995   6.3262   38.567   9.7025   46.897   11.221   13.892   19.313   47.080   5.7788   28.909   11.256 18.17141 12.65240 
1 1 1    5   23   30 o   41.245   6.2823   50.875   11.046   66.871   12.743   2.5398   22.152   56.246   5.4932   26.244   11.300 30.00214 12.56468 
1 1 1    5   23   31 o   33.877   6.4451   28.798   9.5044   34.585   10.920   10.712   19.304   40.213   6.5838   27.541   11.082 12.67192 12.89021 
1 1 1    5   23   32 o   18.570   5.9174  -2.7534   8.6277   1.5737   9.6387 -20.1957   19.352   18.025   7.5954   19.116   9.0759 -1.090830 11.83479 
1 1 1    5   23   33 o   45.180   7.9006   49.083   14.648   52.443   21.036   45.921   20.408   46.749   11.079   43.611   11.266 3.138554 15.80118 
1 1 1    5   23   34 o   33.296   7.2289   27.114   10.279   29.722   11.572   17.358   22.380   36.056   7.9913   30.537   12.049 5.519117 14.45789 
1 1 1    5   23   35 o   77.963   4.4471  133.161   13.197  136.302   16.009  126.500   23.316   80.153   4.8426   75.774   7.4604 4.378601 8.894244 
1 1 1    5   23   36 o   32.227   7.9244   18.513   15.288  -6.7493   21.256   45.587   22.005   22.486   10.273   41.967   12.068 -19.48122 15.84873 
1 1 1    5   23   37 o   32.302   9.2138   21.497   20.333  -4.8941   35.142   34.778   24.929   28.187   12.999   36.417   13.061 -8.230270 18.42755 
1 1 1    5   23   38 o   27.879   8.3907   12.309   16.383   11.556   20.425   13.668   27.433   26.598   11.123   29.160   12.565 -2.562315 16.78136 
1 1 1    5   23   39 o   54.943   6.7443   73.603   14.923   80.256   21.419   67.326   20.803   58.086   8.9405   51.800   10.100 6.285728 13.48868 
1 1 1    5   23   40 o   28.124   8.0042   17.038   14.446   24.274   20.747   10.229   20.126   30.684   11.740   25.565   10.883 5.119497 16.00850 
1 1 1    5   23   41 o   27.680   8.1593   15.500   15.931   4.9764   22.685   25.741   22.378   24.556   10.969   30.804   12.082 -6.248240 16.31858 
1 1 1    5   23   42 o   47.431   9.0802   69.027   18.190   61.204   24.588   78.486   27.035   44.360   12.757   50.502   12.925 -6.142273 18.16039 
1 1 1    5   23   43 o   26.249   8.5120   9.8040   20.800   11.325   31.085   8.5707   27.989   26.787   12.307   25.711   11.763 1.076223 17.02403 
1 1 1    5   24    0 o   26.898   4.3226   17.068   5.9119   17.068   5.9119   17.068   5.9119   26.898   6.1131   26.898   6.1131 0.000000 0.000000 
1 1 1    5   24    1 o  174.294   2.2339  624.689   15.760  613.708   20.330  641.225   24.948  172.406   2.8590  176.182   3.4333 -3.775970 4.467791 
1 1 1    5   24    2 o  156.831   2.5126  499.450   15.848  546.456   25.892  471.287   20.041  162.604   3.8607  151.058   3.2167 11.54645 5.025157 
1 1 1    5   24    3 o  170.001   2.1690  594.191   15.108  618.906   22.903  575.153   20.102  173.106   3.2079  166.897   2.9202 6.209076 4.338032 
1 1 1    5   24    4 o   42.200   4.2043   36.823   7.3176   0.0000   0.0000   36.823   7.3176  ?   ?    42.200   4.2043      ?      ? 
1 1 1    5   24    5 o   99.291   2.6499  213.299   10.222  171.152   16.582  239.134   12.982   90.967   4.4196  107.615   2.9249 -16.64787 5.299850 
1 1 1    5   24    6 o   96.740   2.8561  193.568   11.379  191.543   16.495  195.407   15.718   96.250   4.1553   97.230   3.9196 -0.9799881 5.712212 
1 1 1    5   24    7 o   92.435   2.5859  168.269   9.5855  142.834   11.964  213.864   16.019   83.147   3.4887  101.723   3.8180 -18.57599 5.171866 
1 1 1    5   24    8 o  167.297   3.8311  567.376   19.116  561.926   20.748  598.003   49.182  164.953   3.0496  169.641   7.0293 -4.688049 7.662285 
1 1 1    5   24    9 o  198.690   3.0675  821.201   23.712  830.815   29.149  802.393   40.771  200.520   3.5245  196.861   5.0215 3.658890 6.134936 
1 1 1    5   24   10 o  260.166   3.1647  1403.22   31.335  1407.82   37.688  1392.92   56.398  261.021   3.5008  259.310   5.2732 1.710175 6.329464 
1 1 1    5   24   11 o  213.062   3.5730  940.112   31.377  941.367   43.602  938.764   45.188  213.226   4.9580  212.898   5.1462 0.3280487 7.145929 
1 1 1    5   24   12 o  186.601   3.1963  698.248   22.713  665.071   27.017  778.213   41.944  179.385   3.6516  193.817   5.2470 -14.43181 6.392598 
1 1 1    5   24   13 o  255.269   4.1930  1344.56   33.547  1340.59   36.919  1363.38   80.344  254.693   3.5145  255.845   7.6139 -1.152084 8.385936 
1 1 1    5   24   14 o  229.232   2.6254  1088.22   24.563  1099.72   32.568  1073.04   37.406  230.682   3.4231  227.782   3.9816 2.900253 5.250768 
1 1 1    5   24   15 o  152.835   2.8663  484.091   18.031  453.158   25.686  514.141   25.317  147.995   4.2080  157.676   3.8929 -9.680969 5.732579 
1 1 1    5   24   16 o   74.102   2.8943  113.833   8.6401  114.675   11.110  112.544   13.743   74.476   3.6170   73.728   4.5195 0.7475204 5.788646 
1 1 1    5   24   17 o  107.115   2.9388  236.583   12.959  220.881   17.703  254.709   19.021  103.301   4.1550  110.930   4.1573 -7.628487 5.877682 
1 1 1    5   24   18 o   63.127   3.5183   83.918   8.9867   90.853   11.936   74.843   13.654   66.225   4.3700   60.028   5.5151 6.197670 7.036608 
1 1 1    5   24   19 o  278.379   4.0548  1610.99   46.519  1592.58   64.357  1631.13   67.317  276.754   5.6382  280.004   5.8290 -3.250519 8.109637 
1 1 1    5   24   20 o   40.710   4.5437   33.578   7.4286   30.489   9.3253   38.943   12.289   38.259   5.9097   43.161   6.9034 -4.901974 9.087461 
1 1 1    5   24   21 o   61.605   6.6901   69.387   10.895   65.714   11.541   99.501   33.045   56.238   4.9755   66.971   12.421 -10.73303 13.38027 
1 1 1    5   24   22 f   61.788   4.0947   82.497   9.6298   87.718   11.789   72.030   16.693   64.988   4.3984   58.588   6.9080 6.400780 8.189371 
1 1 1    5   24   23 o   49.892   4.3015   48.783   8.5015   40.757   10.398   64.962   14.765   44.149   5.7105   55.635   6.4345 -11.48531 8.603017 
1 1 1    5   24   24 o   64.399   3.7796   85.582   9.5783   83.039   11.808   90.477   16.379   63.142   4.5340   65.657   6.0485 -2.515182 7.559227 
1 1 1    5   24   25 f  129.167   3.2123  347.810   17.107  335.091   23.861  361.261   24.538  126.732   4.5649  131.603   4.5207 -4.870461 6.424616 
1 1 1    5   24   26 o   90.224   4.1132  170.294   15.234  148.738   20.784  195.315   22.393   84.033   5.9968   96.415   5.6312 -12.38178 8.226311 
1 1 1    5   24   27 o   43.644   5.7401   42.310   9.4684   43.645   11.618   39.669   16.340   45.441   6.1987   41.847   9.6628 3.594791 11.48013 
1 1 1    5   24   28 o   41.720   6.0137   44.520   9.2768   53.090   11.115   24.847   16.841   50.161   5.3727   33.279   10.761 16.88131 12.02732 
1 1 1    5   24   29 o   40.694   6.3083   41.567   10.198   51.108   12.555   23.067   17.483   48.996   6.2130   32.393   10.981 16.60342 12.61659 
1 1 1    5   24   30 o   46.709   7.7398   62.589   11.337   67.530   12.075   25.846   32.930   56.583   5.1742   36.834   14.589 19.74837 15.47969 
1 1 1    5   24   31 o   19.225   6.0264  -0.5486   8.3832   2.4746   9.3836 -12.5031   18.660   18.237   7.5755   20.212   9.3744 -1.974873 12.05270 
1 1 1    5   24   32 o   25.519   6.9123   11.397   8.9759   11.590   10.154   10.706   19.197   23.844   8.3570   27.193   11.013 -3.349127 13.82464 
1 1 1    5   24   33 o   45.951   6.4638   52.158   10.410   56.210   12.109   40.683   20.378   51.249   5.7288   40.653   11.589 10.59617 12.92764 
1 1 1    5   24   34 o   35.105   8.5377   28.572   15.645   41.219   22.197   16.086   22.055   40.430   12.252   29.781   11.894 10.64888 17.07550 
1 1 1    5   24   35 o   49.114   7.6027   63.619   16.285   27.454   24.112   93.950   22.081   33.880   12.727   64.347   8.3201 -30.46683 15.20535 
1 1 1    5   24   36 o   45.291   6.4970   42.796   10.490   35.815   12.040   64.808   21.378   39.356   7.6928   51.225   10.472 -11.86844 12.99407 
1 1 1    5   24   37 o   21.029   5.7452   2.5088   9.5895   17.065   10.741 -54.6853   21.290   26.859   8.5840   15.200   7.6384 11.65947 11.49044 
1 1 1    5   24   38 o   42.831   7.9170   49.798   11.513   50.846   12.339   42.745   32.012   47.898   6.2460   37.765   14.550 10.13241 15.83399 
1 1 1    5   24   39 o   48.912   6.6446   60.519   11.086   61.917   12.740   56.160   22.495   52.905   5.8388   44.919   11.938 7.985325 13.28912 
1 1 1    5   24   40 o   37.119   7.9450   28.948   11.005   21.420   12.194   61.995   25.549   29.019   9.1322   45.219   13.004 -16.19960 15.89001 
1 1 1    5   24   41 o   24.968   7.8971   4.5997   16.873  -6.9489   22.757   18.699   25.145   21.659   10.147   28.276   12.104 -6.616871 15.79424 
1 1 1    5   24   42 o   25.812   8.0542   10.498   16.633   1.1247   21.712   23.816   25.879   22.549   10.332   29.074   12.358 -6.524872 16.10839 
1 1 1    5   25    0 o   51.625   2.4856   55.773   7.4049   55.773   7.4049   55.773   7.4049   51.625   3.5152   51.625   3.5152 0.000000 0.000000 
1 1 1    5   25    1 o  198.549   2.5826  819.417   20.008  829.582   24.673  799.892   34.194  200.427   2.9847  196.671   4.2155 3.756409 5.165126 
1 1 1    5   25    2 o   91.443   2.3618  172.402   8.6750  174.243   13.989  171.251   11.058   91.821   3.6939   91.065   2.9442 0.7559128 4.723642 
1 1 1    5   25    3 o  130.881   2.1482  354.929   11.557  327.385   16.544  381.177   16.151  125.896   3.1862  135.865   2.8822 -9.969513 4.296376 
1 1 1    5   25    4 o  144.682   2.5704  425.458   14.865  460.930   24.648  405.179   18.636  149.311   4.0024  140.053   3.2263 9.257919 5.140812 
1 1 1    5   25    5 o  176.662   2.6847  651.305   19.348  592.048   28.739  700.424   26.166  169.206   4.1181  184.118   3.4456 -14.91203 5.369479 
1 1 1    5   25    6 o   95.615   3.7034  195.393   13.367  173.983   23.688  205.394   16.190   91.558   6.2730   99.673   3.9383 -8.114998 7.406795 
1 1 1    5   25    7 o   94.202   3.6980  191.046   12.123  197.844   13.968  170.283   24.411   97.852   3.4609   90.553   6.5362 7.298317 7.395914 
1 1 1    5   25    8 o   81.876   5.4584  151.531   11.373  155.139   12.115  124.769   32.999   86.652   3.3897   77.100   10.377 9.552299 10.91681 
1 1 1    5   25    9 o  135.872   3.2042  382.979   15.984  384.122   18.755  379.944   30.558  136.351   3.3349  135.393   5.4722 0.9582367 6.408347 
1 1 1    5   25   10 o   77.765   4.3537  125.030   10.565  124.760   11.616  126.321   25.416   77.691   3.6253   77.839   7.9168 -0.1480255 8.707378 
1 1 1    5   25   11 o   94.610   3.9741  190.775   12.041  193.938   13.400  177.504   27.445   96.877   3.3536   92.343   7.2060 4.534294 7.948174 
1 1 1    5   25   12 o  139.752   3.3986  413.440   17.747  426.538   21.221  382.966   32.369  143.647   3.5818  135.856   5.7768 7.791092 6.797120 
1 1 1    5   25   13 o  228.872   4.1546  1087.93   29.239  1088.25   32.045  1086.33   71.442  229.469   3.3859  228.274   7.5881 1.195374 8.309234 
1 1 1    5   25   14 o   95.502   4.0036  188.158   12.199  187.490   13.490  191.152   28.571   95.236   3.4343   95.768   7.2332 -0.5321960 8.007154 
1 1 1    5   25   15 o  281.425   3.5063  1642.37   38.727  1642.72   47.915  1641.71   65.768  281.704   4.1240  281.146   5.6718 0.5581360 7.012572 
1 1 1    5   25   16 o   62.411   3.6271   83.568   8.9636   58.409   12.932  106.834   12.436   52.997   5.9160   71.824   4.1980 -18.82682 7.254113 
1 1 1    5   25   17 f   35.043   5.5058   28.116   7.4101   20.674   13.338   31.439   8.9119   31.198   9.5070   38.887   5.5564 -7.689106 11.01168 
1 1 1    5   25   18 o   92.904   2.7788  177.565   10.396  173.326   13.259  184.328   16.749   91.516   3.5129   94.292   4.3067 -2.776207 5.557682 
1 1 1    5   25   19 o   72.849   3.2052  111.297   9.4693  117.681   12.530  102.794   14.460   75.358   4.0314   70.340   4.9842 5.017921 6.410472 
1 1 1    5   25   20 o  204.189   3.1197  863.690   26.150  885.930   39.126  845.735   35.155  206.500   4.5939  201.877   4.2222 4.622940 6.239423 
1 1 1    5   25   21 o  105.914   3.6933  234.991   16.061  215.821   23.132  252.835   22.318  101.656   5.5172  110.172   4.9115 -8.516129 7.386591 
1 1 1    5   25   22 o   31.064   8.1485   15.217   8.4415   15.073   8.7375   17.229   32.711   26.379   7.6100   35.748   14.411 -9.369528 16.29706 
1 1 1    5   25   23 f   94.710   3.5178  187.753   13.712  175.318   19.515  199.877   19.270   91.558   5.1679   97.861   4.7742 -6.302620 7.035631 
1 1 1    5   25   24 o   41.016   5.2308   36.962   8.1550   38.167   10.090   34.692   13.848   42.608   5.7417   39.424   8.7453 3.184479 10.46169 
1 1 1    5   25   25 o   22.942   5.8511   3.9451   7.2830  -3.1435   8.7080   20.446   13.286   15.271   6.8106   30.614   9.5160 -15.34299 11.70211 
1 1 1    5   25   26 o   32.033   7.6823   21.055   11.970   28.205   18.992   16.343   15.419   35.396   11.425   28.670   10.273 6.726295 15.36453 
1 1 1    5   25   27 o   82.632   4.1898  144.911   14.253  143.333   20.728  146.327   19.630   82.129   6.1191   83.135   5.7249 -1.006531 8.379632 
1 1 1    5   25   28 o   44.788   5.8870   48.871   9.5162   55.674   11.501   34.106   16.944   51.318   5.4339   38.258   10.445 13.06019 11.77407 
1 1 1    5   25   29 o   30.126   6.4809   22.057   9.3215   28.148   10.761   3.7450   18.658   35.474   7.5844   24.778   10.511 10.69580 12.96172 
1 1 1    5   25   30 o   19.943   6.0187   2.4455   7.7942   3.6245   8.9129  -1.3864   16.068   18.441   7.4914   21.445   9.4222 -3.003548 12.03743 
1 1 1    5   25   31 o   65.142   7.1458  105.001   12.684  108.455   13.818   86.523   31.963   71.708   4.6722   58.576   13.506 13.13223 14.29154 
1 1 1    5   25   32 o   48.360   6.1212   59.845   10.278   68.748   12.261   38.800   18.851   56.836   5.2304   39.885   11.069 16.95109 12.24244 
1 1 1    5   25   33 o   44.934   6.3624   46.785   10.113   47.063   11.709   45.971   20.060   46.703   6.0787   43.164   11.179 3.539265 12.72479 
1 1 1    5   25   34 f   47.052   7.8201   56.241   14.988   47.301   22.258   63.658   20.274   42.689   12.092   51.415   9.9199 -8.725178 15.64013 
1 1 1    5   25   35 o   66.405   5.0710  106.036   12.084  118.295   14.586   79.210   21.577   74.423   4.7518   58.386   8.9600 16.03726 10.14208 
1 1 1    5   25   36 o   25.669   7.4985   7.9745   10.286   4.6832   11.365   22.886   24.190   20.088   8.3401   31.250   12.464 -11.16105 14.99694 
1 1 1    5   25   37 o   57.115   5.3693   70.986   11.204   66.778   12.988   83.221   22.148   55.211   5.7037   59.019   9.0987 -3.807724 10.73866 
1 1 1    5   25   38 o   27.341   6.5592   19.136   10.107   26.646   11.523  -5.9052   21.042   32.934   8.4435   21.748   10.040 11.18653 13.11846 
1 1 1    5   25   39 f   32.635   7.8777   28.978   11.278   29.871   12.152   23.428   30.297   34.551   8.5692   30.719   13.221 3.831751 15.75537 
1 1 1    5   25   40 o   21.432   6.7941   3.1052   10.172   3.2461   11.258   2.4790   23.733   18.888   8.0927   23.975   10.915 -5.086561 13.58818 
1 1 1    5   25   41 o   32.598   7.1202   33.031   11.438   38.494   12.941   13.527   24.450   38.974   8.3047   26.223   11.568 12.75129 14.24044 
1 1 1    5   26    0 o  276.753   3.4864  1584.23   56.239  1584.23   56.239  1584.23   56.239  276.753   4.9305  276.753   4.9305 0.000000 0.000000 
1 1 1    5   26    1 o  165.277   2.5805  564.180   17.461  567.935   26.383  561.254   23.292  165.744   3.8594  164.810   3.4266 0.9340668 5.161060 
1 1 1    5   26    2 o  162.868   2.5786  547.011   17.208  558.853   25.985  537.761   22.965  164.415   3.8319  161.320   3.4516 3.094772 5.157266 
1 1 1    5   26    3 o  138.442   2.6842  393.308   15.097  412.657   23.719  380.129   19.575  141.258   4.0711  135.626   3.4994 5.631592 5.368362 
1 1 1    5   26    4 o  190.875   2.7360  750.550   21.011  765.583   33.804  741.085   26.821  192.374   4.2604  189.375   3.4339 2.999039 5.472042 
1 1 1    5   26    5 o  150.080   2.5168  467.490   14.879  458.868   24.961  472.241   18.531  148.951   4.0631  151.208   2.9713 -2.257172 5.033645 
1 1 1    5   26    6 o  125.444   2.4873  326.309   12.783  335.564   17.261  315.065   19.025  127.438   3.2839  123.449   3.7366 3.989136 4.974537 
1 1 1    5   26    7 o  125.727   2.7735  325.753   14.350  343.671   21.179  310.544   19.512  128.907   3.9834  122.547   3.8604 6.359543 5.547078 
1 1 1    5   26    8 o   96.860   4.5429  184.566   11.869  181.378   12.618  209.074   34.980   93.691   3.2652  100.028   8.4788 -6.337128 9.085796 
1 1 1    5   26    9 f  201.564   3.3373  843.189   27.346  852.668   35.880  830.052   42.239  202.992   4.2856  200.136   5.1171 2.855743 6.674642 
1 1 1    5   26   10 o  121.568   3.4396  294.837   15.855  278.741   18.770  334.926   29.621  116.088   3.9201  127.049   5.6529 -10.96019 6.879138 
1 1 1    5   26   11 o  116.427   3.5861  280.272   15.384  279.354   18.063  282.695   29.356  116.219   3.7684  116.636   6.1024 -0.4173050 7.172192 
1 1 1    5   26   12 o  135.611   3.4105  375.455   15.305  371.638   17.091  390.912   34.391  134.102   3.0900  137.121   6.0810 -3.019455 6.821021 
1 1 1    5   26   13 o  178.754   3.1612  656.677   20.213  651.322   23.317  672.869   40.547  177.505   3.1849  180.002   5.4616 -2.496338 6.322380 
1 1 1    5   26   14 o  120.101   3.6961  293.204   14.244  289.553   15.745  309.663   33.430  118.339   3.2258  121.862   6.6512 -3.523048 7.392188 
1 1 1    5   26   15 o   63.651   5.2550   65.104   9.4212   59.128   9.9650  115.421   28.915   53.396   4.5248   73.905   9.4860 -20.50915 10.50991 
1 1 1    5   26   16 o   72.287   5.1596   98.263   10.632   94.350   11.362  125.787   30.136   67.476   4.0827   77.097   9.4772 -9.621170 10.31922 
1 1 1    5   26   17 o   78.617   3.6169  129.864   11.297  123.095   18.399  133.960   14.313   76.865   5.8038   80.369   4.3179 -3.503609 7.233822 
1 1 1    5   26   18 o   74.581   2.8648  112.416   8.6491  100.954   11.022  130.781   13.952   69.784   3.8296   79.377   4.2617 -9.593369 5.729580 
1 1 1    5   26   19 o   96.659   3.1561  192.393   12.424  153.391   16.763  239.922   18.505   85.845   4.7345  107.472   4.1748 -21.62748 6.312233 
1 1 1    5   26   20 o   77.914   3.1827  125.815   10.130  122.688   13.357  130.049   15.541   76.822   4.2155   79.005   4.7694 -2.182419 6.365329 
1 1 1    5   26   21 o   31.699   5.3428   21.316   6.9082   15.716   9.0271   29.232   10.732   26.870   7.7302   36.528   7.3773 -9.657909 10.68555 
1 1 1    5   26   22 o   55.625   3.7659   66.446   8.2445   70.936   10.442   59.012   13.435   58.333   4.3401   52.918   6.1556 5.415432 7.531738 
1 1 1    5   26   23 o   80.635   5.4393  133.686   15.724  128.656   18.065  149.408   31.938   78.263   5.5964   83.007   9.3287 -4.743950 10.87865 
1 1 1    5   26   24 o   42.242   5.0769   41.072   7.8641   45.663   9.6717   32.114   13.509   46.674   5.0241   37.810   8.8238 8.864048 10.15385 
1 1 1    5   26   25 o   84.884   3.2509  149.992   10.796  147.643   13.267  154.597   18.575   84.124   3.8236   85.644   5.2587 -1.519424 6.501827 
1 1 1    5   26   26 o  123.911   3.7415  327.420   18.746  304.249   28.916  344.217   24.620  119.775   5.8535  128.048   4.6618 -8.272820 7.483014 
1 1 1    5   26   27 o   64.186   3.9058   82.939   9.7759   75.013   11.794  100.342   17.476   59.729   4.7875   68.644   6.1727 -8.915630 7.811651 
1 1 1    5   26   28 o   58.642   4.6067   78.962   9.9137   87.974   12.062   60.198   17.404   64.733   4.5177   52.551   8.0299 12.18177 9.213476 
1 1 1    5   26   29 o   82.962   3.8174  139.542   11.922  130.582   14.027  162.862   22.628   78.821   4.3146   87.103   6.2988 -8.281715 7.634823 
1 1 1    5   26   30 o   34.143   6.1776   28.592   8.9035   33.621   10.697   17.252   16.064   39.477   6.5697   28.809   10.464 10.66863 12.35521 
1 1 1    5   26   31 o   26.044   7.3881   12.093   9.2902   14.370   9.7111 -12.4810   31.901   25.465   8.1647   26.623   12.316 -1.157904 14.77620 
1 1 1    5   26   32 o   28.243   6.7513   17.829   8.7598   18.509   10.178   15.887   17.203   28.342   8.2242   28.145   10.709 0.1973267 13.50258 
1 1 1    5   26   33 o   20.054   6.3027   0.4420   8.5055   0.9937   9.4336  -1.9551   19.664   17.310   7.4120   22.797   10.196 -5.486443 12.60534 
1 1 1    5   26   34 o   20.200   6.3196  -0.3838   8.5506  -1.8269   9.6234   5.0276   18.636   16.231   7.2039   24.170   10.385 -7.938992 12.63915 
1 1 1    5   26   35 o   21.884   6.9230  -4.0558   13.405 -17.2153   19.156   8.5704   18.764   18.764   8.9431   25.004   10.570 -6.240982 13.84591 
1 1 1    5   26   36 o   30.783   7.3716   23.482   10.137   24.262   11.320   20.327   22.776   31.592   8.5010   29.973   12.046 1.619377 14.74324 
1 1 1    5   26   37 o   29.631   6.9309   23.368   10.018   27.151   11.393   10.476   21.031   33.309   8.3182   25.953   11.089 7.356245 13.86183 
1 1 1    5   26   38 o   33.337   7.4214   29.688   10.727   29.727   12.422   29.571   21.273   34.341   8.7465   32.333   11.992 2.007713 14.84278 
1 1 1    5   26   39 o   24.053   7.6696   7.8250   10.670   8.8776   11.067  -6.0608   40.198   21.390   8.4623   26.716   12.794 -5.326479 15.33925 
1 1 1    5   26   40 o   21.800   6.8332   4.0393   10.286   1.9408   11.647   11.474   21.924   18.403   8.0553   25.197   11.040 -6.794464 13.66631 
1 1 1    5   27    0 o  163.286   2.0212  550.762   19.237  550.762   19.237  550.762   19.237  163.286   2.8585  163.286   2.8585 0.000000 0.000000 
1 1 1    5   27    1 o  112.272   2.2495  262.189   10.159  268.769   13.092  252.230   16.107  114.079   2.7824  110.465   3.5354 3.614815 4.498981 
1 1 1    5   27    2 o  118.548   2.3944  291.706   11.655  266.103   16.732  315.842   16.245  113.458   3.5755  123.638   3.1857 -10.18015 4.788811 
1 1 1    5   27    3 o  143.554   3.4749  438.093   17.328  406.108   35.361  448.201   19.879  139.833   6.1312  147.275   3.2726 -7.441284 6.949892 
1 1 1    5   27    4 o  123.773   3.6132  342.156   16.467  258.552   28.901  382.343   20.037  111.549   6.2818  135.996   3.5723 -24.44716 7.226480 
1 1 1    5   27    5 o  193.687   3.5744  788.978   27.597  826.325   35.285  730.142   44.287  199.814   4.2815  187.560   5.7249 12.25414 7.148822 
1 1 1    5   27    6 o   90.955   4.8778  147.670   11.644  141.243   12.262  206.578   37.124   82.650   3.5972   99.259   9.0682 -16.60822 9.755609 
1 1 1    5   27    7 o   40.655   6.5107   45.867   9.6723   53.996   10.749   11.291   22.169   51.029   5.1075   30.282   11.978 20.74655 13.02142 
1 1 1    5   27    8 o   73.065   4.7017  115.038   13.065  100.661   22.705  122.156   15.975   69.383   7.9344   76.748   5.0468 -7.365219 9.403480 
1 1 1    5   27    9 o  127.979   4.3444  338.700   22.860  367.787   33.999  314.700   30.882  132.954   6.2000  123.005   6.0873 9.949631 8.688782 
1 1 1    5   27   10 o  109.720   4.3643  249.387   19.579  242.074   25.871  259.190   29.953  107.903   5.8132  111.538   6.5111 -3.634415 8.728509 
1 1 1    5   27   11 o  104.101   6.9142  245.347   25.840  193.364   47.659  266.991   30.753   95.046   12.158  113.155   6.5894 -18.10899 13.82847 
1 1 1    5   27   12 o   51.305   9.8178   54.081   18.525   50.128   20.937   68.331   39.751   47.630   10.894   54.980   16.336 -7.349781 19.63562 
1 1 1    5   27   13 o   65.949   6.1079   99.221   10.985  101.938   11.926   84.014   28.215   70.135   4.1229   61.764   11.499 8.371490 12.21583 
1 1 1    5   27   14 o  200.254   3.2863  833.348   24.510  834.750   29.014  829.854   45.803  200.825   3.5029  199.682   5.5615 1.142410 6.572680 
1 1 1    5   27   15 o   72.000   5.3912  105.654   10.362  104.646   11.022  113.320   30.397   71.072   3.7601   72.929   10.106 -1.856819 10.78247 
1 1 1    5   27   16 o   71.367   5.4745  106.412   10.526  106.085   11.232  108.762   30.149   71.526   3.8075   71.207   10.266 0.3188324 10.94898 
1 1 1    5   27   17 o   53.218   8.3311   66.617   9.6848   67.372   10.021   55.924   37.696   56.938   4.2673   49.498   16.107 7.439579 16.66225 
1 1 1    5   27   18 o   79.929   5.6877  143.208   15.730  150.671   18.202  121.189   31.266   84.949   5.1950   74.910   10.120 10.03940 11.37536 
1 1 1    5   27   19 o   49.523   3.2488   51.466   6.5434   53.387   8.6630   48.914   9.9845   50.656   4.1464   48.391   5.0026 2.265362 6.497614 
1 1 1    5   27   20 o   90.007   3.4466  173.107   12.476  133.997   18.077  208.678   17.240   79.920   5.4841  100.093   4.1761 -20.17276 6.893105 
1 1 1    5   27   21 o   41.855   3.9991   36.403   6.7566   34.899   8.6297   38.784   10.861   40.820   5.1257   42.889   6.1398 -2.069294 7.998159 
1 1 1    5   27   22 o   52.214   3.7742   57.091   8.0280   56.385   10.532   58.070   12.402   51.898   4.9205   52.530   5.7242 -0.6314697 7.548378 
1 1 1    5   27   23 o   48.650   3.9077   49.723   7.5533   49.100   9.4660   50.814   12.532   48.379   4.7440   48.920   6.2110 -0.5413666 7.815480 
1 1 1    5   27   24 o   57.658   7.2501   72.193   10.068   71.366   10.603   79.789   32.118   58.367   4.4045   56.950   13.815 1.416729 14.50015 
1 1 1    5   27   25 o   34.251   5.5951   28.569   7.6063   33.484   9.1675   17.712   13.626   39.769   5.5891   28.733   9.6945 11.03646 11.19023 
1 1 1    5   27   26 o   53.436   4.2159   60.628   8.8150   60.547   10.880   60.782   15.038   53.635   4.9184   53.237   6.8487 0.3981171 8.431808 
1 1 1    5   27   27 o   49.705   5.7522   53.103   11.626   60.884   18.411   47.942   14.994   52.535   8.4971   46.874   7.7557 5.660847 11.50441 
1 1 1    5   27   28 o   78.867   3.6729  133.092   11.492  136.746   14.531  126.992   18.777   80.639   4.3691   77.095   5.9051 3.543861 7.345716 
1 1 1    5   27   29 o   50.917   5.5958   65.370   9.7995   77.531   11.961   40.544   17.090   60.541   4.7903   41.292   10.115 19.24867 11.19163 
1 1 1    5   27   30 o   57.904   6.2772   81.698   13.345   43.500   19.292  116.744   18.479   42.190   10.981   73.617   6.0861 -31.42701 12.55447 
1 1 1    5   27   31 o   46.945   5.5331   50.159   9.7995   50.889   12.071   48.748   16.783   48.483   6.0365   45.407   9.2749 3.075840 11.06628 
1 1 1    5   27   32 o   22.400   7.1322   2.3422   8.5494   2.5413   8.9574   0.3047   28.656   17.659   7.3739   27.142   12.211 -9.482712 14.26442 
1 1 1    5   27   33 o   42.039   6.3325   44.324   9.6991   47.359   11.355   36.133   18.652   46.609   5.9069   37.470   11.203 9.138176 12.66504 
1 1 1    5   27   34 o   28.543   6.9541   18.220   8.8894   16.650   10.195   23.198   18.155   26.504   8.3518   30.582   11.121 -4.077782 13.90825 
1 1 1    5   27   35 o   19.940   6.5794 -18.8043   14.613 -48.9521   22.341   3.7368   19.318   16.250   8.1161   23.630   10.358 -7.379797 13.15880 
1 1 1    5   27   36 f   52.308   5.3664   58.910   10.459   53.124   12.183   75.124   20.395   48.846   6.0473   55.769   8.8669 -6.922447 10.73275 
1 1 1    5   27   37 o   24.474   5.8763   11.990   9.8159   26.021   11.344 -29.8331   19.584   32.285   8.4284   16.663   8.1905 15.62196 11.75252 
1 1 1    5   27   38 o   33.236   7.0376   31.110   10.279   33.533   11.963   24.278   20.089   36.756   8.1092   29.717   11.504 7.039011 14.07518 
1 1 1    5   27   39 o   30.606   7.6814   25.535   11.187   23.612   12.954   31.178   22.192   29.580   9.4241   31.631   12.133 -2.051661 15.36283 
1 1 1    5   28    0 o  135.414   1.9661  378.967   15.514  378.967   15.514  378.967   15.514  135.414   2.7805  135.414   2.7805 0.000000 0.000000 
1 1 1    5   28    1 o   68.232   2.4697   94.890   6.6906   91.354   8.3239  101.346   11.246   66.485   3.0356   69.978   3.8964 -3.493011 4.939306 
1 1 1    5   28    2 o  111.731   3.1269  258.041   14.410   0.0000   0.0000  258.041   14.410  ?   ?   111.731   3.1269      ?      ? 
1 1 1    5   28    3 o  163.668   2.6185  539.441   16.904  603.995   29.118  506.629   20.760  170.790   4.1337  156.546   3.2153 14.24474 5.236933 
1 1 1    5   28    4 o  127.125   2.5690  328.704   13.031  356.151   21.704  313.235   16.294  131.160   4.0122  123.091   3.2095 8.069641 5.137941 
1 1 1    5   28    5 o  136.431   2.7109  383.564   15.152  399.318   22.981  371.448   20.153  138.875   4.0121  133.987   3.6468 4.887527 5.421842 
1 1 1    5   28    6 o   46.031   5.9183   50.506   9.5603   34.415   17.671   57.165   11.368   39.598   10.607   52.464   5.2534 -12.86656 11.83654 
1 1 1    5   28    7 o   22.381   6.1697   6.7004   8.2625  -6.6583   16.338   11.291   9.5775   20.744   9.2847   24.017   8.1275 -3.272114 12.33943 
1 1 1    5   28    8 o   56.540   5.1247   65.995   10.410   68.727   20.793   65.081   12.025   57.114   8.8267   55.966   5.2095 1.147671 10.24943 
1 1 1    5   28    9 o   91.250   4.8001  173.373   17.869  169.907   23.494  178.130   27.523   90.253   6.3114   92.247   7.2339 -1.993935 9.600199 
1 1 1    5   28   10 o  296.049   4.9869  1851.38   57.607  1778.01   97.877  1890.27   71.257  290.794   8.1607  301.304   5.7340 -10.50903 9.973781 
1 1 1    5   28   11 f   73.422   9.8138  122.895   28.397  100.822   43.365  139.465   37.573   66.157   16.055   80.688   11.290 -14.53137 19.62756 
1 1 1    5   28   12 o  180.311   5.2210  676.518   38.827  676.518   38.827   0.0000   0.0000  180.311   5.2210  ?   ?       ?      ? 
1 1 1    5   28   13 o  130.051   5.8430  338.223   26.354  322.633   29.747  395.096   56.818  124.294   5.8026  135.808   10.144 -11.51394 11.68606 
1 1 1    5   28   14 o   77.290   9.6511  153.095   25.330  174.864   29.897   97.710   47.687   90.884   7.9758   63.697   17.577 27.18684 19.30229 
1 1 1    5   28   15 o   23.949   7.5890 -16.0465   16.981   5.7818   22.398 -45.5529   26.041   28.051   11.682   19.846   9.6896 8.205753 15.17791 
1 1 1    5   28   16 o   91.322   6.3121  210.847   13.312  219.583   14.115  140.523   40.048  102.913   3.3254   79.730   12.178 23.18248 12.62418 
1 1 1    5   28   17 o   32.722   7.6092   17.577   7.0991   16.792   7.3438   28.773   27.729   27.681   6.5369   37.763   13.743 -10.08249 15.21833 
1 1 1    5   28   18 o   73.309   5.3226  107.971   10.501  105.938   11.167  123.497   30.868   71.374   3.7935   75.244   9.9464 -3.869553 10.64527 
1 1 1    5   28   19 o   53.856   7.4040   58.313   13.585   53.165   15.271   77.837   29.738   49.968   7.4100   57.743   12.821 -7.775230 14.80799 
1 1 1    5   28   20 o   90.563   3.0543  168.250   11.294  151.647   14.751  191.769   17.557   85.285   4.1937   95.842   4.4416 -10.55711 6.108587 
1 1 1    5   28   21 o   26.637   4.9227   15.511   5.5890   10.956   7.7054   20.568   8.1189   22.752   7.2705   30.522   6.6385 -7.770061 9.845319 
1 1 1    5   28   22 o   73.262   7.4058  149.180   14.795  165.733   16.519   82.077   33.259   88.917   4.5044   57.607   14.110 31.31030 14.81158 
1 1 1    5   28   23 o   37.832   4.9232   31.420   7.3799   29.429   9.9993   33.802   10.937   36.514   6.8923   39.150   7.0318 -2.635788 9.846368 
1 1 1    5   28   24 o   42.143   4.3558   37.962   7.3555   38.484   9.4013   37.139   11.810   42.683   5.3404   41.604   6.8827 1.078106 8.711565 
1 1 1    5   28   25 o   52.748   8.0583   89.502   11.164   95.201   11.658   26.560   38.743   67.412   4.1931   38.085   15.562 29.32684 16.11669 
1 1 1    5   28   26 o   34.119   5.6207   26.558   7.4486   26.958   9.1277   25.760   12.887   34.876   6.5868   33.362   9.1095 1.514870 11.24141 
1 1 1    5   28   27 o   65.089   4.7137   94.216   12.178   68.684   17.715  117.097   16.770   55.995   7.6704   74.184   5.4810 -18.18946 9.427422 
1 1 1    5   28   28 o   27.249   7.0391   11.458   10.809   26.858   17.155   1.3189   13.919   33.675   10.858   20.823   8.9617 12.85234 14.07828 
1 1 1    5   28   29 o   19.803   5.7733   4.4851   7.1855   6.4707   8.3450  -1.2078   14.130   19.583   7.4569   20.024   8.8158 -0.4408855 11.54659 
1 1 1    5   28   30 f   58.517   4.4905   75.773   10.051   77.858   12.263   71.503   17.546   60.402   4.9224   56.632   7.5119 3.770100 8.981045 
1 1 1    5   28   31 o   62.943   4.1001   81.519   9.8836   74.594   11.751   98.267   18.274   59.091   4.8214   66.796   6.6331 -7.705208 8.200266 
1 1 1    5   28   32 o   41.230   6.3597   44.371   9.4130   48.282   10.835   32.331   19.010   47.151   5.5713   35.310   11.434 11.84066 12.71933 
1 1 1    5   28   33 o   17.664   6.0770  -7.1041   8.5363  -4.1489   8.9121 -39.9446   29.709   14.616   6.6679   20.711   10.162 -6.094831 12.15406 
1 1 1    5   28   34 o   37.074   6.4146   36.937   9.5705   41.767   11.207   23.929   18.392   43.357   6.2673   30.791   11.194 12.56674 12.82929 
1 1 1    5   28   35 o   24.252   6.6980   12.523   9.1478   14.834   10.283   3.7555   20.027   24.986   8.4217   23.519   10.418 1.467339 13.39606 
1 1 1    5   28   36 o   23.456   7.1846   6.7101   12.835   4.5124   18.890   8.5947   17.492   23.078   10.175   23.833   10.146 -0.7556973 14.36926 
1 1 1    5   28   37 o   19.234   6.8030 -19.8558   9.2139 -23.2979   9.6746   13.722   30.217   10.683   5.3366   27.785   12.516 -17.10164 13.60601 
1 1 1    5   28   38 o   17.076   5.8865 -12.2118   10.779  -6.0288   11.575 -52.6029   29.584   15.759   7.3341   18.394   9.2095 -2.634932 11.77300 
1 1 1    5   29    0 o   40.160   2.7238   34.238   6.2457   34.238   6.2457   34.238   6.2457   40.160   3.8521   40.160   3.8521 0.000000 0.000000 
1 1 1    5   29    1 o   59.083   2.2306   70.945   5.3559   55.815   7.1191   90.675   8.1300   51.941   3.3231   66.224   2.9765 -14.28314 4.461268 
1 1 1    5   29    2 o   49.584   6.5308   72.358   8.3611   28.645   22.937   79.057   8.9789   37.364   12.578   61.804   3.5224 -24.43969 13.06169 
1 1 1    5   29    3 o   66.678   3.0283   97.604   7.4786   79.194   13.305  106.108   9.0423   61.723   5.2263   71.632   3.0606 -9.909588 6.056528 
1 1 1    5   29    4 o   96.967   2.7014  198.885   10.401  178.061   16.678  212.135   13.304   92.662   4.3640  101.272   3.1852 -8.610397 5.402800 
1 1 1    5   29    5 o   69.274   3.2413  100.400   9.1156   79.509   12.801  121.892   12.984   61.861   5.0173   76.688   4.1049 -14.82772 6.482539 
1 1 1    5   29    6 o  149.705   3.8865  459.958   23.672  504.918   37.267  429.546   30.650  155.673   5.8042  143.736   5.1701 11.93680 7.772949 
1 1 1    5   29    7 o   28.056   6.5323   14.655   8.1774   20.672   15.060   12.139   9.7381   31.495   10.175   24.617   8.1949 6.877701 13.06464 
1 1 1    5   29    8 o   31.636   6.2831   24.072   8.7372   7.7580   17.323   29.637   10.118   26.230   10.518   37.041   6.8762 -10.81135 12.56619 
1 1 1    5   29    9 o  112.703   4.4375  266.431   20.498  230.363   28.744  303.753   29.239  104.823   6.6485  120.583   5.8790 -15.76012 8.875020 
1 1 1    5   29   10 o   39.845   8.3226   36.303   14.900   43.298   18.807   24.514   24.416   44.006   10.507   35.684   12.910 8.321629 16.64514 
1 1 1    5   29   11 o   98.742   6.8579  224.164   24.644  173.396   44.041  247.309   29.736   88.995   11.998  108.489   6.6455 -19.49368 13.71578 
1 1 1    5   29   12 o  109.067   5.7882  236.907   22.521  222.355   25.678  285.421   46.885  102.992   6.0449  115.141   9.8728 -12.14852 11.57642 
1 1 1    5   29   13 o   30.273   8.5368   12.291   15.706   12.139   19.971   12.537   25.431   29.029   11.405   31.516   12.706 -2.487169 17.07369 
1 1 1    5   29   14 o   67.983   6.9777  108.116   17.637  132.666   23.106   73.841   27.301   79.167   7.0764   56.799   12.028 22.36840 13.95545 
1 1 1    5   29   15 o  142.159   4.1996  424.883   24.550  421.572   33.406  428.771   36.202  141.660   5.7175  142.658   6.1528 -0.9976959 8.399204 
1 1 1    5   29   16 o   93.145   6.3276  181.368   22.499  171.827   26.837  203.935   41.273   89.890   7.2386   96.400   10.381 -6.510796 12.65523 
1 1 1    5   29   17 o   91.377   6.3834  183.144   23.625  150.051   34.190  213.382   32.683   82.879   10.002   99.875   7.9341 -16.99612 12.76688 
1 1 1    5   29   18 o   39.836   7.3501   33.699   7.8163   33.611   8.1429   34.739   27.877   40.053   4.9292   39.618   13.849 0.4344978 14.70012 
1 1 1    5   29   19 o   65.622   6.5709   96.674   10.469   96.970   11.101   94.300   31.463   68.161   3.9489   63.082   12.534 5.078629 13.14177 
1 1 1    5   29   20 o   23.407   7.2641   11.810   7.7455   11.810   7.7455   0.0000   0.0000   23.407   7.2641  ?   ?       ?      ? 
1 1 1    5   29   21 o   54.292   8.4182   81.395   10.337   83.713   10.721   50.727   38.998   63.264   4.1087   45.321   16.327 17.94281 16.83638 
1 1 1    5   29   22 o   53.850   3.4862   60.625   7.7076   56.877   10.316   65.361   11.596   52.006   4.8096   55.694   5.0480 -3.688778 6.972431 
1 1 1    5   29   23 o   83.453   3.9658  151.347   13.276  119.257   19.571  178.706   18.070   74.729   6.3496   92.177   4.7532 -17.44708 7.931560 
1 1 1    5   29   24 o  105.903   3.4342  234.479   14.722  225.113   18.918  248.862   23.443  103.454   4.4336  108.352   5.2458 -4.897835 6.868443 
1 1 1    5   29   25 o   24.310   5.7555   12.296   6.5481   11.689   8.0737   13.462   11.194   23.258   7.4433   25.362   8.7807 -2.104630 11.51101 
1 1 1    5   29   26 o  100.304   6.8198  203.289   15.410  198.293   16.038  263.397   55.627   97.175   4.0015  103.432   13.040 -6.256470 13.63970 
1 1 1    5   29   27 o   82.133   3.4983  143.218   11.716  143.251   15.464  143.174   17.950   82.323   4.5544   81.942   5.3112 0.3810730 6.996555 
1 1 1    5   29   28 o   57.994   4.1605   69.611   9.2264   64.933   10.989   80.789   16.987   55.253   4.8219   60.734   6.7814 -5.481049 8.320962 
1 1 1    5   29   29 o   19.696   5.7577   4.5359   7.1190   5.7229   8.3468   1.3680   13.636   18.992   7.3981   20.400   8.8246 -1.408379 11.51539 
1 1 1    5   29   30 o   37.554   6.0237   33.218   8.6127   33.650   10.239   32.174   15.927   39.162   6.3391   35.947   10.245 3.215019 12.04739 
1 1 1    5   29   31 o   56.828   6.1104   78.469   13.349   60.219   19.937   93.298   17.972   49.023   10.193   64.632   6.7419 -15.60947 12.22079 
1 1 1    5   29   32 o   22.426   6.4491   7.4877   8.5275   6.2898   10.006   10.667   16.301   20.049   8.0097   24.804   10.110 -4.755562 12.89825 
1 1 1    5   29   33 o   18.545   5.8258   0.3254   7.9969   1.4384   9.2101  -3.0841   16.120   17.074   7.3175   20.016   9.0671 -2.941942 11.65156 
1 1 1    5   29   34 o   32.214   8.0387   27.539   11.469   28.292   12.262   22.277   32.411   33.552   8.7649   30.876   13.478 2.675940 16.07741 
1 1 1    5   29   35 o   13.574   6.3684 -14.2334   8.6557  -7.1351   9.0220 -96.3470   30.686   13.574   6.3684  ?   ?       ?      ? 
1 1 1    5   29   36 o   28.958   8.9567   19.838   20.265   12.787   27.266   28.540   30.291   26.923   12.026   30.992   13.276 -4.069611 17.91337 
1 1 1    5   29   37 f   35.251   9.7976   45.954   21.244   53.761   29.197   37.172   30.967   37.994   14.057   32.507   13.652 5.487171 19.59525 
1 1 1    5   30    0 o   67.186   2.1240   93.808   8.2858   93.808   8.2858   93.808   8.2858   67.186   3.0038   67.186   3.0038 0.000000 0.000000 
1 1 1    5   30    1 o   81.400   3.0352  140.827   8.5948  131.640   17.531  143.734   9.8612   79.449   5.3500   83.350   2.8685 -3.901840 6.070498 
1 1 1    5   30    2 o   62.248   4.8583   78.532   7.5763   85.142   23.951   77.797   7.9864   63.197   9.1889   61.299   3.1589 1.898830 9.716686 
1 1 1    5   30    3 o  135.872   2.4735  379.546   13.023  391.542   22.873  373.792   15.842  137.336   4.0380  134.408   2.8577 2.927597 4.946912 
1 1 1    5   30    4 o   47.375   3.9653   47.261   7.5966   58.929   10.889   36.196   10.603   53.184   4.9640   41.566   6.1850 11.61848 7.930619 
1 1 1    5   30    5 o   30.571   6.0037   20.866   7.4545   17.369   14.034   22.241   8.7983   29.210   9.8385   31.932   6.8833 -2.721720 12.00737 
1 1 1    5   30    6 f   55.052   4.6339   67.065   9.4406   55.440   16.868   72.367   11.392   51.145   7.9965   58.958   4.6847 -7.813190 9.267724 
1 1 1    5   30    7 f   94.552   6.1622  187.491   24.031  187.491   24.031   0.0000   0.0000   94.552   6.1622  ?   ?       ?      ? 
1 1 1    5   30    8 o   98.969   3.8246  207.256   14.158  198.649   25.980  210.892   16.885   97.200   6.4805  100.739   4.0639 -3.538994 7.649286 
1 1 1    5   30    9 o   41.275   8.1098   39.828   15.163   52.973   19.802   21.198   23.575   48.646   10.196   33.904   12.614 14.74126 16.21958 
1 1 1    5   30   10 f   46.715   5.3308   36.830   9.0219   81.785   17.923   21.573   10.441   62.191   6.9874   31.239   8.0527 30.95196 10.66156 
1 1 1    5   30   11 o   32.932   9.6426  -7.7045   20.345   42.681   39.896 -25.4109   23.651   44.622   16.447   21.242   10.070 23.38019 19.28512 
1 1 1    5   30   12 o   34.978   8.6253   25.930   15.537   32.069   19.380   14.884   25.994   37.710   11.453   32.246   12.900 5.463703 17.25062 
1 1 1    5   30   13 o   37.172   8.7952   28.018   15.800   19.240   20.207   41.826   25.343   31.789   11.707   42.555   13.129 -10.76581 17.59035 
1 1 1    5   30   14 o  146.479   5.9046  451.599   35.672   0.0000   0.0000  451.599   35.672  ?   ?   146.479   5.9046      ?      ? 
1 1 1    5   30   15 o   36.684   8.8328   25.833   16.202   14.142   20.691   44.363   26.049   29.820   11.639   43.548   13.289 -13.72737 17.66559 
1 1 1    5   30   16 o  100.783   5.7366  213.551   22.289  202.909   26.828  237.263   40.046   97.604   6.6643  103.963   9.3392 -6.359001 11.47319 
1 1 1    5   30   17 o   34.621   8.8693   24.956   17.203   35.508   21.921   8.0399   27.756   38.936   12.243   30.306   12.836 8.630226 17.73850 
1 1 1    5   30   18 o   92.496   5.4044  186.550   20.396  201.585   27.734  168.839   30.101   96.967   6.9346   88.025   8.2910 8.941971 10.80876 
1 1 1    5   30   19 o   35.482   10.622   15.168   23.536   24.842   48.119   12.125   26.984   39.914   16.903   31.051   12.868 8.862556 21.24382 
1 1 1    5   30   20 o   35.719   8.0628   28.144   7.6303   28.967   7.7484   1.7795   43.870   37.075   5.0672   34.362   15.309 2.712669 16.12568 
1 1 1    5   30   21 f   48.533   7.3687   59.163   8.9806   60.549   9.4477   46.181   28.919   53.754   4.2614   43.311   14.108 10.44305 14.73743 
1 1 1    5   30   22 o   57.754   7.0774   68.324   13.702   61.930   15.348   93.440   30.417   53.506   6.9547   62.001   12.329 -8.494747 14.15489 
1 1 1    5   30   23 o   30.437   4.2318   25.266   4.7127   9.3434   8.6734   31.936   5.6136   21.766   7.7148   39.108   3.4803 -17.34183 8.463513 
1 1 1    5   30   24 o   46.931   3.3711   49.551   5.9982   37.650   9.9629   56.317   7.5123   41.959   5.7570   51.902   3.5093 -9.943146 6.742256 
1 1 1    5   30   25 o   16.382   4.9153   0.5066   5.8404  -2.2029   8.0400   3.5337   8.4981   14.786   6.5725   17.979   7.3106 -3.193351 9.830680 
1 1 1    5   30   26 o   41.935   4.5454   35.427   7.3207   24.201   9.0749   56.344   12.388   32.718   6.9400   51.151   5.8718 -18.43306 9.090749 
1 1 1    5   30   27 o   23.203   8.3918  -8.9391   7.5123  -9.3848   7.5979   10.520   50.206   11.736   5.6041   34.671   15.820 -22.93505 16.78353 
1 1 1    5   30   28 o   54.420   4.1228   65.649   8.6906   68.806   10.785   59.804   14.676   56.839   4.6004   52.000   6.8430 4.838860 8.245616 
1 1 1    5   30   29 o   26.694   5.3031   17.989   7.3650   27.012   8.8948  -1.6859   13.135   34.523   6.4849   18.865   8.3925 15.65844 10.60610 
1 1 1    5   30   30 o   50.828   4.6710   58.353   8.9284   59.501   10.745   55.792   16.048   52.496   4.9627   49.159   7.9148 3.336132 9.341956 
1 1 1    5   30   31 o   29.385   6.3824   21.077   7.9822   21.647   9.2664   19.440   15.716   30.258   7.4701   28.513   10.351 1.744543 12.76488 
1 1 1    5   30   32 o   31.766   7.5824   26.754   10.349   28.405   10.987   13.757   30.822   34.324   7.9219   29.207   12.931 5.117619 15.16484 
1 1 1    5   30   33 o   21.804   7.4750 -28.8510   20.705 -47.5766   28.056  -6.4568   30.681   18.755   9.3230   24.853   11.687 -6.098131 14.94992 
1 1 1    5   30   34 o   31.162   10.274   13.367   33.845   48.113   46.652 -25.2386   49.174   35.597   15.827   26.727   13.105 8.869402 20.54887 
1 1 1    5   30   35 o   36.165   9.8352   45.125   21.213   29.159   28.693   64.371   31.503   30.914   13.070   41.415   14.700 -10.50063 19.67043 
1 1 1    5   30   36 o   31.387   9.3162   30.713   20.753   16.442   28.176   47.636   30.683   27.337   12.217   35.437   14.068 -8.100552 18.63237 
1 1 1    5   31    0 o   92.929   1.9220  178.881   10.398  178.881   10.398  178.881   10.398   92.929   2.7181   92.929   2.7181 0.000000 0.000000 
1 1 1    5   31    1 o  128.310   3.0110  344.075   13.860  339.745   27.403  345.564   16.067  127.472   5.2121  129.148   3.0163 -1.676376 6.022021 
1 1 1    5   31    2 o  108.208   3.7350  235.437   13.213  260.901   30.563  229.585   14.652  111.212   6.6632  105.203   3.3769 6.009018 7.470056 
1 1 1    5   31    3 o  174.872   2.7108  634.697   19.308  640.510   29.806  630.495   25.344  175.458   4.1187  174.286   3.5257 1.171829 5.421629 
1 1 1    5   31    4 o   26.760   5.9519   14.883   7.0570   16.415   12.085   14.091   8.6930   27.955   9.1208   25.566   7.6493 2.389168 11.90375 
1 1 1    5   31    5 o   64.970   3.9991   90.462   9.8152   83.688   17.524   93.558   11.848   62.921   6.7527   67.018   4.2863 -4.097404 7.998252 
1 1 1    5   31    6 o   41.919   5.6653   46.538   8.5791   20.188   15.360   58.484   10.343   30.918   10.292   52.919   4.7387 -22.00043 11.33064 
1 1 1    5   31    7 o   32.666   6.2645   23.323   8.0882   24.064   15.171   23.029   9.5602   33.028   10.153   32.304   7.3419 0.7234764 12.52907 
1 1 1    5   31    8 o  106.398   4.3456  237.841   19.016  264.425   27.725  214.226   26.131  112.047   5.9993  100.748   6.2885 11.29865 8.691154 
1 1 1    5   31    9 o   84.526   5.0244  151.742   17.494  161.944   24.968  141.903   24.519   87.377   6.9281   81.675   7.2788 5.702660 10.04885 
1 1 1    5   31   10 o   64.633   5.0248   90.711   11.550   84.584   22.690   92.854   13.419   62.632   8.7837   66.634   4.8827 -4.001877 10.04956 
1 1 1    5   31   11 o   79.199   5.2122  132.876   16.718  129.630   21.579  137.750   26.440   78.221   6.6888   80.176   7.9956 -1.955612 10.42443 
1 1 1    5   31   12 o   39.169   8.2857   36.497   15.292   47.410   19.430   18.736   24.787   45.450   10.566   32.889   12.766 12.56092 16.57131 
1 1 1    5   31   13 o  118.717   4.2835  297.222   20.869  284.444   27.919  313.401   31.415  115.955   5.8377  121.479   6.2701 -5.524315 8.566934 
1 1 1    5   31   14 o   40.956   8.9900   38.406   16.284   33.862   20.364   46.463   27.117   38.111   11.771   43.801   13.592 -5.689526 17.98007 
1 1 1    5   31   15 o   58.425   7.6114   77.180   17.436   68.911   22.537   89.509   27.518   54.745   10.361   62.104   11.153 -7.359600 15.22279 
1 1 1    5   31   16 o   38.296   8.9989   31.950   18.409   52.635   25.311   8.7228   26.821   46.558   12.789   30.033   12.664 16.52539 17.99780 
1 1 1    5   31   17 o   75.447   6.2459  122.241   19.194  101.495   25.110  151.398   29.768   67.855   8.9721   83.039   8.6917 -15.18414 12.49183 
1 1 1    5   31   18 o   98.904   5.2165  209.785   21.081  201.825   27.766  220.618   32.391   96.953   6.9436  100.854   7.7868 -3.901344 10.43300 
1 1 1    5   31   19 o   50.257   9.9610   72.306   25.282   10.349   47.069   97.428   29.972   36.453   16.068   64.061   11.778 -27.60791 19.92199 
1 1 1    5   31   20 o   53.177   8.8679   71.202   19.043   77.958   24.789   61.474   29.746   57.440   10.861   48.915   14.021 8.524773 17.73572 
1 1 1    5   31   21 f   29.190   8.4819   8.4987   17.887   24.517   22.854 -16.8282   28.737   33.611   12.437   24.769   11.537 8.841997 16.96378 
1 1 1    5   31   22 o   30.353   7.8174   10.833   6.6798   9.1809   6.8686   39.643   28.686   20.868   6.8793   39.837   14.040 -18.96826 15.63482 
1 1 1    5   31   23 o   28.517   7.7632   16.290   11.795   19.612   12.979   0.5269   28.272   29.308   9.4433   27.725   12.325 1.583233 15.52647 
1 1 1    5   31   24 o   26.643   7.4001   11.620   7.5910   11.573   7.8906   12.204   27.812   22.992   7.3585   30.295   12.841 -7.303431 14.80015 
1 1 1    5   31   25 o   76.424   2.6047  123.563   8.0639  118.329   12.490  127.303   10.560   74.878   4.0443   77.970   3.2836 -3.091896 5.209487 
1 1 1    5   31   26 o   55.969   3.9572   68.617   8.8458   49.301   12.395   88.668   12.628   47.466   6.3312   64.473   4.7490 -17.00718 7.914403 
1 1 1    5   31   27 o   34.374   5.3961   27.691   7.3211   28.483   9.3923   26.465   11.687   35.432   6.6719   33.316   8.4829 2.115711 10.79226 
1 1 1    5   31   28 o   30.516   5.8613   22.732   7.5071   24.309   9.5084   20.121   12.232   32.225   7.3206   28.808   9.1557 3.416647 11.72257 
1 1 1    5   31   29 o   33.762   7.7513   25.669   8.8426   24.942   9.2696   33.024   29.473   32.733   7.0726   34.792   13.795 -2.058838 15.50267 
1 1 1    5   31   30 o   38.165   9.7950   42.304   20.540   27.041   28.014   60.047   30.205   32.522   13.254   43.808   14.425 -11.28586 19.58998 
1 1 1    5   31   31 o   31.396   9.6825   21.602   24.527   37.718   33.361   2.6443   36.183   34.871   14.366   27.920   12.985 6.950312 19.36495 
1 1 1    5   31   32 o   24.200   7.9760  -7.1942   19.658 -21.5543   26.926   9.1966   28.767   21.243   10.249   27.156   12.224 -5.913090 15.95208 
1 1 1    5   31   33 o   27.232   8.5520   9.3013   20.255   28.863   28.117 -11.8014   29.204   31.331   13.072   23.132   11.030 8.198814 17.10394 
1 1 1    5   31   34 o   30.314   8.4286   16.844   20.089   56.033   26.522 -35.8946   30.767   40.257   13.525   20.371   10.061 19.88568 16.85713 
1 1 1    5   31   35 o   27.358   8.6547   13.514   20.869   31.833   29.226  -5.5423   29.809   31.082   13.169   23.635   11.234 7.446831 17.30946 
1 1 1    5   32    0 o   49.912   3.6436   53.383   10.349   53.383   10.349   53.383   10.349   49.912   5.1528   49.912   5.1528 0.000000 0.000000 
1 1 1    5   32    1 o   61.329   3.5321   78.137   8.9345   0.0000   0.0000   78.137   8.9345  ?   ?    61.329   3.5321      ?      ? 
1 1 1    5   32    2 o   83.705   5.1353  146.743   17.729   0.0000   0.0000  146.743   17.729  ?   ?    83.705   5.1353      ?      ? 
1 1 1    5   32    3 o   88.275   3.2855  160.475   11.123  168.991   20.004  156.664   13.383   89.749   5.4040   86.801   3.7381 2.948921 6.570922 
1 1 1    5   32    4 o   95.358   3.5604  189.392   13.687  194.979   21.926  185.826   17.520   96.361   5.5169   94.355   4.5020 2.006226 7.120712 
1 1 1    5   32    5 o   60.595   4.0418   78.775   9.2386   73.279   16.556   81.260   11.133   58.775   6.8295   62.416   4.3248 -3.640625 8.083629 
1 1 1    5   32    6 o   58.098   4.2702   72.566   9.2195   68.008   16.968   74.475   10.982   56.479   7.2841   59.718   4.4587 -3.238674 8.540407 
1 1 1    5   32    7 o   32.708   6.0886   24.519   7.9940   20.981   14.463   26.075   9.5924   31.004   9.9665   34.413   6.9967 -3.408909 12.17723 
1 1 1    5   32    8 o   67.144   4.2316   91.946   10.711  104.126   20.160   87.155   12.643   69.811   7.0016   64.477   4.7543 5.334831 8.463147 
1 1 1    5   32    9 o   45.879   7.8915   48.936   14.709   45.970   19.617   52.746   22.231   44.421   10.810   47.337   11.500 -2.916107 15.78298 
1 1 1    5   32   10 o   51.305   5.6014   55.654   11.853   0.0000   0.0000   55.654   11.853  ?   ?    51.305   5.6014      ?      ? 
1 1 1    5   32   11 f   34.748   7.0339   25.491   9.6207   33.094   18.927   22.843   11.172   37.691   11.289   31.805   8.3938 5.886099 14.06773 
1 1 1    5   32   12 o   34.949   7.7792   27.523   14.681   44.280   18.519  -0.8193   24.085   43.620   10.434   26.279   11.541 17.34055 15.55848 
1 1 1    5   32   13 o   26.601   7.9404   2.5846   14.661  -5.0709   18.448   15.708   24.154   22.019   9.8600   31.182   12.449 -9.162979 15.88081 
1 1 1    5   32   14 o   23.666   7.5143  -6.0130   14.830  -8.9335   18.889  -1.3199   23.945   21.295   9.7118   26.036   11.469 -4.741409 15.02853 
1 1 1    5   32   15 o   29.637   8.3955   11.320   16.969   24.819   20.202 -21.0248   31.271   33.686   11.789   25.587   11.957 8.098486 16.79107 
1 1 1    5   32   16 o   34.490   9.1072   24.644   17.703   31.302   23.924   16.585   26.319   36.927   12.834   32.053   12.925 4.874344 18.21435 
1 1 1    5   32   17 o   42.007   9.2101   43.937   17.579   46.471   22.811   40.231   27.583   43.533   12.210   40.481   13.792 3.052010 18.42024 
1 1 1    5   32   18 o   28.666   8.3824  -0.0004   17.543 -21.9462   23.103   29.886   26.960   20.967   9.9437   36.364   13.497 -15.39771 16.76476 
1 1 1    5   32   19 f   31.813   9.1641   16.351   19.514   27.559   22.295 -20.3494   40.344   34.720   12.362   28.905   13.531 5.814901 18.32813 
1 1 1    5   32   20 o   42.735   9.5220   46.959   18.682   48.293   24.501   45.108   28.875   43.642   12.788   41.828   14.112 1.814865 19.04400 
1 1 1    5   32   21 o   54.851   8.2416   70.120   18.664   42.375   24.281  110.181   29.177   40.833   12.891   68.869   10.272 -28.03634 16.48323 
1 1 1    5   32   22 o   62.193   7.9507   95.556   19.396  107.170   25.769   80.373   29.462   68.540   9.1155   55.846   13.029 12.69382 15.90144 
1 1 1    5   32   23 o   33.077   6.7049   30.795   6.9886   32.664   7.1218 -17.7947   36.309   39.258   4.3984   26.896   12.668 12.36220 13.40986 
1 1 1    5   32   24 f   25.243   7.0835   11.061   6.9815   11.489   7.2107   4.6528   27.912   22.658   7.0051   27.828   12.314 -5.170197 14.16709 
1 1 1    5   32   25 o   33.436   8.2102   27.400   12.528   28.111   13.997   24.540   28.087   33.894   9.5847   32.977   13.333 0.9176674 16.42042 
1 1 1    5   32   26 o   77.506   5.5194  142.543   12.801  145.644   14.103  128.040   30.501   82.770   4.1313   72.242   10.237 10.52734 11.03886 
1 1 1    5   32   27 o   29.378   8.4996   12.739   18.582   35.139   24.704 -16.4509   28.201   35.575   12.968   23.180   10.991 12.39527 16.99920 
1 1 1    5   32   28 o   23.946   7.8650  -7.2865   18.649  -3.3955   24.667 -12.4778   28.492   24.044   11.016   23.847   11.229 0.1968174 15.73005 
1 1 1    5   32   29 o   28.935   8.9450   14.147   20.196   7.8981   27.232   21.784   30.106   26.985   12.039   30.885   13.233 -3.900515 17.88995 
1 1 1    5   32   30 o   26.150   8.3539   2.7878   19.414 -11.3230   26.164   20.074   28.959   22.538   10.658   29.762   12.867 -7.223913 16.70778 
1 1 1    5   32   31 o   30.619   9.5353   22.258   22.880   31.757   36.543   16.133   29.343   32.659   14.283   28.579   12.637 4.079630 19.07052 
1 1 1    5   32   32 o   24.118   7.8347 -13.0208   19.123 -46.9025   25.847   27.954   28.424   17.542   8.7564   30.694   12.994 -13.15270 15.66941 
1 1 1    5   32   33 o   34.439   11.012   45.416   35.474  -1.9483   49.289   96.315   51.095   27.596   13.442   41.281   17.446 -13.68484 22.02422 
1 1 1    5   33    0 o   31.760   5.1979   24.196   8.3779   24.196   8.3779   24.196   8.3779   31.760   7.3509   31.760   7.3509 0.000000 0.000000 
1 1 1    5   33    1 o   45.891   3.0084   42.938   5.0275   46.493   9.9280   41.712   5.8303   46.987   5.1229   44.794   3.1558 2.192600 6.016887 
1 1 1    5   33    2 o   15.401   4.4651   1.7584   4.6205  -2.0888   7.4989   4.1128   5.8664   14.408   6.3788   16.393   6.2498 -1.984850 8.930252 
1 1 1    5   33    3 f   82.265   3.3197  143.876   10.414  137.102   18.439  147.049   12.619   80.538   5.5510   83.993   3.6426 -3.454926 6.639397 
1 1 1    5   33    4 o  123.978   3.2764  321.428   15.339  325.209   28.071  319.818   18.315  124.069   5.4856  123.887   3.5843 0.1817245 6.552820 
1 1 1    5   33    5 o  174.405   3.7995  634.075   26.571  676.112   43.513  609.080   33.553  178.535   5.9092  170.275   4.7777 8.260178 7.599037 
1 1 1    5   33    6 o  146.997   3.8272  449.473   22.845  495.081   36.228  419.365   29.435  152.873   5.7458  141.121   5.0573 11.75238 7.654397 
1 1 1    5   33    7 o   82.944   3.8025  145.149   12.307  145.764   21.137  144.834   15.137   82.758   6.1925   83.130   4.4148 -0.3726501 7.605067 
1 1 1    5   33    8 o   33.712   6.0012   27.344   8.1936   17.677   15.525   31.076   9.6465   29.206   10.325   38.218   6.1199 -9.011555 12.00233 
1 1 1    5   33    9 o   64.745   5.7539   92.955   15.006  111.129   20.801   73.237   21.667   71.912   7.0134   57.579   9.1237 14.33233 11.50780 
1 1 1    5   33   10 f   57.428   5.2127   69.592   12.347   0.0000   0.0000   69.592   12.347  ?   ?    57.428   5.2127      ?      ? 
1 1 1    5   33   11 o   68.626   5.1667  107.664   13.058   86.140   23.128  117.736   15.821   62.526   8.9683   74.726   5.1332 -12.20027 10.33348 
1 1 1    5   33   12 o   45.238   5.9122   43.491   9.7159   50.335   18.688   40.956   11.374   46.663   10.010   43.813   6.2942 2.849396 11.82441 
1 1 1    5   33   13 o   94.637   4.8882  193.419   18.835  195.600   24.850  190.475   28.875   95.611   6.3016   93.663   7.4745 1.948349 9.776402 
1 1 1    5   33   14 o   35.093   8.8401   27.907   15.864   28.265   20.103   27.315   25.825   34.891   11.775   35.294   13.188 -0.4037323 17.68022 
1 1 1    5   33   15 o   33.423   9.1252   23.009   17.351   27.461   20.336   11.091   33.270   34.496   11.841   32.349   13.887 2.147015 18.25035 
1 1 1    5   33   16 o   37.837   9.2537   33.181   17.764   23.976   23.906   44.531   26.545   33.579   12.661   42.094   13.499 -8.515255 18.50735 
1 1 1    5   33   17 o   28.492   8.4701   8.6026   16.510   4.0139   21.072   15.898   26.569   25.659   11.035   31.325   12.853 -5.665813 16.94021 
1 1 1    5   33   18 o   36.354   10.072   29.519   22.962  -0.5860   43.644   41.041   27.001   32.564   14.817   40.143   13.646 -7.579628 20.14334 
1 1 1    5   33   19 o   27.797   8.8423 -16.1708   18.550 -31.1089   21.345   29.922   37.495   18.315   8.9044   37.278   15.279 -18.96207 17.68451 
1 1 1    5   33   20 o   30.527   8.7128   15.193   16.618   7.5731   21.072   27.726   27.025   26.398   11.183   34.656   13.364 -8.257931 17.42561 
1 1 1    5   33   21 o   59.760   7.7878   85.883   18.668   72.346   24.684  103.973   28.534   53.615   11.507   65.906   10.497 -12.29039 15.57570 
1 1 1    5   33   22 o   59.036   7.8920   84.522   18.650   65.477   24.665  109.949   28.500   50.250   12.055   67.823   10.188 -17.57265 15.78404 
1 1 1    5   33   23 o   27.716   8.7560   4.1612   19.218   2.9165   23.246   6.8492   34.160   25.497   11.262   29.936   13.410 -4.439369 17.51194 
1 1 1    5   33   24 o   29.566   8.6248   10.579   17.992  -8.6149   23.693   36.724   27.652   22.789   10.567   36.344   13.634 -13.55467 17.24966 
1 1 1    5   33   25 o   34.325   9.3273   31.925   18.627   34.493   24.853   28.633   28.138   35.307   12.986   33.342   13.392 1.964874 18.65451 
1 1 1    5   33   26 o   38.586   10.794   39.252   22.478   28.658   25.851   72.089   45.513   33.105   12.985   44.068   17.245 -10.96220 21.58729 
1 1 1    5   33   27 o   37.057   7.6378   23.577   19.212   81.753   26.097 -45.2554   28.386   54.751   11.897   19.363   9.5820 35.38810 15.27562 
1 1 1    5   33   28 o   38.131   9.7740   46.323   19.872   39.139   27.164   54.594   29.146   35.519   13.471   40.743   14.165 -5.224144 19.54790 
1 1 1    5   33   29 o   23.285   7.7693  -9.9291   19.399 -16.4635   26.427  -2.2933   28.567   21.750   10.404   24.820   11.541 -3.069815 15.53860 
1 1 1    5   33   30 o   25.378   8.3785   0.5955   20.688  -2.5589   25.715   6.3823   34.831   23.491   10.932   27.264   12.700 -3.773228 16.75701 
1 1 1    5   33   31 o   48.390   9.3877   79.732   20.994  106.372   29.301   51.629   30.095   59.592   12.328   37.189   14.161 22.40294 18.77541 
1 1 1    5   33   32 o   28.692   8.6571   10.634   20.135 -22.3969   26.968   52.239   30.266   20.429   9.9493   36.954   14.170 -16.52532 17.31425 
1 1 1    5   34    0 o  120.013   3.5351  301.718   24.649  301.718   24.649  301.718   24.649  120.013   4.9994  120.013   4.9994 0.000000 0.000000 
1 1 1    5   34    1 o   43.222   3.3305   38.455   5.8729   45.143   9.1569   33.781   7.6547   46.335   4.7915   40.108   4.6273 6.226997 6.661093 
1 1 1    5   34    2 o   53.695   3.4181   56.913   7.1148   71.752   12.959   50.510   8.5124   58.267   5.3925   49.122   4.2016 9.145466 6.836131 
1 1 1    5   34    3 o  119.400   4.5412  299.158   22.364   0.0000   0.0000  299.158   22.364  ?   ?   119.400   4.5412      ?      ? 
1 1 1    5   34    4 o   35.758   5.1873   30.867   6.9940   20.584   12.251   35.839   8.5186   30.265   9.0864   41.250   5.0070 -10.98520 10.37458 
1 1 1    5   34    5 o   76.498   3.6221  124.237   10.567  121.054   18.808  125.705   12.773   75.448   6.0440   77.548   3.9937 -2.099579 7.244272 
1 1 1    5   34    6 o   57.888   4.1021   69.100   9.1583   76.876   16.473   65.622   11.018   59.915   6.6662   55.860   4.7823 4.054836 8.204194 
1 1 1    5   34    7 o  140.740   3.5857  421.456   19.754  405.814   33.335  429.922   24.524  138.189   5.8488  143.291   4.1496 -5.102341 7.171306 
1 1 1    5   34    8 o   51.569   5.4183   64.581   9.5045   45.750   17.418   72.566   11.342   44.420   9.7724   58.718   4.6833 -14.29755 10.83665 
1 1 1    5   34    9 o   70.000   5.3575  106.790   15.454  106.534   21.413  107.068   22.328   69.991   7.4175   70.010   7.7325 -0.1850891E-01 10.71500 
1 1 1    5   34   10 o   63.783   4.8188   85.900   12.677   0.0000   0.0000   85.900   12.677  ?   ?    63.783   4.8188      ?      ? 
1 1 1    5   34   11 o   77.139   7.9169  130.671   25.188  130.671   25.188   0.0000   0.0000   77.139   7.9169  ?   ?       ?      ? 
1 1 1    5   34   12 o   41.772   6.6098   49.243   10.124   20.173   21.984   57.068   11.406   31.702   12.096   51.842   5.3343 -20.13985 13.21967 
1 1 1    5   34   13 o   96.973   4.7642  203.459   18.844  203.528   24.909  203.367   28.815   97.337   6.2045   96.608   7.2316 0.7287903 9.528440 
1 1 1    5   34   14 o   63.398   6.9139   95.051   16.710  102.396   21.294   83.280   26.958   68.257   7.5639   58.538   11.576 9.719986 13.82784 
1 1 1    5   34   15 o   33.806   8.6815   26.629   16.574   35.811   19.540   3.0803   31.293   38.189   11.478   29.423   13.028 8.766056 17.36291 
1 1 1    5   34   16 f   32.119   8.7863   21.297   16.782   26.766   22.471   14.400   25.234   34.008   12.372   30.230   12.479 3.777855 17.57257 
1 1 1    5   34   17 o   27.439   8.1865   6.4963   15.705  -1.7723   20.115   19.408   25.136   23.297   10.374   31.581   12.667 -8.283512 16.37298 
1 1 1    5   34   18 o   51.183   10.697   70.763   22.629   88.019   41.866   63.641   26.896   53.415   16.934   48.951   13.075 4.464626 21.39437 
1 1 1    5   34   19 o   32.625   8.0451   21.355   16.758   45.994   21.470 -17.0559   26.807   42.153   11.854   23.098   10.881 19.05519 16.09030 
1 1 1    5   34   20 o   42.967   9.1308   48.913   17.636   38.371   23.608   62.225   26.529   38.010   12.761   47.925   13.063 -9.914955 18.26159 
1 1 1    5   34   21 o   39.005   8.8707   41.779   17.735   57.243   23.401   20.906   27.186   46.459   12.094   31.552   12.980 14.90772 17.74147 
1 1 1    5   34   22 o   56.970   8.5151   85.996   19.330   81.041   26.185   91.929   28.654   55.352   11.829   58.588   12.252 -3.236019 17.03029 
1 1 1    5   34   23 o   48.423   9.6708   67.302   20.400   85.846   30.660   52.571   27.326   54.680   13.640   42.166   13.713 12.51406 19.34166 
1 1 1    5   34   24 o   45.740   9.1972   61.018   18.666   71.368   25.224   48.488   27.752   51.231   12.126   40.249   13.832 10.98213 18.39443 
1 1 1    5   34   25 o   31.021   9.5014   20.279   23.093  -0.3424   40.272   30.381   28.188   28.767   13.483   33.275   13.391 -4.507559 19.00274 
1 1 1    5   34   26 o   27.349   9.0720  -3.9566   21.460 -14.8003   24.643   30.069   43.653   21.422   10.191   33.277   15.011 -11.85503 18.14408 
1 1 1    5   34   27 o   23.647   7.8043  -6.4616   18.664 -14.6941   25.181   3.5740   27.802   21.555   10.268   25.739   11.756 -4.184074 15.60851 
1 1 1    5   34   28 o   29.128   8.7327   14.100   19.519  -9.9551   26.347   43.368   29.062   22.495   10.654   35.760   13.839 -13.26532 17.46531 
1 1 1    5   34   29 o   32.270   8.9644   31.233   19.345   51.707   26.384   7.4279   28.449   38.736   13.477   25.803   11.825 12.93322 17.92887 
1 1 1    5   34   30 o   24.447   8.2268  -6.8727   22.437   12.804   34.121 -21.8638   29.782   27.428   12.705   21.466   10.455 5.961876 16.45356 
1 1 1    5   35    0 o   64.080   3.0929   86.677   11.437   86.677   11.437   86.677   11.437   64.080   4.3740   64.080   4.3740 0.000000 0.000000 
1 1 1    5   35    1 o   48.183   7.0403   69.591   9.6319   75.502   10.327   30.084   26.699   59.969   4.1754   36.398   13.447 23.57150 14.08052 
1 1 1    5   35    2 o   78.190   3.1289  127.800   9.2112  130.700   16.981  126.590   10.964   78.499   5.2449   77.880   3.4135 0.6193466 6.257876 
1 1 1    5   35    3 o   86.394   4.8995  157.754   17.458   0.0000   0.0000  157.754   17.458  ?   ?    86.394   4.8995      ?      ? 
1 1 1    5   35    4 o   35.785   4.9052   27.359   6.6852   30.774   11.828   25.756   8.1038   36.799   8.0195   34.771   5.6508 2.027817 9.810385 
1 1 1    5   35    5 o   46.831   4.6640   47.468   8.6043   46.498   14.361   48.011   10.747   46.144   7.5460   47.517   5.4835 -1.372868 9.327929 
1 1 1    5   35    6 o   62.114   4.0735   82.129   9.5655   82.748   17.412   81.861   11.448   61.864   6.8240   62.365   4.4506 -0.5010338 8.147027 
1 1 1    5   35    7 o   25.224   6.0862   13.318   7.1379   12.552   13.529   13.613   8.4026   25.652   9.5534   24.796   7.5434 0.8566608 12.17248 
1 1 1    5   35    8 o   20.096   5.6554   5.6993   6.9156  -4.0875   13.919   8.9069   7.9687   19.076   8.5516   21.117   7.4031 -2.041164 11.31084 
1 1 1    5   35    9 o   67.820   5.3276  101.334   14.832  108.692   20.600   93.415   21.371   70.631   7.0714   65.010   7.9704 5.620110 10.65516 
1 1 1    5   35   10 o   18.879   7.5102   4.7744   8.7615   0.0000   0.0000   4.7744   8.7615  ?   ?    18.879   7.5102      ?      ? 
1 1 1    5   35   11 o   40.481   6.7445   37.429   9.9797   40.993   19.893   36.231   11.536   40.788   11.389   40.174   7.2283 0.6147728 13.48896 
1 1 1    5   35   12 o   41.269   7.7538   43.040   15.122   64.543   20.346   16.503   22.603   52.399   9.7742   30.140   12.039 22.25868 15.50753 
1 1 1    5   35   13 o   37.378   6.6640   35.213   9.5882   24.622   20.208   38.290   10.892   32.698   11.756   42.058   6.2791 -9.359962 13.32791 
1 1 1    5   35   14 o   48.913   6.0551   56.453   10.559   51.172   19.630   58.604   12.526   45.706   10.616   52.119   5.8269 -6.412804 12.11029 
1 1 1    5   35   15 o   23.566   7.4435  -1.9682   14.931   5.3025   18.825 -14.2974   24.515   24.552   10.491   22.579   10.563 1.973030 14.88703 
1 1 1    5   35   16 o   27.980   8.0209   11.108   15.799   25.188   20.323 -10.3995   25.118   32.435   11.771   23.525   10.899 8.910513 16.04188 
1 1 1    5   35   17 o   26.075   7.8646   3.3619   16.278   19.797   21.402 -19.1924   25.071   30.303   11.835   21.848   10.361 8.454935 15.72911 
1 1 1    5   35   18 o   49.207   8.9941   64.659   18.305   59.789   24.498   70.814   27.542   47.354   12.398   51.061   13.034 -3.706264 17.98825 
1 1 1    5   35   19 o   39.545   8.7930   44.054   17.321   57.817   22.699   24.872   26.798   46.683   11.787   32.407   13.051 14.27572 17.58593 
1 1 1    5   35   20 o   29.046   8.5625   16.535   16.843   16.227   21.861   16.984   26.418   28.425   11.661   29.666   12.542 -1.241117 17.12496 
1 1 1    5   35   21 o   28.439   8.0482   10.543   17.029   34.380   22.257 -23.1110   26.446   35.448   12.376   21.431   10.293 14.01773 16.09643 
1 1 1    5   35   22 o   24.412   8.0075  -5.8746   18.031  -9.5996   22.063   1.6165   31.288   21.618   10.083   27.205   12.443 -5.586592 16.01495 
1 1 1    5   35   23 o   29.035   8.7667   10.640   19.853   35.986   28.811 -12.2759   27.395   34.910   13.703   23.161   10.938 11.74872 17.53330 
1 1 1    5   35   24 o   32.790   8.8454   29.358   18.202   45.958   24.495   8.8882   27.201   38.733   12.998   26.847   12.001 11.88673 17.69081 
1 1 1    5   35   25 o   28.541   9.3489   5.4060   23.648   29.394   43.276  -4.8067   28.237   32.785   14.854   24.297   11.357 8.488476 18.69771 
1 1 1    5   35   26 f   26.487   8.3785   10.294   18.680   10.018   24.888   10.650   28.267   26.044   11.571   26.930   12.120 -0.8858986 16.75694 
1 1 1    5   35   27 o   24.244   7.9292   1.7055   18.661   3.3935   25.133  -0.3682   27.857   24.232   11.108   24.256   11.318 -0.2396584E-01 15.85845 
1 1 1    5   35   28 o   22.616   7.5862  -7.1260   18.995  -7.3044   25.949  -6.9200   27.882   22.288   10.561   22.943   10.893 -0.6541595 15.17246 
1 1 1    5   36    0 o   13.206   6.4342 -10.5770   16.438 -10.5770   16.438 -10.5770   16.438   13.206   9.0994   13.206   9.0994 0.000000 0.000000 
1 1 1    5   36    1 o   75.897   4.9485  122.229   15.490  122.229   15.490   0.0000   0.0000   75.897   4.9485  ?   ?       ?      ? 
1 1 1    5   36    2 o   55.337   7.3969   95.264   13.380  112.318   15.162   35.252   28.442   72.707   5.0561   37.968   13.903 34.73893 14.79379 
1 1 1    5   36    3 f   14.338   4.3162   0.3920   4.5067  -3.4899   7.5406   2.5491   5.6211   13.745   6.2162   14.930   5.9898 -1.185238 8.632389 
1 1 1    5   36    4 o   29.823   5.1879   17.536   6.0166   29.276   11.132   12.691   7.1510   35.813   7.7605   23.833   6.8871 11.98001 10.37586 
1 1 1    5   36    5 o   22.002   5.7203   9.0958   6.5746   9.3202   11.281   8.9804   8.0905   22.845   8.6771   21.158   7.4563 1.687412 11.44063 
1 1 1    5   36    6 o   39.081   5.4571   36.885   7.7253   28.337   14.271   40.428   9.1879   34.571   9.6440   43.591   5.1103 -9.020245 10.91427 
1 1 1    5   36    7 o   18.217   5.4520  -0.4670   6.3151   8.3541   12.549  -3.4587   7.3080   22.936   9.0310   13.498   6.1106 9.438607 10.90403 
1 1 1    5   36    8 o   45.382   5.7757   53.778   9.0610   31.934   16.615   63.025   10.810   36.277   10.502   54.486   4.8103 -18.20903 11.55138 
1 1 1    5   36    9 o   50.837   6.7205   61.219   13.589   66.628   18.237   54.469   20.376   54.495   8.1141   47.179   10.715 7.315571 13.44092 
1 1 1    5   36   10 o   40.095   6.1216   34.892   10.123   0.0000   0.0000   34.892   10.123  ?   ?    40.095   6.1216      ?      ? 
1 1 1    5   36   11 o   48.482   6.1459   52.985   10.800   58.053   20.459   51.027   12.717   48.631   10.507   48.332   6.3793 0.2988625 12.29183 
1 1 1    5   36   12 o   42.090   6.6200   43.982   9.9926   37.469   20.408   46.036   11.460   38.172   11.782   46.009   6.0393 -7.837814 13.23991 
1 1 1    5   36   13 o   24.253   6.6431   11.348   8.8709   0.8987   19.779   13.979   9.9252   23.555   10.397   24.951   8.2717 -1.395895 13.28629 
1 1 1    5   36   14 f   28.227   7.2178   7.1293   9.2108   40.258   22.070   0.1420   10.136   39.011   12.288   17.442   7.5766 21.56922 14.43564 
1 1 1    5   36   15 o   49.562   6.9730   65.079   11.306   49.538   24.382   69.337   12.762   42.532   12.830   56.592   5.4674 -14.06004 13.94606 
1 1 1    5   36   16 o   47.649   8.3558   59.840   16.202   56.540   21.335   64.336   24.904   46.604   11.231   48.694   12.375 -2.089298 16.71150 
1 1 1    5   36   17 o   32.911   7.8754   15.472   16.187 -17.9762   21.557   58.710   24.509   19.905   9.4872   45.916   12.573 -26.01067 15.75082 
1 1 1    5   36   18 o   34.289   9.8900   27.107   19.074   21.969   21.588   45.397   40.727   30.410   11.883   38.168   15.812 -7.757544 19.77993 
1 1 1    5   36   19 o   55.786   7.9429   83.534   17.649   99.461   23.586   63.271   26.604   64.689   8.8403   46.883   13.199 17.80600 15.88582 
1 1 1    5   36   20 o   26.546   8.0838   10.221   16.199   15.286   21.441   3.4839   24.728   27.695   11.473   25.397   11.391 2.297558 16.16761 
1 1 1    5   36   21 o   29.995   8.7422   21.316   17.413   16.496   23.345   27.362   26.143   28.137   11.837   31.853   12.868 -3.715851 17.48438 
1 1 1    5   36   22 o   31.079   9.2251   15.704   19.455  -2.3965   23.645   53.648   34.234   23.244   10.699   38.915   15.031 -15.67109 18.45022 
1 1 1    5   36   23 o   30.041   8.2659   7.6063   17.740 -27.0448   23.327   55.129   27.319   18.895   9.2133   41.188   13.727 -22.29351 16.53183 
1 1 1    5   36   24 o   28.218   8.6490   17.327   18.354   12.391   24.016   24.258   28.457   26.365   11.553   30.070   12.874 -3.705229 17.29799 
1 1 1    5   36   25 o   25.840   8.7788  -3.3083   21.038  -9.7498   23.462   23.124   47.526   21.166   10.033   30.513   14.408 -9.346186 17.55765 
1 1 1    5   36   26 o   31.782   8.4802   26.634   18.953   57.619   25.279 -13.1483   28.643   41.315   13.165   22.248   10.693 19.06707 16.96037 
1 1 1    5   37    1 o   40.274   6.4233   41.092   8.4475   42.989   9.2918   32.051   20.282   44.851   5.0230   35.698   11.824 9.152481 12.84654 
1 1 1    5   37    2 o   29.617   5.8116   24.554   8.4323   30.979   9.0743 -16.0916   22.823   37.845   5.8135   21.389   10.065 16.45656 11.62314 
1 1 1    5   37    3 o   38.441   4.3469   34.836   5.8386   27.544   10.722   37.910   6.9612   34.493   7.7284   42.389   3.9816 -7.895851 8.693759 
1 1 1    5   37    4 o   54.645   6.3089   65.183   14.219   0.0000   0.0000   65.183   14.219  ?   ?    54.645   6.3089      ?      ? 
1 1 1    5   37    5 o   78.694   3.4443  129.342   10.289  139.701   18.915  124.989   12.262   80.385   5.7051   77.004   3.8607 3.381256 6.888645 
1 1 1    5   37    6 o   36.566   5.4358   29.998   7.3844   31.816   13.854   29.277   8.7276   36.358   9.2239   36.774   5.7543 -0.4160194 10.87164 
1 1 1    5   37    7 o   75.841   3.8751  119.944   11.473  136.999   20.234  111.862   13.928   79.223   6.1924   72.460   4.6606 6.762756 7.750273 
1 1 1    5   37    8 o   38.355   5.8884   33.840   8.2889   34.767   16.067   33.503   9.6759   37.476   10.146   39.234   5.9794 -1.758087 11.77688 
1 1 1    5   37    9 o   43.315   7.0584   48.605   13.437   68.845   18.066   23.541   20.104   55.094   7.9503   31.536   11.665 23.55861 14.11688 
1 1 1    5   37   10 o   25.148   7.9066   14.499   9.1428   0.0000   0.0000   14.499   9.1428  ?   ?    25.148   7.9066      ?      ? 
1 1 1    5   37   11 o   78.175   4.5518  133.233   13.662  139.539   24.338  130.332   16.508   78.581   7.5093   77.768   5.1466 0.8129501 9.103693 
1 1 1    5   37   12 o   27.745   6.3815   19.852   9.1934  -3.0275   20.311   25.747   10.310   22.450   10.173   33.040   7.7070 -10.58983 12.76292 
1 1 1    5   37   13 o   32.575   7.3931   22.785   9.2637   36.294   21.926   19.849   10.221   36.389   12.297   28.761   8.2104 7.627714 14.78623 
1 1 1    5   37   14 o   62.022   9.5458   93.143   24.419   93.143   24.419   0.0000   0.0000   62.022   9.5458  ?   ?       ?      ? 
1 1 1    5   37   15 o   30.837   7.1320   24.033   9.6737   18.353   21.799   25.426   10.795   29.122   11.756   32.552   8.0784 -3.430531 14.26394 
1 1 1    5   37   16 o   45.504   8.1454   56.464   15.315   60.933   19.999   50.129   23.815   49.003   10.226   42.004   12.682 6.998592 16.29086 
1 1 1    5   37   17 o   29.665   8.7387   17.727   19.297 -13.3005   35.242   31.013   23.062   25.764   12.237   33.566   12.478 -7.802158 17.47732 
1 1 1    5   37   18 o   41.123   9.2766   56.033   19.042   62.919   21.612   32.139   40.260   48.402   11.067   33.844   14.891 14.55781 18.55314 
1 1 1    5   37   19 o   19.730   6.6887 -18.4385   15.106 -25.0892   19.515  -8.4965   23.860   17.307   8.4362   22.154   10.382 -4.847458 13.37734 
1 1 1    5   37   20 o   24.444   7.7793   3.4707   16.186  -0.0630   21.071   8.5578   25.282   22.734   10.325   26.153   11.639 -3.418341 15.55857 
1 1 1    5   37   21 o   34.418   8.1863   31.484   16.979   60.177   23.264  -1.2196   24.836   45.170   12.200   23.665   10.919 21.50551 16.37270 
1 1 1    5   37   22 o   31.199   9.0993   29.173   18.848   32.286   28.400   26.724   25.196   32.009   13.228   30.388   12.498 1.620775 18.19855 
1 1 1    5   37   23 o   21.906   7.2746 -13.4843   17.035 -35.0461   22.818   13.662   25.603   17.313   8.5715   26.498   11.756 -9.185598 14.54923 
1 1 1    5   37   24 o   26.582   8.8731   2.8740   22.313   31.023   42.274  -7.9967   26.271   30.908   14.256   22.256   10.569 8.652412 17.74614 
1 1 1    5   38    1 o   42.932   10.229   46.043   17.856   0.0000   0.0000   46.043   17.856  ?   ?    42.932   10.229      ?      ? 
1 1 1    5   38    2 o   95.644   4.9426  196.447   19.498  196.447   19.498   0.0000   0.0000   95.644   4.9426  ?   ?       ?      ? 
1 1 1    5   38    3 o   31.292   6.6824   26.098   8.9161   29.188   9.6987   9.2365   22.657   35.746   6.8274   26.839   11.489 8.906561 13.36472 
1 1 1    5   38    4 o   39.432   4.6892   33.293   7.6262   0.0000   0.0000   33.293   7.6262  ?   ?    39.432   4.6892      ?      ? 
1 1 1    5   38    5 o   36.152   4.7185   26.847   6.5752   38.746   11.812   21.505   7.9150   41.623   6.8803   30.681   6.4591 10.94236 9.437083 
1 1 1    5   38    6 f   21.462   5.2205   9.0001   6.7256  -6.4704   11.685   16.664   8.2246   16.237   7.4909   26.687   7.2733 -10.45013 10.44103 
1 1 1    5   38    7 o   57.840   7.2254   75.760   17.237   75.760   17.237   0.0000   0.0000   57.840   7.2254  ?   ?       ?      ? 
1 1 1    5   38    8 o   21.047   6.0281   4.6826   7.0499   13.789   14.688   1.9566   8.0361   25.627   9.8607   16.467   6.9369 9.160700 12.05625 
1 1 1    5   38    9 o   18.685   5.6995   2.3077   7.5309  -5.7980   15.210   4.9400   8.6679   18.845   8.6397   18.524   7.4358 0.3203392 11.39892 
1 1 1    5   38   10 o   21.383   7.7887   9.4410   8.9094   0.0000   0.0000   9.4410   8.9094  ?   ?    21.383   7.7887      ?      ? 
1 1 1    5   38   11 o   61.422   5.5977   95.643   11.462   69.094   21.180  106.638   13.631   52.414   10.164   70.430   4.6925 -18.01563 11.19534 
1 1 1    5   38   12 o   43.677   6.4126   44.916   9.6176   49.215   20.419   43.690   10.903   42.853   11.366   44.501   5.9403 -1.647335 12.82513 
1 1 1    5   38   13 o   26.125   6.9593   14.545   8.7116   15.108   20.567   14.421   9.6169   27.451   11.291   24.798   8.1385 2.653353 13.91865 
1 1 1    5   38   14 o   63.268   5.4566   86.480   12.280  107.782   25.546   80.080   14.004   66.268   9.3467   60.268   5.6336 5.999649 10.91317 
1 1 1    5   38   15 o   26.254   6.7156   17.235   9.6198  -0.8250   21.876   21.565   10.711   23.019   10.480   29.489   8.4004 -6.470530 13.43113 
1 1 1    5   38   16 o   73.935   6.2294  132.969   18.941  147.115   27.719  120.578   25.943   77.835   8.6346   70.035   8.9813 7.799889 12.45875 
1 1 1    5   38   17 o   29.696   8.5604   14.657   10.018   45.882   35.728   11.993   10.436   36.319   14.904   23.074   8.4259 13.24548 17.12080 
1 1 1    5   38   18 f   24.606   8.1403  -0.0641   17.240  -0.2827   19.336   0.7837   38.081   21.827   9.9046   27.385   12.921 -5.558699 16.28068 
1 1 1    5   38   19 o   43.199   8.8032   55.079   16.600   41.360   21.436   75.632   26.238   36.668   12.156   49.731   12.736 -13.06318 17.60635 
1 1 1    5   38   20 o   35.179   8.6957   34.404   16.405   15.407   20.936   64.627   26.407   26.237   11.132   44.121   13.361 -17.88422 17.39135 
1 1 1    5   38   21 o   27.384   8.0367   15.892   17.834   34.636   21.315 -27.8520   32.564   33.080   12.048   21.687   10.640 11.39280 16.07345 
1 1 1    5   38   22 o   32.118   9.1865   34.667   18.846   37.395   27.384   32.211   25.975   32.852   13.206   31.385   12.774 1.467398 18.37292 
1 1 1    5   39    8 f   31.300   7.8685   27.012   13.839   34.180   15.555  -0.2036   30.309   36.291   10.049   26.308   12.111 9.982529 15.73707 
1 1 1    5   39    9 f   27.338   8.2795   10.260   13.537   6.0006   15.087   27.852   30.661   22.221   9.4404   32.454   13.604 -10.23286 16.55897 
1 1 1    5   39   10 o   25.506   11.885  -3.3930   30.556   0.0000   0.0000  -3.3930   30.556  ?   ?    25.506   11.885      ?      ? 
1 1 1    5   39   11 o   20.472   6.5585  -4.7065   12.641   6.7949   16.481 -21.1448   19.703   22.922   9.8053   18.023   8.7127 4.899271 13.11696 
1 1 1    5   39   12 o   20.472   6.2348   4.5503   8.2704   2.7397   17.984   5.0359   9.3136   22.227   9.8575   18.717   7.6369 3.509729 12.46965 
1 1 1    5   39   13 o   32.574   6.8364   30.324   9.9777   16.136   21.588   34.178   11.252   27.376   11.441   37.773   7.4867 -10.39750 13.67278 
1 1 1    5   39   14 o   27.908   6.9570   20.730   10.078   8.1427   21.597   24.234   11.394   24.881   10.928   30.935   8.6129 -6.054462 13.91400 
1 1 1    5   39   15 o   61.021   7.5451  101.820   18.873  187.491   28.544   35.279   25.156   88.495   7.8204   33.547   12.906 54.94796 15.09013 
1 1 1    5   39   16 o   26.055   6.6117   17.646   10.543 -10.2085   22.345   25.623   11.958   20.742   9.8205   31.367   8.8553 -10.62463 13.22338 
1 1 1    5   39   17 o   44.133   6.9081   45.725   12.574   0.0000   0.0000   45.725   12.574  ?   ?    44.133   6.9081      ?      ? 
1 1 1    5   39   18 o   33.587   6.8416   34.399   10.979   16.759   20.326   41.665   13.046   26.392   11.071   40.782   8.0416 -14.38940 13.68318 
1 1 1    5   39   19 o   22.368   6.9563  -6.4924   15.208   22.993   19.619 -50.8741   24.071   28.485   11.268   16.251   8.1608 12.23387 13.91268 
1 1 1    6    0    0 o  390.698   5.9995  3153.72  136.575  3153.72  136.575  3153.72  136.575  390.698   8.4845  390.698   8.4845 0.000000 0.000000 
1 1 1    6    0    1 o  612.294   6.1010  7743.24  217.794  7743.24  217.794  7743.24  217.794  612.294   8.6281  612.294   8.6281 0.000000 0.000000 
1 1 1    6    0    2 o  106.952   2.5003  236.704   15.559  236.704   15.559  236.704   15.559  106.952   3.5359  106.952   3.5359 0.000000 0.000000 
1 1 1    6    0    3 o  590.392   4.1770  7194.16  143.810  7194.16  143.810  7194.16  143.810  590.392   5.9072  590.392   5.9072 0.000000 0.000000 
1 1 1    6    0    4 o   53.559   2.6936   60.064   8.3170   60.064   8.3170   60.064   8.3170   53.559   3.8093   53.559   3.8093 0.000000 0.000000 
1 1 1    6    0    5 o  332.862   2.6835  2286.48   52.086  2286.48   52.086  2286.48   52.086  332.862   3.7950  332.862   3.7950 0.000000 0.000000 
1 1 1    6    0    6 o  257.833   2.3095  1371.96   34.720  1371.96   34.720  1371.96   34.720  257.833   3.2661  257.833   3.2661 0.000000 0.000000 
1 1 1    6    0    7 o   38.992   2.7446   32.288   6.1002   32.288   6.1002   32.288   6.1002   38.992   3.8815   38.992   3.8815 0.000000 0.000000 
1 1 1    6    0    8 o  258.957   3.3222  1385.17   50.144  1385.17   50.144  1385.17   50.144  258.957   4.6984  258.957   4.6984 0.000000 0.000000 
1 1 1    6    0   10 o  460.783   3.4408  4382.78   92.455  4382.78   92.455  4382.78   92.455  460.783   4.8661  460.783   4.8661 0.000000 0.000000 
1 1 1    6    0   11 o  159.763   2.1774  527.073   20.274  527.073   20.274  527.073   20.274  159.763   3.0793  159.763   3.0793 0.000000 0.000000 
1 1 1    6    0   12 o  581.394   4.1672  6977.49  141.286  6977.49  141.286  6977.49  141.286  581.394   5.8934  581.394   5.8934 0.000000 0.000000 
1 1 1    6    0   13 o  225.326   2.3980  1047.91   31.500  1047.91   31.500  1047.91   31.500  225.326   3.3912  225.326   3.3912 0.000000 0.000000 
1 1 1    6    0   14 o  396.644   3.1422  3246.46   72.676  3246.46   72.676  3246.46   72.676  396.644   4.4437  396.644   4.4437 0.000000 0.000000 
1 1 1    6    0   15 o  140.936   2.5292  410.486   20.761  410.486   20.761  410.486   20.761  140.936   3.5768  140.936   3.5768 0.000000 0.000000 
1 1 1    6    0   16 o  270.190   3.6799  1507.70   57.946  1507.70   57.946  1507.70   57.946  270.190   5.2042  270.190   5.2042 0.000000 0.000000 
1 1 1    6    0   17 o  335.842   2.8790  2327.61   56.378  2327.61   56.378  2327.61   56.378  335.842   4.0715  335.842   4.0715 0.000000 0.000000 
1 1 1    6    0   18 o   54.059   4.9602   63.287   14.913   63.287   14.913   63.287   14.913   54.059   7.0147   54.059   7.0147 0.000000 0.000000 
1 1 1    6    0   19 o  308.409   2.7889  1963.04   50.152  1963.04   50.152  1963.04   50.152  308.409   3.9441  308.409   3.9441 0.000000 0.000000 
1 1 1    6    0   20 o  168.974   3.7775  590.953   37.147  590.953   37.147  590.953   37.147  168.974   5.3422  168.974   5.3422 0.000000 0.000000 
1 1 1    6    0   21 o  405.992   3.2586  3402.31   77.144  3402.31   77.144  3402.31   77.144  405.992   4.6083  405.992   4.6083 0.000000 0.000000 
1 1 1    6    0   22 o   21.124   8.4931   11.978   16.288   11.978   16.288   11.978   16.288   21.124   12.011   21.124   12.011 0.000000 0.000000 
1 1 1    6    0   23 o   41.190   8.8964   43.649   18.674   43.649   18.674   43.649   18.674   41.190   12.581   41.190   12.581 0.000000 0.000000 
1 1 1    6    0   24 o  137.600   3.0853  391.925   24.706  391.925   24.706  391.925   24.706  137.600   4.3633  137.600   4.3633 0.000000 0.000000 
1 1 1    6    0   25 o  537.510   4.0094  5969.39  125.672  5969.39  125.672  5969.39  125.672  537.510   5.6701  537.510   5.6701 0.000000 0.000000 
1 1 1    6    0   26 o   15.768   7.6729 -16.8702   23.209 -16.8702   23.209 -16.8702   23.209   15.768   10.851   15.768   10.851 0.000000 0.000000 
1 1 1    6    0   27 o   86.522   4.2314  156.886   21.120  156.886   21.120  156.886   21.120   86.522   5.9841   86.522   5.9841 0.000000 0.000000 
1 1 1    6    0   28 o  271.794   2.8728  1526.07   45.520  1526.07   45.520  1526.07   45.520  271.794   4.0627  271.794   4.0627 0.000000 0.000000 
1 1 1    6    0   29 o   28.864   10.060   25.609   20.260   25.609   20.260   25.609   20.260   28.864   14.226   28.864   14.226 0.000000 0.000000 
1 1 1    6    0   30 o   86.141   5.8208  157.925   28.633  157.925   28.633  157.925   28.633   86.141   8.2318   86.141   8.2318 0.000000 0.000000 
1 1 1    6    0   31 o   31.083   10.291   29.571   20.872   29.571   20.872   29.571   20.872   31.083   14.554   31.083   14.554 0.000000 0.000000 
1 1 1    6    0   32 o  287.283   3.6100  1707.34   60.449  1707.34   60.449  1707.34   60.449  287.283   5.1054  287.283   5.1054 0.000000 0.000000 
1 1 1    6    0   33 o  213.766   3.7504  946.535   46.697  946.535   46.697  946.535   46.697  213.766   5.3038  213.766   5.3038 0.000000 0.000000 
1 1 1    6    0   34 o   54.361   8.8163   70.510   24.345   70.510   24.345   70.510   24.345   54.361   12.468   54.361   12.468 0.000000 0.000000 
1 1 1    6    0   35 o  199.176   4.2262  824.079   48.998  824.079   48.998  824.079   48.998  199.176   5.9767  199.176   5.9767 0.000000 0.000000 
1 1 1    6    0   36 o   90.053   7.0962  175.727   36.089  175.727   36.089  175.727   36.089   90.053   10.036   90.053   10.036 0.000000 0.000000 
1 1 1    6    0   37 o   18.024   8.8799 -29.1961   33.611 -29.1961   33.611 -29.1961   33.611   18.024   12.558   18.024   12.558 0.000000 0.000000 
1 1 1    6    0   38 o   75.484   18.460  168.991   73.265  168.991   73.265  168.991   73.265   75.484   26.106   75.484   26.106 0.000000 0.000000 
1 1 1    6    0   39 o   33.474   11.847   36.832   28.273   36.832   28.273   36.832   28.273   33.474   16.754   33.474   16.754 0.000000 0.000000 
1 1 1    6    0   40 o   87.525   5.6757  165.195   28.415  165.195   28.415  165.195   28.415   87.525   8.0266   87.525   8.0266 0.000000 0.000000 
1 1 1    6    0   41 o   15.417   7.5638 -17.9534   23.712 -17.9534   23.712 -17.9534   23.712   15.417   10.697   15.417   10.697 0.000000 0.000000 
1 1 1    6    0   42 o   23.961   10.206   14.942   25.911   14.942   25.911   14.942   25.911   23.961   14.433   23.961   14.433 0.000000 0.000000 
1 1 1    6    0   43 o   83.838   5.3987  152.645   25.897  152.645   25.897  152.645   25.897   83.838   7.6349   83.838   7.6349 0.000000 0.000000 
1 1 1    6    0   44 o   19.180   8.7886   2.2570   23.291   2.2570   23.291   2.2570   23.291   19.180   12.429   19.180   12.429 0.000000 0.000000 
1 1 1    6    0   45 o   54.854   12.212   86.869   34.327   86.869   34.327   86.869   34.327   54.854   17.271   54.854   17.271 0.000000 0.000000 
1 1 1    6    0   46 o   22.048   9.5531   13.101   23.550   13.101   23.550   13.101   23.550   22.048   13.510   22.048   13.510 0.000000 0.000000 
1 1 1    6    0   47 o   16.190   7.7382  -5.7932   21.433  -5.7932   21.433  -5.7932   21.433   16.190   10.944   16.190   10.944 0.000000 0.000000 
1 1 1    6    0   48 o   21.828   9.2189   15.193   20.784   15.193   20.784   15.193   20.784   21.828   13.037   21.828   13.037 0.000000 0.000000 
1 1 1    6    0   49 o   13.525   6.8674 -34.8070   25.956 -34.8070   25.956 -34.8070   25.956   13.525   9.7120   13.525   9.7120 0.000000 0.000000 
1 1 1    6    0   50 o   19.578   9.2480   2.1825   29.002   2.1825   29.002   2.1825   29.002   19.578   13.079   19.578   13.079 0.000000 0.000000 
1 1 1    6    1    0 o  272.935   3.3483  1538.06   53.269  1538.06   53.269  1538.06   53.269  272.935   4.7353  272.935   4.7353 0.000000 0.000000 
1 1 1    6    1    1 o  510.526   5.2229  5382.16  109.963  5414.56  156.909  5350.89  154.150  512.032   7.4299  509.021   7.3425 3.010620 10.44587 
1 1 1    6    1    2 o  274.565   3.3577  1555.57   38.023  1562.12   54.020  1549.13   53.527  275.138   4.7604  273.992   4.7367 1.146149 6.715441 
1 1 1    6    1    3 o  309.706   2.7511  1983.14   34.940  1938.00   51.959  2020.40   47.206  306.474   4.1106  312.939   3.6574 -6.465149 5.502131 
1 1 1    6    1    4 o  585.158   4.1469  7065.07   99.993  7184.77  145.018  6956.58  138.062  589.867   5.9608  580.449   5.7669 9.418701 8.293860 
1 1 1    6    1    5 o   94.665   1.7900  184.791   6.9875  189.055   9.9894  180.706   9.7776   95.734   2.5299   93.596   2.5328 2.137825 3.579921 
1 1 1    6    1    6 o  247.783   2.2583  1266.80   23.079  1268.18   32.683  1265.44   32.594  247.917   3.1963  247.649   3.1911 0.2675323 4.516609 
1 1 1    6    1    7 f  114.631   1.9180  268.396   8.7800  281.701   14.501  260.694   11.032  116.846   3.0089  112.416   2.3794 4.430000 3.836029 
1 1 1    6    1    8 o  184.230   2.6833  688.476   19.568  742.654   33.199  659.634   24.222  189.668   4.2439  178.791   3.2848 10.87732 5.366573 
1 1 1    6    1    9 o  327.550   7.6475  2219.94  103.315   0.0000   0.0000  2219.94  103.315  ?   ?   327.550   7.6475      ?      ? 
1 1 1    6    1   10 o  137.153   3.1224  387.434   17.641  370.567   24.215  406.506   25.751  133.981   4.3821  140.326   4.4492 -6.344452 6.244876 
1 1 1    6    1   11 o  417.910   3.2103  3605.15   55.334  3601.29   78.156  3609.03   78.353  417.686   4.5367  418.134   4.5433 -0.4480591 6.420573 
1 1 1    6    1   12 o  316.298   2.7042  2063.99   35.273  2080.69   50.372  2047.92   49.410  317.552   3.8460  315.043   3.8026 2.509094 5.408445 
1 1 1    6    1   13 o  719.508   5.0177 10690.46  148.902 10677.53  210.043 10703.53  211.122  719.073   7.0822  719.944   7.1100 -0.8710327 10.03541 
1 1 1    6    1   14 o  487.193   3.6327  4897.72   72.988  4927.72  104.074  4868.69  102.388  488.659   5.1638  485.727   5.1108 2.932343 7.265355 
1 1 1    6    1   15 o  178.773   2.4595  659.308   18.134  667.723   25.688  650.949   25.602  179.910   3.4619  177.635   3.4945 2.274719 4.918955 
1 1 1    6    1   16 o  450.532   4.4413  4195.48   81.080  4218.13  105.416  4162.67  126.870  452.069   5.6538  448.996   6.8509 3.072540 8.882594 
1 1 1    6    1   17 o  277.336   2.8504  1587.67   32.306  1581.82   49.079  1592.13   42.913  276.876   4.2978  277.797   3.7454 -0.9205322 5.700798 
1 1 1    6    1   18 o  130.292   2.7287  349.611   14.650  331.026   20.250  370.019   21.220  126.666   3.8761  133.919   3.8419 -7.253143 5.457498 
1 1 1    6    1   19 o  201.170   2.5361  834.718   21.039  851.691   30.052  818.405   29.463  203.175   3.5863  199.165   3.5868 4.009857 5.072103 
1 1 1    6    1   20 o  183.915   3.3607  693.350   24.705  717.904   40.582  678.891   31.141  186.462   5.2769  181.368   4.1630 5.093719 6.721314 
1 1 1    6    1   21 o  326.988   3.1612  2206.17   42.112  2200.52   55.362  2213.93   64.874  326.517   4.1109  327.458   4.8034 -0.9412537 6.322359 
1 1 1    6    1   22 o  409.281   3.2904  3458.91   55.543  3469.92   78.897  3448.10   78.207  409.925   4.6665  408.638   4.6403 1.287964 6.580897 
1 1 1    6    1   23 o  240.665   2.7559  1195.60   27.354  1180.49   38.565  1210.90   38.805  239.134   3.9101  242.196   3.8847 -3.061783 5.511762 
1 1 1    6    1   24 o  156.436   2.9492  505.107   19.020  484.789   26.592  526.389   27.216  153.215   4.2081  159.658   4.1330 -6.442459 5.898331 
1 1 1    6    1   25 o  183.414   2.8331  694.837   21.431  698.624   30.328  691.060   30.289  183.914   3.9982  182.914   4.0149 0.9994812 5.666121 
1 1 1    6    1   26 o  101.766   4.4595  214.115   18.552  211.661   24.585  217.359   28.272  101.118   5.8949  102.414   6.6933 -1.295822 8.919052 
1 1 1    6    1   27 o  185.853   3.4715  711.708   26.131  727.420   41.246  701.174   33.773  187.516   5.3331  184.191   4.4457 3.325134 6.943053 
1 1 1    6    1   28 o   37.784   7.7534   28.952   14.056   47.280   19.732   10.069   20.029   46.644   10.509   28.924   11.403 17.71951 15.50673 
1 1 1    6    1   29 o   28.175   8.4224   1.2334   17.034  -8.7862   26.396   8.3844   22.299   26.874   11.929   29.476   11.893 -2.602379 16.84488 
1 1 1    6    1   30 o  104.365   4.7301  223.676   20.241  203.458   26.909  250.021   30.717   99.003   6.5899  109.727   6.7874 -10.72401 9.460160 
1 1 1    6    1   31 o  148.502   3.2471  456.399   19.885  449.810   28.230  462.887   28.014  147.432   4.6424  149.571   4.5412 -2.138885 6.494188 
1 1 1    6    1   32 o  109.161   4.0648  247.604   18.250  268.261   25.774  226.832   25.845  113.763   5.4930  104.560   5.9930 9.203445 8.129564 
1 1 1    6    1   33 o   34.499   8.9685   19.057   17.955   32.394   22.627  -3.6197   29.505   39.298   12.449   29.700   12.914 9.598684 17.93701 
1 1 1    6    1   34 o   21.984   7.2980 -28.4648   16.991 -11.3772   25.114 -42.8899   23.075   25.379   11.423   18.590   9.0861 6.788965 14.59603 
1 1 1    6    1   35 o   63.518   8.5270   88.164   21.267   93.448   33.118   84.456   27.743   64.925   12.823   62.112   11.244 2.813118 17.05403 
1 1 1    6    1   36 o   78.794   6.0941  133.454   19.350  159.847   26.785  104.645   27.984   87.324   7.4369   70.264   9.6563 17.05934 12.18822 
1 1 1    6    1   37 o   37.329   9.6759   22.949   19.563   11.448   25.088   40.790   31.246   31.225   12.609   43.434   14.680 -12.20904 19.35184 
1 1 1    6    1   38 o   43.077   9.3418   31.163   20.865  -0.1044   26.998   77.533   32.878   28.580   12.390   57.574   13.984 -28.99417 18.68366 
1 1 1    6    1   39 o   34.064   8.8982   21.477   16.804   30.336   24.258   13.304   23.299   37.483   12.929   30.644   12.229 6.839338 17.79645 
1 1 1    6    1   40 o   32.535   9.1656   15.783   18.994  -1.8876   31.949   25.442   23.621   29.963   13.221   35.108   12.698 -5.144907 18.33113 
1 1 1    6    1   41 o   39.259   8.2191   28.754   17.435  -4.3076   23.751   67.391   25.676   25.256   11.257   53.261   11.979 -28.00446 16.43828 
1 1 1    6    1   42 o   25.692   8.2507 -10.2616   19.304  -0.5776   25.571 -23.0925   29.434   27.014   11.877   24.369   11.455 2.645264 16.50138 
1 1 1    6    1   43 o   22.635   7.5647 -21.7555   18.384 -27.3691   28.808 -17.8990   23.878   23.125   11.007   22.146   10.380 0.9788742 15.12940 
1 1 1    6    1   44 o   59.276   7.7553   83.738   18.260   85.095   26.040   82.425   25.613   59.758   10.970   58.795   10.966 0.9632645 15.51052 
1 1 1    6    1   45 o   51.545   9.7183   68.463   22.346   39.930   30.167  103.155   33.264   39.507   14.341   63.583   13.120 -24.07570 19.43662 
1 1 1    6    1   46 o   24.784   7.8450  -1.6918   16.568   5.0596   24.028  -7.8121   22.877   26.570   11.602   22.999   10.563 3.571507 15.68994 
1 1 1    6    1   47 o   23.495   7.4980  -2.1646   15.446  -4.7493   22.270   0.2314   21.441   23.087   10.535   23.903   10.672 -0.8167229 14.99604 
1 1 1    6    1   48 o   31.634   8.8532   24.368   17.173   27.720   24.478   21.119   24.099   32.790   12.698   30.477   12.340 2.312767 17.70650 
1 1 1    6    1   49 o   34.887   9.5942   35.878   20.082   27.710   28.480   43.956   28.321   32.243   13.278   37.531   13.853 -5.288059 19.18839 
1 1 1    6    1   50 o   29.545   9.4141   15.439   23.177   8.8316   28.841   27.485   38.941   27.003   12.190   32.086   14.350 -5.083221 18.82817 
1 1 1    6    2    0 o  372.367   4.0909  2862.87   88.805  2862.87   88.805  2862.87   88.805  372.367   5.7854  372.367   5.7854 0.000000 0.000000 
1 1 1    6    2    1 o  550.218   5.5622  6253.65  126.203  6299.65  180.445  6209.61  176.573  552.191   7.9230  548.245   7.8088 3.945801 11.12435 
1 1 1    6    2    2 f  378.886   3.8008  2947.70   57.623  3025.91   94.213  2900.96   72.834  382.840   5.9666  374.931   4.7100 7.908691 7.601578 
1 1 1    6    2    3 o  188.102   2.5600  731.608   19.513  721.234   30.478  738.815   25.402  186.961   3.9525  189.243   3.2545 -2.281631 5.119983 
1 1 1    6    2    4 o  366.011   2.8586  2764.42   43.152  2757.68   60.827  2771.25   61.227  365.562   4.0343  366.460   4.0509 -0.8973694 5.717122 
1 1 1    6    2    5 o  454.198   3.3629  4258.86   62.997  4250.50   88.819  4267.33   89.367  453.750   4.7459  454.646   4.7658 -0.8954468 6.725850 
1 1 1    6    2    6 o   97.429   1.9632  195.341   7.8011  199.112   12.012  192.590   10.259   98.237   2.9647   96.620   2.5744 1.616623 3.926444 
1 1 1    6    2    7 o  200.932   2.9344  812.651   23.909  947.180   38.329  726.965   30.590  214.195   4.3387  187.668   3.9521 26.52682 5.868818 
1 1 1    6    2    8 o  160.300   2.2868  530.222   15.116  515.380   21.291  545.307   21.465  158.037   3.2664  162.563   3.2014 -4.525787 4.573665 
1 1 1    6    2    9 o  330.652   3.4929  2264.52   47.022  2301.83   62.016  2214.07   72.119  333.903   4.5032  327.400   5.3408 6.502899 6.985895 
1 1 1    6    2   10 o   97.553   2.8333  195.508   10.764  193.688   13.173  199.164   18.671   96.886   3.2966   98.219   4.6090 -1.333473 5.666610 
1 1 1    6    2   11 o  282.095   2.5265  1641.76   29.391  1656.52   41.981  1627.57   41.162  283.338   3.5924  280.853   3.5535 2.485291 5.052938 
1 1 1    6    2   12 o  104.809   3.1701  230.832   13.448  187.659   19.577  269.409   18.505   95.351   4.9780  114.266   3.9266 -18.91558 6.340186 
1 1 1    6    2   13 o  202.199   2.3465  843.254   19.568  833.761   27.472  853.029   27.878  201.044   3.3131  203.354   3.3239 -2.309631 4.693043 
1 1 1    6    2   14 o  292.030   2.6465  1759.23   31.874  1769.60   45.387  1749.13   44.774  292.879   3.7573  291.180   3.7282 1.698639 5.293081 
1 1 1    6    2   15 o  439.861   3.3931  3991.23   61.536  4040.23   88.389  3945.14   85.723  442.477   4.8433  437.244   4.7534 5.232697 6.786239 
1 1 1    6    2   16 o  424.532   3.5782  3722.58   62.146  3745.45   82.919  3693.27   93.870  426.041   4.7189  423.024   5.3802 3.016418 7.156401 
1 1 1    6    2   17 o  228.345   2.9006  1074.52   27.298  1042.20   37.730  1110.01   39.544  224.748   4.0703  231.942   4.1337 -7.193787 5.801287 
1 1 1    6    2   18 o  498.449   3.7292  5127.97   76.663  5152.15  109.074  5104.37  107.773  499.608   5.2933  497.290   5.2545 2.318390 7.458494 
1 1 1    6    2   19 o  290.684   2.7323  1743.32   32.756  1759.25   46.670  1727.86   45.986  291.992   3.8752  289.376   3.8530 2.616028 5.464678 
1 1 1    6    2   20 o  331.042   3.1560  2261.36   42.600  2266.62   65.400  2257.49   56.145  331.353   4.7854  330.731   4.1160 0.6221619 6.312020 
1 1 1    6    2   21 o   79.123   4.7082  127.750   15.260  115.070   20.208  144.578   23.280   74.614   6.5664   83.631   6.7491 -9.016121 9.416363 
1 1 1    6    2   22 o   92.337   3.7877  176.067   14.421  179.126   20.690  173.176   20.112   93.116   5.3871   91.559   5.3259 1.557793 7.575360 
1 1 1    6    2   23 o  165.914   2.8836  568.042   19.720  596.757   28.204  540.578   27.583  170.016   4.0222  161.811   4.1331 8.205536 5.767160 
1 1 1    6    2   24 o  120.664   3.3077  300.272   16.437  278.321   22.778  324.122   23.743  116.067   4.7583  125.261   4.5958 -9.194298 6.615301 
1 1 1    6    2   25 o   87.673   4.2214  158.986   15.250  161.102   22.115  157.069   21.057   88.223   6.0778   87.123   5.8600 1.099915 8.442709 
1 1 1    6    2   26 o  139.535   3.5090  403.234   20.147  413.593   27.780  391.740   29.262  141.443   4.7619  137.626   5.1552 3.816696 7.017951 
1 1 1    6    2   27 o  229.143   3.1845  1085.47   30.084  1077.58   43.064  1092.99   42.046  228.321   4.5731  229.965   4.4330 -1.643417 6.368989 
1 1 1    6    2   28 o  100.205   3.9465  209.564   16.095  249.588   22.833  170.030   22.692  109.829   5.0406   90.582   6.0740 19.24726 7.893084 
1 1 1    6    2   29 o  158.929   4.2337  523.754   26.979  524.590   34.364  522.411   43.558  159.188   5.2340  158.670   6.6559 0.5181580 8.467332 
1 1 1    6    2   30 o   97.595   5.2089  201.702   20.526  222.208   27.339  175.207   31.076  103.483   6.4054   91.706   8.2158 11.77610 10.41775 
1 1 1    6    2   31 o  118.146   4.3749  280.189   20.414  322.027   35.216  259.016   25.053  124.488   6.8588  111.804   5.4329 12.68391 8.749833 
1 1 1    6    2   32 o  116.523   4.1485  280.206   19.735  291.542   30.391  271.939   25.952  118.509   6.2177  114.538   5.4936 3.970886 8.296932 
1 1 1    6    2   33 o   28.017   8.2928   0.9712   16.455  -9.1618   22.577   12.453   24.034   24.407   10.920   31.627   12.484 -7.220798 16.58569 
1 1 1    6    2   34 o   95.219   5.1670  189.662   20.235  202.882   28.348  175.930   28.893   98.661   6.9665   91.777   7.6328 6.883934 10.33403 
1 1 1    6    2   35 o   53.335   8.0497   63.795   17.882   93.354   25.157   33.605   25.424   66.549   9.1655   40.120   13.236 26.42932 16.09949 
1 1 1    6    2   36 o   95.451   4.8696  190.570   19.169  193.761   27.146  187.398   27.072   96.257   6.8377   94.645   6.9351 1.612663 9.739120 
1 1 1    6    2   37 f   30.534   9.2077   0.6929   21.221 -18.6449   32.630   14.867   27.936   27.602   12.655   33.466   13.379 -5.863926 18.41543 
1 1 1    6    2   38 o   80.541   6.0587  137.243   20.016  152.942   30.298  125.086   26.662   84.546   8.6887   76.536   8.4463 8.009842 12.11742 
1 1 1    6    2   39 o   64.607   6.6007   90.245   17.560   84.451   24.069   96.837   25.676   62.391   9.3535   66.823   9.3162 -4.431927 13.20150 
1 1 1    6    2   40 o   34.609   8.2541   19.918   16.341  -5.7967   22.851   46.833   23.378   24.619   11.002   44.599   12.307 -19.98031 16.50821 
1 1 1    6    2   41 o   30.970   8.7026   15.491   16.651   13.057   23.918   17.781   23.195   30.277   12.282   31.663   12.333 -1.386347 17.40520 
1 1 1    6    2   42 o   59.948   7.8993   83.620   18.963   89.757   25.837   76.456   27.918   63.393   9.8820   56.503   12.326 6.889572 15.79856 
1 1 1    6    2   43 o   50.732   10.363   65.876   21.883   70.298   39.221   63.877   26.369   50.702   16.424   50.762   12.643 -0.5953217E-01 20.72669 
1 1 1    6    2   44 o   49.627   8.8842   63.839   21.401   21.911   32.014   97.716   28.777   34.507   14.128   64.748   10.776 -30.24094 17.76843 
1 1 1    6    2   45 o   39.093   9.8793   38.522   21.390   53.038   28.389   19.457   32.535   44.674   13.914   33.512   14.029 11.16189 19.75866 
1 1 1    6    2   46 o   31.723   8.4934   15.351   17.323  -9.3200   23.626   44.039   25.476   23.033   10.635   40.414   13.245 -17.38036 16.98676 
1 1 1    6    2   47 o   23.645   7.5836  -8.8688   16.576   11.454   24.492 -26.0431   22.516   28.010   11.967   19.280   9.3188 8.730099 15.16722 
1 1 1    6    2   48 o   29.777   8.6444   18.843   17.083   22.761   23.972   14.800   24.351   30.997   12.393   28.556   12.055 2.440922 17.28886 
1 1 1    6    2   49 o   38.559   9.9123   47.295   20.394   47.957   28.507   46.601   29.188   38.877   13.964   38.241   14.072 0.6356201 19.82468 
1 1 1    6    2   50 o   26.931   9.1135  -8.5968   27.951   6.0211   43.944 -18.5289   36.222   29.262   13.829   24.601   11.873 4.661491 18.22705 
1 1 1    6    3    0 o  791.631   7.6901 12956.78  354.935 12956.78  354.935 12956.78  354.935  791.631   10.875  791.631   10.875 0.000000 0.000000 
1 1 1    6    3    1 o  557.231   5.0990  6434.63  115.978  6271.41  175.974  6559.97  154.208  550.887   7.7450  563.574   6.6342 -12.68713 10.19794 
1 1 1    6    3    2 o  336.093   3.2746  2346.02   43.405  2280.38   72.447  2382.78   54.213  332.362   5.2850  339.824   3.8679 -7.462311 6.549201 
1 1 1    6    3    3 o  372.334   3.1174  2864.80   47.512  2831.12   71.513  2891.41   63.571  370.353   4.6817  374.314   4.1177 -3.960693 6.234897 
1 1 1    6    3    4 o  276.761   2.5747  1583.56   29.188  1554.12   43.705  1607.26   39.215  274.424   3.8614  279.098   3.4067 -4.674347 5.149350 
1 1 1    6    3    5 f  168.102   1.9322  582.963   13.397  586.245   19.006  579.722   18.885  168.572   2.7337  167.631   2.7315 0.9404755 3.864478 
1 1 1    6    3    6 o  106.994   2.5443  220.020   10.808  328.003   18.036  159.520   13.500  126.073   3.4687   87.916   3.7232 38.15684 5.088560 
1 1 1    6    3    7 o  223.549   2.2420  1031.67   20.044  1029.20   32.592  1033.18   25.419  223.317   3.5385  223.781   2.7541 -0.4635468 4.483991 
1 1 1    6    3    8 o  319.814   3.7324  2103.00   49.017  2016.04   65.779  2211.58   73.504  312.431   5.1046  327.198   5.4467 -14.76755 7.464880 
1 1 1    6    3    9 o  185.596   2.2924  709.772   17.289  705.066   22.558  716.473   26.916  184.860   2.9586  186.331   3.5024 -1.471451 4.584751 
1 1 1    6    3   10 o  415.589   4.1377  3558.73   69.084  3527.91   88.047  3608.09  111.433  413.333   5.1647  417.845   6.4659 -4.512177 8.275448 
1 1 1    6    3   11 o  269.122   2.4791  1494.21   27.515  1505.21   39.234  1483.57   38.598  270.095   3.5219  268.148   3.4900 1.947052 4.958193 
1 1 1    6    3   12 o  397.462   3.1167  3259.31   51.084  3231.94   71.470  3287.90   73.043  395.758   4.3785  399.166   4.4367 -3.408234 6.233439 
1 1 1    6    3   13 o  214.798   2.3680  951.537   20.976  964.372   29.957  939.190   29.382  216.219   3.3592  213.377   3.3386 2.841309 4.736083 
1 1 1    6    3   14 o  192.925   2.3851  767.739   18.978  759.684   26.687  775.978   26.992  191.902   3.3718  193.949   3.3743 -2.047043 4.770207 
1 1 1    6    3   15 o  316.728   3.2150  2069.73   41.996  2091.41   59.744  2048.55   59.046  318.367   4.5499  315.089   4.5435 3.278625 6.430003 
1 1 1    6    3   16 o  396.482   3.1642  3243.19   51.735  3221.03   72.404  3266.31   73.950  395.100   4.4432  397.864   4.5065 -2.763977 6.328494 
1 1 1    6    3   17 o  570.718   4.7819  6726.61  112.559  6743.36  159.823  6710.12  158.550  571.420   6.7814  570.015   6.7440 1.405457 9.563895 
1 1 1    6    3   18 o  343.904   2.9286  2440.18   41.535  2427.47   58.270  2453.31   59.220  342.994   4.1190  344.813   4.1641 -1.818756 5.857102 
1 1 1    6    3   19 o  269.743   3.0685  1500.32   34.107  1530.09   49.496  1473.41   47.064  272.285   4.4073  267.201   4.2706 5.084839 6.136999 
1 1 1    6    3   20 o  299.850   2.7809  1855.42   34.391  1865.77   48.889  1845.28   48.388  300.677   3.9422  299.023   3.9234 1.653839 5.561871 
1 1 1    6    3   21 o  199.507   3.0195  820.104   24.807  795.753   33.969  847.934   36.314  196.343   4.1947  202.671   4.3443 -6.328308 6.038910 
1 1 1    6    3   22 o  483.924   3.6877  4837.51   73.603  4843.33  104.273  4831.73  103.909  484.213   5.2212  483.635   5.2092 0.5782166 7.375372 
1 1 1    6    3   23 o  148.171   3.1430  452.861   19.103  458.340   28.628  448.465   25.647  148.968   4.6594  147.375   4.2194 1.593155 6.285989 
1 1 1    6    3   24 o  147.407   2.9891  448.919   18.166  439.704   25.858  457.900   25.527  145.910   4.2968  148.905   4.1565 -2.995560 5.978193 
1 1 1    6    3   25 o   85.047   5.7664  146.867   18.936  141.076   22.836  159.614   33.881   82.517   6.7097   87.577   9.3801 -5.059540 11.53280 
1 1 1    6    3   26 o  304.087   3.2011  1908.98   39.588  1898.07   51.770  1924.35   61.435  303.098   4.1413  305.077   4.8825 -1.979431 6.402261 
1 1 1    6    3   27 o  122.184   4.1753  305.740   20.463  323.255   33.455  295.271   25.865  124.898   6.4945  119.469   5.2492 5.428551 8.350636 
1 1 1    6    3   28 o   28.688   8.0652   7.8445   14.351   15.807   21.773   1.7285   19.082   31.986   12.077   25.390   10.692 6.595514 16.13038 
1 1 1    6    3   29 o  101.439   4.9685  214.109   20.664  185.509   28.941  243.855   29.515   94.473   7.4274  108.405   6.6013 -13.93185 9.937015 
1 1 1    6    3   30 o   54.112   7.3821   60.766   15.984   88.268   24.594   40.656   21.031   65.008   9.1727   43.217   11.569 21.79177 14.76430 
1 1 1    6    3   31 o   71.391   6.2283  104.321   17.866   97.653   22.531  115.614   29.322   68.460   7.9795   74.323   9.5653 -5.863525 12.45666 
1 1 1    6    3   32 o  152.378   3.2957  480.678   20.706  478.908   29.628  482.369   28.949  152.096   4.7230  152.660   4.5977 -0.5641327 6.591322 
1 1 1    6    3   33 f   73.674   5.8577  115.355   17.238  149.434   24.543   82.180   24.216   84.734   7.0228   62.613   9.3772 22.12109 11.71541 
1 1 1    6    3   34 o  101.995   4.8533  216.917   20.398  219.928   28.374  213.696   29.345  102.754   6.6950  101.236   7.0281 1.517616 9.706584 
1 1 1    6    3   35 o   73.209   6.0374  115.008   17.750  141.602   24.777   86.967   25.442   82.274   7.3016   64.144   9.6169 18.13058 12.07470 
1 1 1    6    3   36 o  116.473   4.5180  281.453   21.556  298.237   32.796  268.687   28.603  119.449   6.6569  113.497   6.1103 5.952049 9.036015 
1 1 1    6    3   37 o  102.161   5.6932  220.994   23.836  221.816   35.793  220.340   31.950  102.180   8.4932  102.143   7.5840 0.3671265E-01 11.38649 
1 1 1    6    3   38 o   53.495   8.3064   65.326   17.824   62.564   25.496   67.967   24.929   52.242   12.075   54.748   11.410 -2.505360 16.61287 
1 1 1    6    3   39 o   26.011   8.4030 -15.4971   19.048 -22.9164   23.554  -1.4757   32.381   21.569   10.172   30.452   13.378 -8.882732 16.80593 
1 1 1    6    3   40 o   59.856   7.1798   80.426   17.221   91.465   24.600   69.817   24.115   64.651   9.2255   55.060   11.004 9.591595 14.35952 
1 1 1    6    3   41 o   43.278   8.8605   44.958   16.851   38.427   23.829   51.490   23.833   40.248   12.778   46.307   12.279 -6.059143 17.72104 
1 1 1    6    3   42 o   23.486   7.5410 -12.5862   16.391   2.2450   23.346 -27.0055   23.019   26.702   11.549   20.270   9.7001 6.432093 15.08193 
1 1 1    6    3   43 o   18.553   6.4745 -48.9588   17.740 -36.8532   25.745 -59.9039   24.480   20.183   9.8046   16.923   8.4586 3.260281 12.94909 
1 1 1    6    3   44 o   97.229   5.9127  213.023   23.351  184.350   34.273  237.867   31.902   90.285   9.2038  104.172   7.4250 -13.88666 11.82542 
1 1 1    6    3   45 o   38.527   9.0516   36.550   17.641   51.933   25.117   21.572   24.784   44.749   12.900   32.306   12.701 12.44320 18.10329 
1 1 1    6    3   46 o   30.790   8.6908   17.169   17.408   3.0565   24.390   31.824   24.854   26.158   11.546   35.421   12.993 -9.262440 17.38165 
1 1 1    6    3   47 o   46.802   9.3044   59.203   18.267   72.781   29.936   51.148   23.056   50.234   13.951   43.369   12.315 6.865215 18.60880 
1 1 1    6    3   48 o   23.267   7.5836  -6.0014   16.917  -2.8681   23.522  -9.3588   24.349   23.755   10.835   22.779   10.613 0.9760551 15.16718 
1 1 1    6    3   49 o   34.691   8.9064   35.542   19.887   53.897   23.864  -6.1680   35.974   42.800   12.643   26.583   12.548 16.21637 17.81279 
1 1 1    6    3   50 o   29.145   9.5953   7.3246   27.585   29.555   42.766  -8.5142   36.098   32.511   14.744   25.779   12.284 6.732407 19.19064 
1 1 1    6    3   51 o   54.416   16.779  121.480   41.401   0.0000   0.0000  121.480   41.401  ?   ?    54.416   16.779      ?      ? 
1 1 1    6    4    0 o  584.882   5.8646  7069.13  199.983  7069.13  199.983  7069.13  199.983  584.882   8.2938  584.882   8.2938 0.000000 0.000000 
1 1 1    6    4    1 o  296.770   3.2197  1810.16   38.363  1851.24   62.116  1784.83   48.778  299.451   5.0294  294.089   4.0214 5.362244 6.439458 
1 1 1    6    4    2 o  425.532   3.9104  3740.80   64.740  3735.45  111.958  3743.49   79.353  425.204   6.3840  425.860   4.5178 -0.6562195 7.820880 
1 1 1    6    4    3 o  278.975   2.5948  1605.02   29.519  1612.80   45.329  1599.29   38.898  279.548   3.9314  278.402   3.3876 1.145752 5.189601 
1 1 1    6    4    4 o  170.125   2.0958  595.522   14.527  607.407   22.459  586.971   19.050  171.575   3.1737  168.675   2.7382 2.899170 4.191691 
1 1 1    6    4    5 o  202.031   2.0544  842.107   17.118  846.415   24.313  837.871   24.106  202.543   2.9105  201.519   2.9003 1.024536 4.108838 
1 1 1    6    4    6 o   27.548   3.4170   17.305   3.5483   11.345   5.6174   21.262   4.5769   22.997   5.8950   32.098   3.4572 -9.101820 6.833992 
1 1 1    6    4    7 o  129.950   3.6088  348.514   19.342   0.0000   0.0000  348.514   19.342  ?   ?   129.950   3.6088      ?      ? 
1 1 1    6    4    8 o  425.366   3.8810  3774.94   66.042  3900.70   84.530  3577.91  105.808  434.643   4.7153  416.088   6.1655 18.55548 7.761943 
1 1 1    6    4    9 o  151.128   2.1345  465.857   12.777  452.611   15.874  490.230   21.533  148.122   2.5984  154.135   3.3871 -6.013687 4.269005 
1 1 1    6    4   10 f  161.144   2.6599  536.100   16.347  536.492   19.679  535.227   29.363  161.260   2.9587  161.029   4.4211 0.2304688 5.319820 
1 1 1    6    4   11 o  147.602   2.7993  447.230   15.898  443.178   19.236  455.963   28.239  146.568   3.1821  148.636   4.6063 -2.068085 5.598596 
1 1 1    6    4   12 o  129.454   2.3843  345.707   12.730  347.125   18.013  344.292   17.993  129.720   3.3668  129.189   3.3769 0.5306091 4.768503 
1 1 1    6    4   13 o  384.078   3.0650  3041.36   48.519  3099.31   70.180  2988.31   67.152  387.578   4.3903  380.579   4.2781 6.998779 6.129942 
1 1 1    6    4   14 o  605.574   4.3339  7570.79  108.246  7581.74  153.400  7559.92  152.769  606.010   6.1373  605.139   6.1209 0.8707886 8.667892 
1 1 1    6    4   15 o  294.812   3.1066  1793.25   37.772  1789.88   53.075  1796.72   53.767  294.532   4.3691  295.093   4.4176 -0.5607300 6.213262 
1 1 1    6    4   16 o  215.106   2.4591  954.242   21.813  940.544   30.462  968.657   31.248  213.522   3.4590  216.689   3.4964 -3.166718 4.918284 
1 1 1    6    4   17 o  465.444   4.2791  4496.13   78.586  4554.72   98.141  4391.42  131.196  469.772   5.0652  461.115   6.8983 8.657227 8.558225 
1 1 1    6    4   18 o  274.473   2.8764  1547.32   32.045  1593.94   50.320  1515.53   41.562  277.922   4.3899  271.025   3.7181 6.896393 5.752833 
1 1 1    6    4   19 o  333.025   3.3414  2288.04   45.859  2319.04   66.367  2259.72   63.442  335.177   4.8008  330.872   4.6489 4.305267 6.682799 
1 1 1    6    4   20 o  129.602   3.0882  347.401   16.365  352.202   21.841  341.255   24.711  130.633   4.0536  128.571   4.6599 2.062820 6.176309 
1 1 1    6    4   21 o  110.194   3.6830  249.068   16.662  233.629   22.302  268.576   25.068  106.359   5.0838  114.029   5.3302 -7.669388 7.365905 
1 1 1    6    4   22 o  147.890   3.2163  450.597   19.254  446.327   24.886  456.965   30.390  147.037   4.1036  148.743   4.9537 -1.705902 6.432655 
1 1 1    6    4   23 o  256.283   3.0141  1356.22   31.429  1356.83   48.612  1355.78   41.197  256.304   4.5986  256.262   3.8978 0.4263306E-01 6.028244 
1 1 1    6    4   24 o  258.379   3.0198  1371.28   31.676  1420.93   49.766  1337.47   41.070  262.257   4.6009  254.502   3.9126 7.755112 6.039608 
1 1 1    6    4   25 o  238.430   3.4681  1169.44   33.405  1146.68   42.904  1204.49   53.234  235.557   4.4160  241.303   5.3489 -5.746353 6.936270 
1 1 1    6    4   26 o  184.839   3.0077  701.438   22.734  673.442   29.991  739.249   34.854  180.550   4.0275  189.128   4.4682 -8.577255 6.015407 
1 1 1    6    4   27 o  112.491   3.7010  261.389   17.150  253.849   23.553  269.897   25.021  110.772   5.1553  114.209   5.3117 -3.436539 7.402082 
1 1 1    6    4   28 o   47.267   7.8201   52.129   16.970   11.272   26.676   79.905   21.995   32.589   13.058   61.945   8.6089 -29.35619 15.64012 
1 1 1    6    4   29 o   59.163   6.2998   75.530   14.442   99.739   20.620   52.220   20.233   69.281   7.2161   49.046   10.328 20.23484 12.59954 
1 1 1    6    4   30 o  118.428   3.5763  290.488   17.455  286.901   25.088  293.855   24.301  117.709   5.1676  119.147   4.9452 -1.438492 7.152532 
1 1 1    6    4   31 o  202.959   3.5439  853.799   29.576  864.227   40.423  841.786   43.387  204.329   4.7966  201.589   5.2182 2.739578 7.087798 
1 1 1    6    4   32 o  168.096   3.1999  584.901   22.180  598.888   31.377  570.931   31.358  170.112   4.4721  166.080   4.5779 4.031967 6.399757 
1 1 1    6    4   33 o   72.405   5.7177  109.451   17.004  123.015   24.420   96.683   23.692   76.800   7.7094   68.010   8.4461 8.790550 11.43549 
1 1 1    6    4   34 o   49.259   8.5496   52.139   17.480   36.788   23.291   71.940   26.452   41.299   12.558   57.219   11.606 -15.91959 17.09929 
1 1 1    6    4   35 o   95.654   4.6475  191.066   18.289  208.457   26.065  174.198   25.670   99.987   6.3204   91.320   6.8155 8.666389 9.295058 
1 1 1    6    4   36 o   42.544   9.5706   39.354   19.018   33.466   28.047   44.366   25.875   40.402   13.904   44.685   13.155 -4.282875 19.14121 
1 1 1    6    4   37 o   49.156   8.4797   55.153   17.451   38.002   24.704   72.237   24.656   41.384   12.995   56.928   10.898 -15.54406 16.95938 
1 1 1    6    4   38 o   42.994   8.9627   42.307   16.987   39.975   23.825   44.718   24.227   41.897   12.692   44.091   12.658 -2.194138 17.92547 
1 1 1    6    4   39 o   50.888   9.5670   63.344   21.089   78.288   27.682   42.675   32.556   58.346   11.906   43.431   14.978 14.91497 19.13395 
1 1 1    6    4   40 o   42.806   8.4600   42.518   16.823   20.580   23.845   64.258   23.737   33.072   12.602   52.540   11.290 -19.46859 16.91992 
1 1 1    6    4   41 o   92.178   5.3864  183.113   20.078  139.282   27.414  233.831   29.489   79.901   8.3187  104.455   6.8449 -24.55419 10.77281 
1 1 1    6    4   42 f   50.224   8.3244   60.059   16.956   64.649   24.243   55.664   23.725   52.251   11.556   48.197   11.985 4.054104 16.64872 
1 1 1    6    4   43 o   26.672   8.1990   2.0338   16.960   8.0643   23.754  -4.2371   24.223   28.194   11.904   25.149   11.277 3.044426 16.39800 
1 1 1    6    4   44 o   37.150   9.1309   31.499   17.564   47.361   26.476   19.032   23.472   42.909   13.449   31.391   12.354 11.51859 18.26189 
1 1 1    6    4   45 o   20.657   6.9561 -26.4968   16.489  -7.8008   24.164 -42.7885   22.557   23.878   10.926   17.436   8.6121 6.442211 13.91215 
1 1 1    6    4   46 o   24.729   7.9866 -20.3412   18.611 -45.4853   23.885   18.522   29.694   17.698   8.7634   31.760   13.355 -14.06237 15.97313 
1 1 1    6    4   47 o   43.343   8.7292   51.454   16.546   42.968   23.153   60.311   23.655   39.367   12.605   47.319   12.079 -7.951469 17.45846 
1 1 1    6    4   48 o   29.363   8.5938   17.313   17.184   10.415   24.326   24.184   24.279   27.263   11.790   31.463   12.506 -4.200005 17.18763 
1 1 1    6    4   49 o   22.685   7.4689  -8.3298   17.289 -19.9970   24.703   2.8718   24.205   20.664   9.9309   24.706   11.159 -4.041975 14.93777 
1 1 1    6    4   50 o   34.261   10.642   35.614   29.246   65.614   44.390   12.603   38.876   39.251   16.405   29.270   13.560 9.981577 21.28345 
1 1 1    6    4   51 o   28.472   9.4447   5.7717   27.346   47.159   43.578 -21.1129   35.123   33.769   15.135   23.176   11.302 10.59249 18.88946 
1 1 1    6    5    0 o  268.887   2.7080  1492.48   42.453  1492.48   42.453  1492.48   42.453  268.887   3.8297  268.887   3.8297 0.000000 0.000000 
1 1 1    6    5    1 o  265.267   3.0138  1446.63   32.121  1478.38   51.898  1426.92   40.894  267.588   4.7024  262.946   3.7708 4.642426 6.027546 
1 1 1    6    5    2 o  152.397   2.2882  479.782   13.564  477.554   23.451  480.902   16.627  152.116   3.7379  152.678   2.6404 -0.5619049 4.576453 
1 1 1    6    5    3 o  128.485   1.9567  340.958   10.266  337.949   15.627  343.242   13.616  127.982   2.9605  128.989   2.5594 -1.006538 3.913438 
1 1 1    6    5    4 o  445.689   3.5791  4100.99   65.058  4112.71   99.790  4092.33   85.800  446.194   5.4225  445.185   4.6728 1.008484 7.158115 
1 1 1    6    5    5 o   63.566   2.3240   82.613   5.7372   85.648   10.049   81.145   6.9882   64.418   3.7821   62.715   2.7017 1.703289 4.647933 
1 1 1    6    5    6 o  158.743   2.0836  520.615   13.499  515.132   20.581  524.755   17.883  158.003   3.1582  159.484   2.7187 -1.481033 4.167208 
1 1 1    6    5    7 o  354.051   3.4497  2575.93   47.077  2623.79   83.319  2553.48   57.057  356.372   5.6686  351.730   3.9331 4.642303 6.899450 
1 1 1    6    5    8 o  125.644   2.7952  325.331   14.474  341.576   20.928  310.435   20.040  128.646   3.9442  122.641   3.9618 6.004707 5.590405 
1 1 1    6    5    9 o  240.750   2.8050  1208.61   26.771  1243.32   33.776  1149.94   43.905  245.475   3.3361  236.024   4.5102 9.450943 5.609902 
1 1 1    6    5   10 o  109.325   2.4143  248.577   10.704  258.573   14.081  234.895   16.475  111.955   3.0496  106.695   3.7438 5.259293 4.828643 
1 1 1    6    5   11 o  252.687   3.0242  1308.20   29.282  1292.67   35.280  1342.57   52.498  250.321   3.4171  255.053   4.9906 -4.731934 6.048345 
1 1 1    6    5   12 o  497.893   3.9762  5114.45   80.758  5104.19  106.559  5128.31  123.786  497.335   5.1949  498.451   6.0212 -1.115845 7.952455 
1 1 1    6    5   13 o  747.649   5.1970 11543.89  160.240 11606.84  228.523 11483.00  224.752  749.648   7.3911  745.650   7.3081 3.997375 10.39402 
1 1 1    6    5   14 o  781.389   5.8624 12600.90  186.460 12525.89  244.361 12705.44  288.487  778.727   7.6082  784.051   8.9211 -5.324036 11.72475 
1 1 1    6    5   15 o  330.199   3.0570  2250.16   41.279  2245.56   62.560  2253.70   54.935  329.889   4.5979  330.509   4.0300 -0.6198425 6.114045 
1 1 1    6    5   16 o  109.275   2.7513  246.477   12.385  261.546   17.586  231.647   17.446  112.592   3.7870  105.959   3.9921 6.633499 5.502534 
1 1 1    6    5   17 o  250.829   2.8212  1299.38   28.753  1305.56   37.610  1290.70   44.604  251.558   3.6249  250.100   4.3241 1.458206 5.642448 
1 1 1    6    5   18 o  427.861   4.3389  3781.02   74.979  3783.13   96.709  3777.86  118.716  428.071   5.4775  427.651   6.7306 0.4197083 8.677800 
1 1 1    6    5   19 o  102.610   3.6434  220.423   15.205  187.285   22.194  249.730   20.872   95.229   5.6506  109.992   4.6009 -14.76244 7.286815 
1 1 1    6    5   20 o  167.142   2.8417  575.127   19.343  585.661   29.943  567.583   25.341  168.442   4.3100  165.842   3.7047 2.599716 5.683423 
1 1 1    6    5   21 o  218.017   2.8499  974.538   25.326  940.156   33.109  1023.03   39.321  213.426   3.7612  222.607   4.2827 -9.180603 5.699869 
1 1 1    6    5   22 o  100.488   4.8483  209.982   19.132  212.555   23.757  205.234   32.272  101.417   5.6795   99.559   7.8591 1.857529 9.696519 
1 1 1    6    5   23 o  149.179   2.9159  459.620   17.937  464.168   25.180  454.935   25.557  149.930   4.0719  148.427   4.1748 1.503616 5.831754 
1 1 1    6    5   24 o  135.836   3.1235  381.215   17.495  370.393   24.688  392.130   24.794  133.896   4.4705  137.775   4.3633 -3.878906 6.246944 
1 1 1    6    5   25 o  199.113   2.8292  818.894   23.232  806.589   32.621  831.558   33.095  197.595   4.0027  200.630   3.9994 -3.035370 5.658365 
1 1 1    6    5   26 o  161.128   2.9414  536.752   19.527  565.458   27.636  508.129   27.596  165.441   4.0501  156.815   4.2667 8.626160 5.882842 
1 1 1    6    5   27 o  188.616   3.0019  732.792   23.219  712.909   31.031  758.086   35.000  185.738   4.0507  191.494   4.4315 -5.755859 6.003827 
1 1 1    6    5   28 o   79.777   6.2450  130.550   19.268  138.538   34.177  126.828   23.328   81.403   10.179   78.151   7.2374 3.252899 12.49000 
1 1 1    6    5   29 o  127.271   3.3541  335.207   17.601  333.134   25.153  337.196   24.639  126.880   4.8065  127.662   4.6795 -0.7826004 6.708221 
1 1 1    6    5   30 f  185.521   2.9787  711.650   22.789  696.305   32.036  727.371   32.425  183.495   4.2330  187.548   4.1918 -4.053787 5.957312 
1 1 1    6    5   31 o  173.753   3.6661  624.883   26.195  619.583   35.628  631.118   38.645  172.979   4.9938  174.526   5.3687 -1.547287 7.332175 
1 1 1    6    5   32 o   74.005   5.3472  114.091   16.234  130.245   23.372   99.030   22.567   79.105   7.1635   68.905   7.9407 10.19997 10.69446 
1 1 1    6    5   33 o  217.733   3.4168  982.711   30.662  999.790   42.792  964.690   43.956  219.701   4.7224  215.766   4.9394 3.935455 6.833621 
1 1 1    6    5   34 o  128.750   3.7827  344.131   20.085  350.761   28.586  337.667   28.227  129.978   5.3323  127.523   5.3667 2.454651 7.565361 
1 1 1    6    5   35 o  167.727   3.5172  581.402   24.226  555.483   32.510  613.769   36.328  163.580   4.8186  171.874   5.1248 -8.293732 7.034316 
1 1 1    6    5   36 o   60.363   10.237   80.423   24.475   96.496   40.638   71.274   30.660   64.668   15.448   56.057   13.436 8.610744 20.47357 
1 1 1    6    5   37 o   48.082   8.5762   52.733   17.088   59.503   24.017   45.792   24.319   51.289   11.623   44.874   12.614 6.414413 17.15233 
1 1 1    6    5   38 o   57.852   7.5256   75.193   17.293   77.229   24.515   73.177   24.398   58.705   10.511   56.999   10.773 1.706036 15.05122 
1 1 1    6    5   39 o   32.770   9.2150   3.9395   20.319 -20.3787   26.529   38.450   31.603   23.748   11.069   41.793   14.736 -18.04539 18.42994 
1 1 1    6    5   40 o   34.831   8.8378   25.670   16.334   19.508   23.481   31.447   22.736   32.474   12.474   37.188   12.523 -4.714832 17.67553 
1 1 1    6    5   41 o   53.430   8.7049   69.070   18.881   79.269   26.221   58.086   27.211   58.172   11.336   48.687   13.213 9.485569 17.40971 
1 1 1    6    5   42 o   92.235   4.9070  182.978   18.460  149.858   25.584  218.946   26.662   83.233   7.4527  101.236   6.3853 -18.00296 9.814042 
1 1 1    6    5   43 o   28.797   8.7131   7.0135   18.382   8.7664   24.796   4.8750   27.389   28.817   12.165   28.778   12.477 0.3921509E-01 17.42612 
1 1 1    6    5   44 o   58.529   8.1143   80.292   19.115  123.701   29.443   48.666   25.132   73.458   9.7181   43.601   12.997 29.85659 16.22852 
1 1 1    6    5   45 o   55.940   7.8041   76.836   17.363   77.160   24.302   76.497   24.814   56.190   10.880   55.691   11.192 0.4989471 15.60819 
1 1 1    6    5   46 o   52.839   9.3283   74.512   20.441   59.266   27.591   93.059   30.432   46.285   13.573   59.392   12.801 -13.10679 18.65661 
1 1 1    6    5   47 o   27.152   8.1835   5.0189   17.598 -17.8158   25.179   26.822   24.604   21.725   10.326   32.579   12.699 -10.85374 16.36700 
1 1 1    6    5   48 o   22.462   7.4056  -9.8328   16.875 -15.2326   23.889  -4.4542   23.842   21.446   10.154   23.477   10.783 -2.031128 14.81129 
1 1 1    6    5   49 o   25.978   8.5147  -0.1749   21.634   2.2458   31.995  -2.2138   29.364   26.727   12.353   25.230   11.722 1.497046 17.02936 
1 1 1    6    5   50 o   36.408   10.461   23.351   27.958  109.088   45.369 -29.1440   35.500   49.839   17.647   22.977   11.239 26.86113 20.92173 
1 1 1    6    5   51 o   24.316   8.4061 -19.8912   26.860  -1.8059   42.531 -31.8896   34.642   26.740   12.896   21.891   10.786 4.848902 16.81218 
1 1 1    6    6    0 o  343.664   3.1603  2438.25   63.324  2438.25   63.324  2438.25   63.324  343.664   4.4693  343.664   4.4693 0.000000 0.000000 
1 1 1    6    6    1 o  400.099   3.5186  3305.81   58.060  3321.93   82.644  3290.09   81.585  401.060   4.9961  399.138   4.9559 1.922089 7.037194 
1 1 1    6    6    2 o  176.916   2.4057  639.826   16.385  662.747   29.184  629.276   19.800  179.187   3.9489  174.645   2.7488 4.542084 4.811381 
1 1 1    6    6    3 o  184.613   2.1459  703.774   16.178  699.258   24.629  707.202   21.457  184.084   3.2439  185.141   2.8100 -1.057007 4.291709 
1 1 1    6    6    4 o  197.546   2.1982  807.768   17.787  781.915   26.527  828.888   23.976  194.658   3.3041  200.435   2.9003 -5.776413 4.396411 
1 1 1    6    6    5 o  128.323   2.2680  342.823   11.330  330.481   19.395  349.216   13.959  126.541   3.7161  130.105   2.6013 -3.563866 4.536073 
1 1 1    6    6    6 o  289.358   3.0125  1729.38   33.937  1725.41   58.597  1731.39   41.630  289.060   4.9150  289.656   3.4847 -0.5968628 6.024948 
1 1 1    6    6    7 o  149.813   2.3419  460.515   13.627  470.784   23.785  455.497   16.627  151.035   3.8182  148.590   2.7130 2.444107 4.683865 
1 1 1    6    6    8 o  157.294   2.6547  515.021   17.014  544.810   22.780  477.442   25.586  162.492   3.3991  152.096   4.0786 10.39665 5.309325 
1 1 1    6    6    9 o  302.424   2.6849  1886.20   32.345  1883.22   40.748  1891.28   53.178  302.125   3.2701  302.724   4.2591 -0.5993958 5.369709 
1 1 1    6    6   10 o  199.552   2.4039  823.973   19.580  839.434   26.022  803.798   29.726  201.722   3.1276  197.382   3.6515 4.340027 4.807852 
1 1 1    6    6   11 o  356.496   3.6004  2598.24   48.787  2560.80   58.357  2685.17   88.913  352.314   4.0160  360.677   5.9770 -8.363373 7.200898 
1 1 1    6    6   12 o  317.071   2.8133  2075.75   35.619  2080.75   45.078  2067.44   58.117  317.596   3.4413  316.546   4.4515 1.050110 5.626553 
1 1 1    6    6   13 o  313.614   3.3802  2031.63   41.193  2035.66   50.442  2023.58   71.371  314.115   3.8935  313.113   5.5266 1.002411 6.760337 
1 1 1    6    6   14 o  243.516   2.8917  1223.48   29.039  1226.06   40.764  1220.83   41.378  243.777   4.0543  243.254   4.1242 0.5226746 5.783319 
1 1 1    6    6   15 o  199.006   2.6326  815.925   21.286  823.526   33.159  810.598   27.760  199.786   4.0241  198.225   3.3954 1.560440 5.265199 
1 1 1    6    6   16 o  352.878   3.1775  2570.25   45.782  2564.74   69.830  2574.40   60.630  352.530   4.8026  353.225   4.1617 -0.6954041 6.354947 
1 1 1    6    6   17 o   45.006   5.7612   42.174   10.234   26.634   13.679   61.930   15.423   35.255   9.2805   54.757   6.8293 -19.50220 11.52249 
1 1 1    6    6   18 o  242.891   3.6224  1206.12   35.923  1298.08   55.626  1140.34   47.048  250.742   5.3788  235.040   4.8533 15.70226 7.244759 
1 1 1    6    6   19 o  158.616   2.6238  518.919   17.161  506.039   23.962  532.481   24.587  156.596   3.7101  160.635   3.7111 -4.039169 5.247569 
1 1 1    6    6   20 o   42.068   6.7942   38.260   11.555   33.550   16.482   42.811   16.204   39.477   10.086   44.659   9.1057 -5.182198 13.58832 
1 1 1    6    6   21 o  172.520   2.7305  614.284   19.427  618.731   27.700  609.980   27.253  173.133   3.8792  171.906   3.8438 1.227295 5.461010 
1 1 1    6    6   22 o   30.741   8.1589   7.4523   15.215  -9.0501   20.099   29.604   23.286   22.972   10.289   38.511   12.665 -15.53886 16.31771 
1 1 1    6    6   23 o  269.085   2.7662  1494.75   30.697  1518.94   43.767  1471.33   43.066  271.227   3.9124  266.943   3.9116 4.284119 5.532384 
1 1 1    6    6   24 o   72.504   5.1811  108.901   15.318   88.140   21.101  132.032   22.273   65.175   7.8497   79.832   6.7644 -14.65707 10.36220 
1 1 1    6    6   25 o  337.156   3.2421  2346.69   44.598  2329.93   58.804  2369.38   68.425  335.796   4.2459  338.516   4.9008 -2.720428 6.484271 
1 1 1    6    6   26 o   80.697   4.4299  134.934   14.733  128.751   20.808  141.151   20.863   78.834   6.3995   82.559   6.1271 -3.724922 8.859758 
1 1 1    6    6   27 o   88.351   4.1468  162.322   15.049  147.887   21.526  176.123   21.047   84.472   6.1784   92.230   5.5329 -7.757568 8.293696 
1 1 1    6    6   28 o  282.362   4.0731  1652.31   47.409  1591.66   67.094  1712.78   67.000  277.161   5.8693  287.563   5.6490 -10.40213 8.146173 
1 1 1    6    6   29 o   78.812   4.7173  128.896   15.331  132.354   21.934  125.594   21.436   79.846   6.6603   77.778   6.6822 2.067322 9.434612 
1 1 1    6    6   30 o  141.516   3.2741  413.752   19.082  383.409   26.463  446.621   27.542  136.111   4.7138  146.921   4.5451 -10.81047 6.548156 
1 1 1    6    6   31 o  131.734   3.7458  360.760   20.139  350.745   30.546  368.462   26.786  130.063   5.6942  133.404   4.8682 -3.341080 7.491514 
1 1 1    6    6   32 f   87.982   4.7486  160.695   17.185  144.895   23.817  177.858   24.822   83.455   6.9192   92.509   6.5056 -9.053703 9.497291 
1 1 1    6    6   33 o   90.294   5.2172  171.960   19.170  199.860   26.766  142.575   27.468   97.998   6.6221   82.590   8.0637 15.40788 10.43434 
1 1 1    6    6   34 f  131.400   3.7358  358.447   20.242  348.941   28.401  368.261   28.859  129.624   5.3123  133.175   5.2540 -3.550293 7.471582 
1 1 1    6    6   35 o  124.305   3.8628  321.309   19.796  308.246   27.725  334.895   28.274  121.716   5.5228  126.893   5.4023 -5.176643 7.725698 
1 1 1    6    6   36 o   85.699   6.3610  154.617   22.380  171.653   33.651  141.104   29.969   89.872   9.0783   81.527   8.9126 8.345039 12.72202 
1 1 1    6    6   37 o   49.957   8.6977   58.020   17.911   47.236   26.901   66.607   24.006   45.456   13.422   54.458   11.065 -9.002434 17.39531 
1 1 1    6    6   38 o   33.981   7.7209   9.9655   16.702 -31.8269   23.432   53.133   23.814   20.048   9.6443   47.913   12.060 -27.86436 15.44181 
1 1 1    6    6   39 o   59.879   7.6394   78.721   18.337   94.417   28.159   67.164   24.163   65.540   10.417   54.217   11.177 11.32265 15.27874 
1 1 1    6    6   40 o   30.064   8.6224   12.506   16.687   15.633   24.058   9.6079   23.164   31.232   12.438   28.896   11.945 2.335211 17.24488 
1 1 1    6    6   41 o   29.858   8.5458   10.843   16.791   0.0417   23.265   22.584   24.257   26.058   11.396   33.657   12.738 -7.598631 17.09170 
1 1 1    6    6   42 f   29.732   8.0960   4.6674   16.685 -24.8207   23.288   35.768   23.916   20.702   9.8654   38.761   12.840 -18.05875 16.19209 
1 1 1    6    6   43 o   52.548   9.4429   71.936   21.169   50.449   31.617   89.395   28.501   44.195   14.768   60.902   11.772 -16.70773 18.88588 
1 1 1    6    6   44 o   78.606   6.4587  140.067   20.750  163.838   29.902  117.991   28.816   85.534   8.4762   71.678   9.7474 13.85597 12.91734 
1 1 1    6    6   45 o   29.951   8.6181   16.424   16.721   17.436   23.804   15.437   23.494   30.321   12.269   29.582   12.106 0.7391510 17.23619 
1 1 1    6    6   46 o   28.404   8.4714   11.606   16.796   17.965   25.945   7.0188   22.037   30.619   12.648   26.189   11.274 4.429989 16.94280 
1 1 1    6    6   47 o   24.826   7.9283  -0.9255   17.406   7.7115   25.106  -8.9184   24.152   26.852   11.788   22.800   10.605 4.051796 15.85657 
1 1 1    6    6   48 f   21.191   7.1227 -16.7689   16.988 -20.8654   24.542 -13.0009   23.538   20.769   9.9592   21.612   10.186 -0.8431149 14.24539 
1 1 1    6    6   49 o   22.596   7.7067 -21.1331   21.410 -24.7311   32.310 -18.3164   28.588   22.825   11.064   22.366   10.731 0.4591618 15.41341 
1 1 1    6    6   50 f   29.785   9.6161   11.009   26.427   49.508   41.045 -16.2531   34.539   35.543   15.343   24.028   11.596 11.51464 19.23217 
1 1 1    6    6   51 o   28.546   9.4396   16.294   27.709   11.089   41.498   20.482   37.223   28.069   13.316   29.023   13.383 -0.9542332 18.87926 
1 1 1    6    7    0 o  206.906   2.3892  883.843   28.817  883.843   28.817  883.843   28.817  206.906   3.3789  206.906   3.3789 0.000000 0.000000 
1 1 1    6    7    1 o  395.797   3.4900  3234.96   56.968  3219.04   80.010  3251.33   81.132  394.812   4.9135  396.783   4.9576 -1.970734 6.980016 
1 1 1    6    7    2 o  416.772   3.3921  3589.15   57.791  3569.17   87.637  3604.52   76.875  415.708   5.1113  417.836   4.4608 -2.128510 6.784102 
1 1 1    6    7    3 o  258.241   2.4828  1377.13   26.199  1369.57   39.803  1382.91   34.801  257.603   3.7463  258.879   3.2593 -1.275787 4.965665 
1 1 1    6    7    4 o  105.267   2.1945  231.821   8.6901  220.813   15.799  236.597   10.406  103.438   3.7032  107.095   2.3558 -3.657303 4.389028 
1 1 1    6    7    5 o  232.341   2.6856  1118.19   24.361  1101.31   41.687  1126.95   30.021  230.975   4.3760  233.707   3.1145 -2.731689 5.371141 
1 1 1    6    7    6 o  539.725   6.0730  6066.38  109.959  5966.82  239.238  6093.04  123.812  536.310   10.816  543.140   5.5269 -6.830811 12.14594 
1 1 1    6    7    7 o  445.346   4.3457  4058.34   76.765  3959.44   95.636  4237.49  128.712  437.891   5.2953  452.802   6.8920 -14.91052 8.691358 
1 1 1    6    7    8 o  350.575   2.8212  2536.01   40.791  2523.79   57.346  2548.54   58.034  349.720   3.9758  351.430   4.0038 -1.709198 5.642451 
1 1 1    6    7    9 o  422.267   3.9761  3673.63   64.926  3659.92   79.022  3702.10  113.897  421.133   4.5495  423.400   6.5223 -2.266724 7.952204 
1 1 1    6    7   10 o  521.461   4.8467  5633.24  103.836  5892.21  142.871  5343.30  151.172  534.239   6.4840  508.682   7.2054 25.55719 9.693304 
1 1 1    6    7   11 o  112.511   2.7325  261.722   12.640  269.556   17.359  252.880   18.441  114.309   3.6819  110.713   4.0386 3.596085 5.464989 
1 1 1    6    7   12 o  405.441   4.1294  3388.06   67.366  3369.70   86.151  3416.95  108.072  404.073   5.1694  406.809   6.4410 -2.736115 8.258889 
1 1 1    6    7   13 o  203.169   3.0332  840.861   23.597  823.250   28.354  880.550   42.564  199.769   3.4412  206.568   4.9959 -6.798828 6.066429 
1 1 1    6    7   14 o  529.501   4.9888  5801.91  107.316  5859.74  140.523  5721.00  166.232  532.741   6.3954  526.262   7.6585 6.478577 9.977669 
1 1 1    6    7   15 o  291.107   2.6521  1748.34   31.842  1751.79   45.212  1744.95   44.852  291.391   3.7619  290.822   3.7393 0.5685730 5.304198 
1 1 1    6    7   16 o  265.975   2.5784  1459.39   28.284  1472.02   40.227  1447.05   39.774  267.113   3.6514  264.838   3.6413 2.274628 5.156737 
1 1 1    6    7   17 o  294.104   2.7035  1784.66   32.793  1774.74   46.143  1794.78   46.612  293.279   3.8147  294.929   3.8319 -1.650299 5.406977 
1 1 1    6    7   18 o  343.629   3.7433  2439.35   52.246  2444.94   68.243  2431.43   81.213  344.143   4.8079  343.115   5.7388 1.028473 7.486618 
1 1 1    6    7   19 o  273.098   2.9091  1542.76   32.528  1510.09   48.773  1568.93   43.655  270.473   4.3721  275.723   3.8388 -5.249451 5.818238 
1 1 1    6    7   20 o   32.358   6.7762   17.261   11.560  -3.1565   15.955   39.826   16.772   21.733   9.4726   42.983   9.6922 -21.24985 13.55248 
1 1 1    6    7   21 o  112.099   3.2661  259.278   15.089  274.200   21.657  245.203   21.035  115.233   4.5568  108.966   4.6803 6.267235 6.532260 
1 1 1    6    7   22 o  231.409   2.8901  1107.11   27.400  1093.33   41.057  1118.18   36.792  230.092   4.3263  232.727   3.8331 -2.635544 5.780105 
1 1 1    6    7   23 o   47.009   7.7639   49.517   14.858   57.836   18.687   35.216   24.501   52.790   8.5827   41.228   12.940 11.56219 15.52780 
1 1 1    6    7   24 o  103.583   4.0442  221.539   17.252  205.429   23.818  239.318   25.021   99.626   5.7965  107.540   5.6412 -7.914406 8.088428 
1 1 1    6    7   25 o   44.598   7.3316   43.123   13.243   46.639   18.858   39.702   18.601   46.414   10.135   42.781   10.597 3.632744 14.66323 
1 1 1    6    7   26 o  173.014   2.8536  618.483   20.363  615.367   28.705  621.641   28.890  172.576   4.0329  173.453   4.0383 -0.8770447 5.707191 
1 1 1    6    7   27 o   88.329   4.7878  161.309   17.315  166.375   26.290  157.428   23.010   89.522   7.1203   87.137   6.4026 2.384933 9.575581 
1 1 1    6    7   28 o   67.964   5.4903   95.597   15.341   90.191   20.707  102.174   22.840   65.856   7.6235   70.072   7.9029 -4.216461 10.98058 
1 1 1    6    7   29 o   83.570   4.5931  144.983   15.828  142.819   22.501  147.103   22.269   82.946   6.5772   84.195   6.4130 -1.248421 9.186163 
1 1 1    6    7   30 o   64.990   5.6891   88.565   15.139   77.498   21.627   99.196   21.198   60.936   8.6053   69.044   7.4438 -8.108444 11.37814 
1 1 1    6    7   31 o  148.035   3.3345  453.784   20.353  441.130   28.818  466.378   28.748  145.967   4.7867  150.104   4.6435 -4.136566 6.668993 
1 1 1    6    7   32 o   90.137   5.4055  163.938   19.686  143.853   24.959  197.008   32.025   83.110   7.2812   97.163   7.9915 -14.05296 10.81104 
1 1 1    6    7   33 o  104.556   4.5673  226.139   19.566  265.783   28.811  192.206   26.655  113.050   6.1790   96.062   6.7276 16.98746 9.134589 
1 1 1    6    7   34 o   28.375   8.3594   4.5535   16.290   0.7306   23.257   8.2353   22.824   27.323   11.667   29.428   11.975 -2.105597 16.71888 
1 1 1    6    7   35 f   25.468   7.9508  -5.7364   16.360  -3.2794   23.675  -7.9820   22.633   26.379   11.517   24.558   10.964 1.821644 15.90160 
1 1 1    6    7   36 o   25.091   7.8067 -11.4719   16.624   9.0840   24.034 -30.3275   23.018   29.984   12.255   20.198   9.6747 9.785908 15.61335 
1 1 1    6    7   37 o   42.212   9.1454   39.379   18.249   55.346   25.779   23.342   25.837   49.016   12.662   35.409   13.199 13.60633 18.29072 
1 1 1    6    7   38 o   39.329   7.9531   31.158   16.550  -2.2488   23.727   62.813   23.097   26.158   11.472   52.499   11.018 -26.34142 15.90615 
1 1 1    6    7   39 o   37.237   8.9884   30.484   16.566   30.085   23.264   30.894   23.596   37.037   12.666   37.438   12.757 -0.4010544 17.97674 
1 1 1    6    7   40 o   22.331   7.7756 -47.8185   20.147 -54.1236   23.561 -30.6717   38.855   17.123   8.5172   27.539   13.011 -10.41524 15.55114 
1 1 1    6    7   41 o   29.113   8.5227   9.9702   16.724   8.7135   23.735   11.209   23.568   28.755   12.005   29.472   12.101 -0.7169991 17.04539 
1 1 1    6    7   42 f   25.003   7.8716  -3.4276   16.482   1.8275   22.953  -9.0222   23.683   26.146   11.380   23.860   10.879 2.285822 15.74313 
1 1 1    6    7   43 o   71.751   7.9833  134.369   20.556   73.199   31.811  178.229   26.936   53.040   14.241   90.461   7.2194 -37.42125 15.96656 
1 1 1    6    7   44 o   37.228   8.9225   32.532   18.154   9.4188   26.831   52.044   24.653   29.337   12.529   45.120   12.707 -15.78319 17.84491 
1 1 1    6    7   45 o   48.824   8.6213   61.812   17.327   58.678   24.615   64.890   24.393   47.342   12.443   50.306   11.936 -2.964100 17.24250 
1 1 1    6    7   46 o   55.883   7.3817   77.649   16.354  103.380   23.423   53.175   22.844   66.958   8.4814   44.807   12.084 22.15176 14.76344 
1 1 1    6    7   47 o   29.373   8.6529   11.690   20.085   34.201   25.155 -27.8999   33.360   35.192   13.042   23.554   11.375 11.63833 17.30575 
1 1 1    6    7   48 o   29.641   8.6610   19.305   17.294   13.908   23.973   25.161   24.973   27.822   11.862   31.459   12.624 -3.636820 17.32205 
1 1 1    6    7   49 o   32.353   9.4745   24.745   23.045  -7.1358   33.700   52.746   31.583   25.552   12.086   39.155   14.594 -13.60306 18.94890 
1 1 1    6    7   50 o   27.997   9.3285   6.2397   27.408   23.110   42.235  -6.0329   36.023   30.489   14.128   25.505   12.186 4.984186 18.65707 
1 1 1    6    7   51 o   26.977   9.0300   5.8419   27.096  -9.3613   41.459   17.178   35.800   25.646   12.455   28.309   13.078 -2.663433 18.06000 
1 1 1    6    8    0 o  274.816   2.7502  1559.05   44.064  1559.05   44.064  1559.05   44.064  274.816   3.8893  274.816   3.8893 0.000000 0.000000 
1 1 1    6    8    1 o  154.258   2.1844  490.871   13.896  483.337   19.488  498.664   19.821  153.055   3.0871  155.462   3.0912 -2.407669 4.368752 
1 1 1    6    8    2 o  252.375   2.4539  1316.27   25.337  1298.69   38.208  1330.07   33.850  250.857   3.6929  253.892   3.2326 -3.034363 4.907861 
1 1 1    6    8    3 o  198.478   2.6509  803.583   20.987  849.213   34.810  777.526   26.305  202.836   4.1610  194.119   3.2856 8.717316 5.301767 
1 1 1    6    8    4 o  137.696   2.4252  388.578   13.454  403.369   21.651  379.275   17.171  139.808   3.7548  135.584   3.0706 4.223984 4.850433 
1 1 1    6    8    5 o  278.316   3.1364  1587.09   34.889  1645.93   57.340  1552.50   43.963  282.352   4.9238  274.280   3.8862 8.071991 6.272717 
1 1 1    6    8    6 o  211.045   3.6493  904.394   29.395  959.330   53.494  880.631   35.183  215.518   6.0180  206.573   4.1294 8.945618 7.298548 
1 1 1    6    8    7 o  279.523   4.9127  1612.71   56.637   0.0000   0.0000  1612.71   56.637  ?   ?   279.523   4.9127      ?      ? 
1 1 1    6    8    8 o  114.596   2.3288  271.899   10.780  265.903   16.968  275.956   13.959  113.529   3.6238  115.664   2.9261 -2.134224 4.657657 
1 1 1    6    8    9 o  286.373   2.7498  1692.42   32.157  1695.89   42.611  1687.84   49.012  286.721   3.6033  286.025   4.1546 0.6964417 5.499519 
1 1 1    6    8   10 o  268.316   2.6913  1486.88   29.527  1498.04   39.341  1472.47   44.683  269.478   3.5396  267.155   4.0552 2.323730 5.382689 
1 1 1    6    8   11 o  649.362   5.2958  8705.28  141.740  8830.21  204.837  8590.50  196.333  653.815   7.5961  644.909   7.3812 8.905640 10.59165 
1 1 1    6    8   12 o  327.174   3.4762  2195.33   43.648  2172.28   52.675  2245.83   77.969  324.488   3.9359  329.859   5.7310 -5.370483 6.952374 
1 1 1    6    8   13 o  130.878   2.9209  353.517   15.242  353.832   19.238  352.987   24.979  130.964   3.5616  130.792   4.6306 0.1726379 5.841860 
1 1 1    6    8   14 o  281.340   2.7647  1634.91   31.692  1645.07   41.768  1621.13   48.655  282.382   3.5863  280.298   4.2087 2.083710 5.529389 
1 1 1    6    8   15 o  292.088   2.6675  1760.06   32.134  1772.33   45.747  1748.10   45.147  293.093   3.7843  291.083   3.7605 2.010162 5.335018 
1 1 1    6    8   16 o  403.297   3.1961  3356.62   53.163  3352.46   75.049  3360.81   75.320  403.047   4.5146  403.548   4.5253 -0.5009155 6.392222 
1 1 1    6    8   17 f  333.772   3.1040  2297.69   42.211  2309.55   65.037  2289.06   55.486  334.495   4.7142  333.050   4.0393 1.444458 6.208029 
1 1 1    6    8   18 o  517.397   4.6618  5546.70   94.593  5579.46  117.086  5485.12  160.512  519.773   5.4617  515.020   7.5564 4.753357 9.323588 
1 1 1    6    8   19 o  211.463   2.7777  922.413   23.984  926.668   36.637  919.223   31.727  211.877   4.1925  211.049   3.6448 0.8279572 5.555364 
1 1 1    6    8   20 f  168.852   2.6838  588.495   18.690  584.518   26.448  592.464   26.416  168.281   3.8105  169.422   3.7804 -1.141205 5.367631 
1 1 1    6    8   21 o   99.826   3.5381  205.576   14.550  191.988   20.200  220.229   20.977   96.400   5.0804  103.253   4.9257 -6.852409 7.076257 
1 1 1    6    8   22 o   90.059   4.0904  167.944   15.034  166.050   22.916  169.376   19.920   89.594   6.2015   90.523   5.3352 -0.9293442 8.180710 
1 1 1    6    8   23 o   77.201   5.1975  119.957   16.092  109.264   20.158  138.747   26.721   72.628   6.7293   81.773   7.9229 -9.144386 10.39499 
1 1 1    6    8   24 o  144.180   3.1518  429.949   18.709  423.837   27.177  435.455   25.795  143.195   4.6016  145.165   4.3084 -1.969955 6.303688 
1 1 1    6    8   25 o  230.692   2.9277  1096.75   27.591  1079.74   36.449  1119.57   42.224  228.631   3.8653  232.753   4.3984 -4.122437 5.855488 
1 1 1    6    8   26 o   76.219   4.6323  121.140   14.453  104.809   20.531  137.185   20.351   71.067   7.0045   81.370   6.0639 -10.30273 9.264637 
1 1 1    6    8   27 o  136.681   3.7139  387.004   20.877  382.194   30.598  391.193   28.556  135.865   5.4603  137.496   5.0355 -1.631134 7.427777 
1 1 1    6    8   28 o  109.289   3.7784  244.833   16.943  221.229   22.624  274.973   25.565  103.356   5.3072  115.222   5.3796 -11.86582 7.556899 
1 1 1    6    8   29 o  121.701   4.0388  308.973   19.923  239.945   27.766  382.233   28.604  107.537   6.2602  135.866   5.1045 -28.32898 8.077511 
1 1 1    6    8   30 o   73.311   5.1951  111.719   15.700  114.915   22.653  108.766   21.780   74.315   7.3907   72.307   7.3030 2.008110 10.39024 
1 1 1    6    8   31 o  109.719   3.8934  249.642   17.597  265.844   25.062  233.887   24.714  113.245   5.3658  106.192   5.6427 7.053383 7.786710 
1 1 1    6    8   32 o   58.373   9.9295   74.352   22.953   70.575   28.755   80.986   38.107   56.571   12.642   60.176   15.315 -3.604954 19.85894 
1 1 1    6    8   33 o   23.554   7.4432 -15.4883   15.858 -36.3863   22.724   4.3481   22.139   19.249   9.3178   27.859   11.610 -8.610270 14.88635 
1 1 1    6    8   34 o   43.305   7.5088   36.634   16.664  -1.7609   23.425   75.973   23.711   26.682   11.554   59.927   9.5932 -33.24463 15.01764 
1 1 1    6    8   35 o   52.501   8.5910   65.096   21.270   11.381   32.459  105.521   28.158   34.524   14.191   70.478   9.6870 -35.95425 17.18196 
1 1 1    6    8   36 o   46.720   8.3031   49.836   17.043   25.391   24.382   73.194   23.834   35.966   12.915   57.473   10.439 -21.50758 16.60622 
1 1 1    6    8   37 o   37.052   8.6574   23.774   17.463   51.810   25.642  -0.4766   23.848   47.290   12.823   26.813   11.634 20.47714 17.31471 
1 1 1    6    8   38 o   63.494   6.6161   87.781   17.235   96.760   24.227   78.581   24.524   66.985   8.7692   60.003   9.9093 6.981438 13.23226 
1 1 1    6    8   39 f   37.729   8.9146   31.834   16.492   39.389   23.647   24.680   23.012   40.967   12.689   34.490   12.525 6.476871 17.82910 
1 1 1    6    8   40 o   63.661   9.9907   99.568   24.704   98.588   30.749  101.352   41.491   64.688   11.966   62.635   16.002 2.052711 19.98134 
1 1 1    6    8   41 o   27.490   8.3020   4.4111   16.721   0.3995   23.645   8.4234   23.648   26.345   11.506   28.634   11.971 -2.289274 16.60406 
1 1 1    6    8   42 o   39.825   8.2272   35.602   17.222   3.2586   24.742   66.005   23.988   27.268   11.841   52.381   11.425 -25.11280 16.45432 
1 1 1    6    8   43 o   49.715   7.3701   60.371   17.078   11.730   24.058  109.780   24.248   29.211   12.132   70.219   8.3723 -41.00853 14.74019 
1 1 1    6    8   44 o   23.266   7.4703 -11.8811   16.489   6.5962   22.858 -31.9281   23.809   26.964   11.541   19.568   9.4880 7.395969 14.94065 
1 1 1    6    8   45 o   28.783   8.1513   10.881   16.117  -8.7692   22.819   30.442   22.768   22.751   10.486   34.815   12.482 -12.06384 16.30260 
1 1 1    6    8   46 o   31.659   8.8302   23.310   16.990   21.571   23.630   25.172   24.445   30.973   12.330   32.346   12.644 -1.373220 17.66040 
1 1 1    6    8   47 o   28.867   8.8717   12.671   19.803   19.185   24.812   1.2399   32.869   29.978   12.374   27.756   12.716 2.222313 17.74340 
1 1 1    6    8   48 o   35.381   9.9149   37.762   22.187   24.769   32.616   48.953   30.270   31.820   13.706   38.942   14.330 -7.122166 19.82975 
1 1 1    6    8   49 o   31.392   9.5813   24.694   22.745   38.596   33.748   13.124   30.788   34.479   14.348   28.305   12.702 6.174021 19.16256 
1 1 1    6    8   50 o   26.492   8.7434   4.6555   23.650  -6.8930   32.949   16.928   33.967   24.508   11.694   28.477   13.001 -3.968639 17.48682 
1 1 1    6    9    0 o  156.174   2.7208  504.073   24.750  504.073   24.750  504.073   24.750  156.174   3.8477  156.174   3.8477 0.000000 0.000000 
1 1 1    6    9    1 f   42.300   2.9330   36.663   4.7445   37.634   8.5379   36.229   5.7068   42.696   4.8484   41.904   3.3020 0.7924461 5.865971 
1 1 1    6    9    2 o  123.045   1.9929  310.875   9.9906  321.429   15.495  303.366   13.070  124.821   3.0098  121.269   2.6132 3.551781 3.985897 
1 1 1    6    9    3 o  136.715   2.4111  373.921   13.056  426.887   22.353  346.494   16.085  143.833   3.7680  129.597   3.0093 14.23520 4.822233 
1 1 1    6    9    4 o  210.949   2.2877  918.126   19.693  917.560   30.119  918.549   26.028  210.885   3.4628  211.012   2.9907 -0.1263733 4.575449 
1 1 1    6    9    5 f  415.498   5.0959  3586.03   76.702  3526.65  149.467  3607.26   89.366  412.963   8.7754  418.033   5.1832 -5.070129 10.19184 
1 1 1    6    9    6 o   74.810   3.1018  117.716   7.8648  111.570   16.725  119.462   8.9115   73.519   5.5157   76.101   2.8392 -2.582077 6.203514 
1 1 1    6    9    7 o  542.968   5.0239  6098.07  110.726  6028.81  172.120  6146.97  144.624  540.268   7.7243  545.667   6.4261 -5.399719 10.04782 
1 1 1    6    9    8 o  191.352   2.1679  754.968   17.105  740.709   23.887  769.974   24.506  189.498   3.0563  193.205   3.0753 -3.706909 4.335721 
1 1 1    6    9    9 o  334.643   3.5470  2319.34   48.374  2368.15   64.053  2254.54   73.799  338.774   4.5842  330.511   5.4138 8.263458 7.093911 
1 1 1    6    9   10 o  315.031   2.9096  2052.77   37.643  2110.36   51.349  1985.88   55.345  319.827   3.8927  310.235   4.3254 9.592438 5.819128 
1 1 1    6    9   11 o  250.092   2.8511  1289.93   29.400  1308.93   42.196  1272.01   40.987  251.880   4.0618  248.305   4.0022 3.575256 5.702241 
1 1 1    6    9   12 o  199.109   2.8198  824.952   20.670  833.699   24.335  802.295   39.164  201.041   2.9348  197.177   4.8157 3.863419 5.639511 
1 1 1    6    9   13 o  324.464   3.3585  2175.38   42.294  2180.88   51.736  2164.29   73.433  325.122   3.8582  323.805   5.4984 1.317139 6.717018 
1 1 1    6    9   14 o  319.676   2.8558  2090.83   35.901  2051.16   44.303  2166.71   61.269  315.320   3.4066  324.032   4.5844 -8.711761 5.711545 
1 1 1    6    9   15 o  529.347   4.0198  5771.72   84.453  5736.45  105.741  5833.86  140.343  527.199   4.8630  531.496   6.4021 -4.296997 8.039660 
1 1 1    6    9   16 o   96.859   2.9392  193.577   11.739  199.972   16.709  187.344   16.495   98.439   4.1154   95.279   4.1976 3.160156 5.878438 
1 1 1    6    9   17 o  534.637   4.5370  5904.94  100.016  5954.22  143.400  5858.25  139.564  536.799   6.4770  532.475   6.3549 4.323853 9.073931 
1 1 1    6    9   18 o  368.775   3.0459  2807.00   46.325  2788.02   65.021  2826.57   66.017  367.510   4.2896  370.039   4.3255 -2.528900 6.091883 
1 1 1    6    9   19 o  231.435   2.9859  1105.55   28.482  1111.64   41.101  1099.92   39.506  232.044   4.2946  230.826   4.1497 1.218246 5.971873 
1 1 1    6    9   20 o  130.015   3.0054  348.903   16.112  353.405   23.107  344.643   22.477  130.830   4.2822  129.200   4.2180 1.629852 6.010743 
1 1 1    6    9   21 o  171.619   2.7559  608.223   19.502  623.437   27.559  592.963   27.601  173.772   3.8452  169.467   3.9489 4.305435 5.511753 
1 1 1    6    9   22 o  108.990   3.3281  245.417   14.959  250.004   21.272  240.929   21.041  109.998   4.6888  107.981   4.7244 2.016487 6.656188 
1 1 1    6    9   23 o  104.889   4.9918  225.391   21.240  213.958   27.360  242.733   33.696  101.622   6.5277  108.155   7.5538 -6.533264 9.983510 
1 1 1    6    9   24 o  306.870   2.8912  1945.54   36.593  1954.05   51.749  1937.03   51.751  307.543   4.0797  306.198   4.0978 1.345062 5.782428 
1 1 1    6    9   25 f  142.150   2.9772  417.426   17.448  400.825   24.446  434.665   24.911  139.266   4.2560  145.033   4.1645 -5.766266 5.954497 
1 1 1    6    9   26 o  151.696   2.9782  475.667   18.632  468.996   26.313  482.375   26.387  150.627   4.2355  152.764   4.1879 -2.137466 5.956346 
1 1 1    6    9   27 o  133.800   3.7165  370.815   20.400  368.972   30.423  372.320   27.499  133.470   5.5265  134.130   4.9707 -0.6597290 7.433067 
1 1 1    6    9   28 o  123.593   3.3569  316.277   17.101  306.858   24.349  325.447   24.024  121.767   4.8483  125.419   4.6442 -3.652428 6.713752 
1 1 1    6    9   29 o   59.953   6.9382   75.834   16.383  101.286   24.429   55.031   22.085   69.676   8.5008   50.231   10.968 19.44499 13.87634 
1 1 1    6    9   30 o  143.299   3.2905  424.845   19.441  409.635   27.214  440.698   27.783  140.677   4.6903  145.922   4.6163 -5.244873 6.580990 
1 1 1    6    9   31 o   81.725   4.9360  139.017   16.627  133.000   23.470  145.080   23.559   79.935   7.1190   83.516   6.8394 -3.580948 9.872023 
1 1 1    6    9   32 o   37.175   9.5546   24.437   18.922   30.165   28.205   19.750   25.515   39.559   13.924   34.791   13.088 4.767853 19.10923 
1 1 1    6    9   33 f   48.111   8.2750   51.033   16.631   68.245   23.940   34.980   23.120   55.841   10.785   40.382   12.553 15.45927 16.54997 
1 1 1    6    9   34 o  127.478   3.8129  337.829   20.041  343.501   28.794  332.500   27.910  128.507   5.4327  126.449   5.3516 2.058334 7.625867 
1 1 1    6    9   35 o   28.590   8.4836 -24.7946   19.570   29.511   30.945 -60.9876   25.263   39.441   14.493   17.739   8.8228 21.70216 16.96716 
1 1 1    6    9   36 o   57.247   7.4361   72.679   17.018   59.003   24.081   86.323   24.053   51.002   11.697   63.491   9.1852 -12.48905 14.87214 
1 1 1    6    9   37 o   31.191   8.4690   8.8532   17.129 -13.6884   23.773   33.195   24.703   23.534   10.794   38.848   13.053 -15.31402 16.93795 
1 1 1    6    9   38 o   63.002   6.7236   87.228   16.936  101.339   24.379   74.066   23.545   68.596   8.6171   57.408   10.323 11.18773 13.44713 
1 1 1    6    9   39 o   27.975   8.1425   6.3825   15.815   18.966   22.233  -6.5039   22.499   31.863   12.162   24.086   10.829 7.776766 16.28501 
1 1 1    6    9   40 f   47.311   8.9703   55.906   18.745   35.070   28.170   72.463   25.111   39.078   13.898   55.543   11.345 -16.46521 17.94053 
1 1 1    6    9   41 o   52.527   8.0168   64.913   16.909   79.267   24.700   52.252   23.197   58.465   10.635   46.590   11.999 11.87544 16.03369 
1 1 1    6    9   42 o   59.591   8.9237   87.645   21.175   84.068   31.414   90.623   28.666   57.803   13.432   61.379   11.752 -3.575783 17.84736 
1 1 1    6    9   43 o   23.585   7.5534  -6.9757   15.958   0.2357   22.633 -14.1062   22.505   25.254   11.136   21.915   10.208 3.339975 15.10685 
1 1 1    6    9   44 o   33.016   8.8483   24.803   16.575   23.593   23.557   25.990   23.326   32.578   12.499   33.453   12.527 -0.8745499 17.69651 
1 1 1    6    9   45 o   24.950   7.8225  -2.9488   16.278   14.082   24.776 -15.8844   21.593   29.242   12.242   20.659   9.7420 8.583437 15.64507 
1 1 1    6    9   46 o   38.538   9.2823   42.114   17.764   37.701   25.439   46.314   24.817   36.700   13.191   40.376   13.063 -3.676537 18.56457 
1 1 1    6    9   47 o   34.269   9.8822   31.465   21.967   30.971   29.522   32.077   32.882   34.026   13.700   34.512   14.246 -0.4855614 19.76430 
1 1 1    6    9   48 o   57.274   10.180  102.114   23.939  109.934   35.645   95.688   32.311   58.875   14.719   55.673   14.066 3.202801 20.35924 
1 1 1    6    9   49 o   38.357   9.3813   44.947   22.983  -3.4590   34.422   83.887   30.873   25.985   12.268   50.729   14.196 -24.74350 18.76259 
1 1 1    6    9   50 o   23.985   8.0684  -9.6893   21.508   12.912   32.944 -26.4797   28.394   27.437   12.629   20.534   10.045 6.903000 16.13686 
1 1 1    6   10    0 o  479.777   4.9769  4754.05  139.208  4754.05  139.208  4754.05  139.208  479.777   7.0383  479.777   7.0383 0.000000 0.000000 
1 1 1    6   10    1 o  698.870   5.2096 10107.21  149.844  9792.24  217.059 10393.97  207.113  688.402   7.6449  709.338   7.0793 -20.93585 10.41922 
1 1 1    6   10    2 o  189.163   2.3367  736.148   18.204  698.457   24.958  778.998   26.611  184.004   3.2887  194.322   3.3203 -10.31889 4.673307 
1 1 1    6   10    3 o  234.348   2.5574  1132.95   24.718  1129.28   34.779  1136.70   35.136  233.964   3.6041  234.731   3.6292 -0.7667694 5.114785 
1 1 1    6   10    4 o   97.945   2.0338  202.368   7.9788  176.004   12.392  221.036   10.428   92.370   3.2528  103.521   2.4423 -11.15106 4.067582 
1 1 1    6   10    5 o  218.006   2.7736  965.144   24.013  1036.25   40.392  926.274   29.864  224.109   4.3699  211.903   3.4170 12.20612 5.547248 
1 1 1    6   10    6 o  280.481   2.9902  1631.47   32.892  1595.70   55.663  1650.67   40.773  278.086   4.8531  282.876   3.4947 -4.789551 5.980423 
1 1 1    6   10    7 o  893.549   7.7713 16569.56  285.249 15845.41  416.995 17206.44  391.060  874.991   11.555  912.107   10.395 -37.11627 15.54259 
1 1 1    6   10    8 o   98.275   2.2461  198.850   9.0725  176.710   12.549  223.096   13.132   92.554   3.2873  103.997   3.0616 -11.44273 4.492174 
1 1 1    6   10    9 o  211.710   2.3785  931.062   20.131  951.896   25.657  897.696   32.469  214.821   2.8958  208.598   3.7740 6.222504 4.756933 
1 1 1    6   10   10 o  404.235   3.2481  3375.32   52.490  3386.48   66.560  3356.96   85.365  405.148   3.9832  403.322   5.1317 1.826263 6.496205 
1 1 1    6   10   11 o  387.350   3.2936  3103.12   52.334  3168.78   70.860  3024.32   77.626  391.882   4.3841  382.818   4.9164 9.064117 6.587227 
1 1 1    6   10   12 o  359.212   3.3798  2660.40   50.029  2718.66   72.580  2607.67   69.056  362.952   4.8484  355.473   4.7101 7.479126 6.759596 
1 1 1    6   10   13 o   73.281   6.6622  132.554   11.147  137.982   11.837   90.031   33.131   81.782   3.5093   64.780   12.854 17.00179 13.32436 
1 1 1    6   10   14 o  454.613   3.5442  4278.21   64.789  4322.62   83.091  4209.33  103.477  457.677   4.4018  451.549   5.5561 6.128021 7.088469 
1 1 1    6   10   15 o  334.403   2.9208  2310.06   39.006  2317.22   49.382  2298.17   63.605  335.122   3.5727  333.684   4.6216 1.438385 5.841521 
1 1 1    6   10   16 o  246.491   2.7450  1249.91   27.584  1228.71   36.209  1279.24   42.582  244.020   3.5977  248.962   4.1470 -4.942535 5.490050 
1 1 1    6   10   17 f  356.842   3.4421  2628.62   50.653  2597.34   70.938  2661.17   72.352  354.677   4.8493  359.006   4.8864 -4.328613 6.884219 
1 1 1    6   10   18 o  222.170   2.5579  1018.54   23.437  1005.30   32.900  1032.19   33.395  220.704   3.6143  223.636   3.6205 -2.932007 5.115753 
1 1 1    6   10   19 o   73.680   4.3675  112.448   13.242  116.551   18.343  107.981   19.137   75.094   5.9225   72.266   6.4206 2.827820 8.734998 
1 1 1    6   10   20 o  346.711   3.2445  2486.01   45.981  2458.45   69.647  2507.31   61.218  344.968   4.8951  348.454   4.2596 -3.486023 6.488907 
1 1 1    6   10   21 o   93.982   3.6561  182.593   14.167  180.805   20.235  184.313   19.842   93.528   5.2456   94.437   5.0943 -0.9090347 7.312156 
1 1 1    6   10   22 o  148.053   2.8633  452.795   17.482  462.780   24.801  442.933   24.646  149.678   4.0174  146.429   4.0809 3.248596 5.726552 
1 1 1    6   10   23 o  154.391   3.4872  489.509   21.919  513.212   34.177  472.949   28.568  157.516   5.2607  151.266   4.5789 6.249695 6.974337 
1 1 1    6   10   24 o   83.811   4.8395  151.893   15.733  167.796   19.841  124.962   25.821   90.060   5.3416   77.562   8.0715 12.49803 9.678919 
1 1 1    6   10   25 o  109.291   3.4147  247.079   15.392  245.428   21.816  248.715   21.718  108.926   4.8561  109.657   4.8021 -0.7307968 6.829427 
1 1 1    6   10   26 o  103.890   4.1706  222.164   17.758  236.110   26.956  211.470   23.605  106.733   6.1234  101.047   5.6639 5.686119 8.341164 
1 1 1    6   10   27 o  113.119   3.4816  264.631   16.237  274.160   23.332  255.683   22.610  115.093   4.9152  111.145   4.9323 3.947365 6.963232 
1 1 1    6   10   28 o  202.999   3.2604  853.053   27.284  827.187   38.752  878.481   38.422  199.933   4.6994  206.065   4.5207 -6.132126 6.520816 
1 1 1    6   10   29 o  136.853   3.5385  385.968   19.925  359.167   27.088  417.562   29.411  131.703   4.9868  142.003   5.0216 -10.29941 7.077075 
1 1 1    6   10   30 o  145.754   3.2974  439.674   19.819  427.651   27.781  452.134   28.282  143.723   4.6865  147.785   4.6399 -4.062561 6.594883 
1 1 1    6   10   31 o  196.944   3.2417  799.114   26.110  774.011   34.512  832.715   39.928  193.388   4.3269  200.500   4.8284 -7.111893 6.483426 
1 1 1    6   10   32 o   88.117   5.5660  156.788   19.525  183.708   33.127  142.458   24.169   93.596   8.5814   82.639   7.0910 10.95699 11.13203 
1 1 1    6   10   33 o  109.987   4.8353  249.921   21.195  242.359   26.555  263.194   35.180  107.885   5.9678  112.090   7.6097 -4.204582 9.670690 
1 1 1    6   10   34 o   39.820   9.0552   33.682   16.991   39.108   24.092   28.313   23.967   42.220   12.757   37.419   12.854 4.800205 18.11037 
1 1 1    6   10   35 o   30.946   8.6514   11.856   16.616   20.924   24.099   3.6381   22.941   34.168   12.746   27.724   11.702 6.444353 17.30280 
1 1 1    6   10   36 o   24.092   7.6381  -8.2047   15.775  -3.1490   22.548 -13.0521   22.078   25.435   11.169   22.750   10.422 2.685104 15.27622 
1 1 1    6   10   37 o   33.900   8.0377   15.916   16.258   46.994   23.132 -14.4171   22.854   45.002   12.170   22.797   10.503 22.20506 16.07537 
1 1 1    6   10   38 o   41.906   9.0175   41.167   17.226   32.907   25.656   47.947   23.244   38.567   13.297   45.245   12.184 -6.678566 18.03493 
1 1 1    6   10   39 o   38.238   9.1240   32.914   17.569   21.630   24.774   44.332   24.921   33.549   12.831   42.927   12.976 -9.378403 18.24806 
1 1 1    6   10   40 f   65.444   7.2543   94.397   18.835  121.844   29.387   75.259   24.538   73.987   9.6301   56.902   10.852 17.08470 14.50859 
1 1 1    6   10   41 o   25.281   7.9581  -3.4086   16.740  -7.7168   22.975   1.4675   24.442   23.795   10.797   26.767   11.694 -2.972271 15.91629 
1 1 1    6   10   42 o   25.147   8.1539 -15.6090   19.210   4.7515   29.598 -30.4295   25.252   29.518   12.883   20.777   9.9989 8.741066 16.30770 
1 1 1    6   10   43 o   28.638   8.1881   6.3861   16.623 -15.6689   23.247   29.461   23.779   21.982   10.284   35.293   12.744 -13.31102 16.37628 
1 1 1    6   10   44 o   62.524   7.0851   93.531   17.222   65.905   23.832  123.728   24.916   51.073   11.580   73.974   8.1664 -22.90072 14.17021 
1 1 1    6   10   45 o   25.211   7.9051   1.4510   16.418  -3.5018   22.999   6.5970   23.443   23.855   10.816   26.567   11.531 -2.711369 15.81025 
1 1 1    6   10   46 o   46.622   8.9045   60.964   17.919   74.303   25.350   47.644   25.332   52.625   11.952   40.619   13.203 12.00566 17.80898 
1 1 1    6   10   47 o   31.687   8.7883   23.457   18.710  -2.1328   29.487   40.705   24.208   25.861   11.920   37.514   12.917 -11.65254 17.57665 
1 1 1    6   10   48 o   27.040   8.8024   3.9708   22.574   10.943   33.254  -1.9891   30.744   28.487   12.951   25.594   11.925 2.892599 17.60471 
1 1 1    6   10   49 o   25.863   8.4726   0.8581   22.134 -18.1114   32.679   16.935   30.085   23.283   11.247   28.443   12.674 -5.160870 16.94515 
1 1 1    6   10   50 o   33.005   9.7568   38.549   22.114   48.866   33.338   30.444   29.550   35.236   14.421   30.775   13.146 4.461546 19.51364 
1 1 1    6   11    0 o  478.026   4.0477  4716.31  112.825  4716.31  112.825  4716.31  112.825  478.026   5.7244  478.026   5.7244 0.000000 0.000000 
1 1 1    6   11    1 o  453.503   3.6206  4250.47   67.294  4184.70  100.579  4303.78   90.547  450.304   5.4155  456.701   4.8070 -6.397247 7.241168 
1 1 1    6   11    2 o  215.977   2.3076  961.149   20.317  969.104   31.262  955.333   26.733  216.746   3.4970  215.209   3.0117 1.536942 4.615160 
1 1 1    6   11    3 o  223.641   2.2433  1037.57   20.234  1002.76   31.888  1061.04   26.180  220.477   3.5067  226.806   2.7986 -6.328613 4.486544 
1 1 1    6   11    4 o  114.636   2.3034  274.285   10.361  260.472   17.377  281.904   12.906  112.365   3.7496  116.907   2.6765 -4.542320 4.606839 
1 1 1    6   11    5 o  592.009   5.0933  7271.10  118.799  7126.08  199.143  7351.22  148.022  587.273   8.2217  596.744   6.0141 -9.471436 10.18654 
1 1 1    6   11    6 o  202.953   2.7440  828.182   21.891  920.024   37.949  782.376   26.800  211.160   4.3573  194.747   3.3366 16.41373 5.488045 
1 1 1    6   11    7 o  113.062   2.6147  259.611   12.093  222.472   16.044  308.467   18.402  103.845   3.7460  122.280   3.6488 -18.43522 5.229333 
1 1 1    6   11    8 o  133.681   2.4468  369.439   13.450  356.752   19.596  380.742   18.496  131.504   3.6129  135.858   3.3008 -4.353546 4.893693 
1 1 1    6   11    9 o  225.868   2.4947  1052.86   22.927  1055.04   30.075  1049.83   35.427  226.154   3.2243  225.582   3.8077 0.5722351 4.989449 
1 1 1    6   11   10 o  434.149   3.8156  3886.61   68.255  3972.32   99.171  3809.48   94.085  438.686   5.4811  429.612   5.3098 9.073639 7.631266 
1 1 1    6   11   11 o  272.855   3.2906  1542.41   36.368  1569.57   47.397  1503.52   56.711  275.806   4.1666  269.904   5.0944 5.901886 6.581244 
1 1 1    6   11   12 o  435.730   4.2696  3932.86   75.879  4011.19  100.667  3829.80  115.467  440.812   5.5369  430.649   6.5008 10.16299 8.539227 
1 1 1    6   11   13 o  442.240   4.1131  4062.72   71.338  4119.20   88.482  3957.82  120.586  446.744   4.8021  437.736   6.6791 9.008240 8.226252 
1 1 1    6   11   14 o  355.161   3.0065  2608.13   42.713  2623.59   54.251  2582.93   69.280  356.580   3.6888  353.741   4.7485 2.839355 6.012916 
1 1 1    6   11   15 o  143.758   2.6392  425.192   15.551  415.531   20.758  437.551   23.477  141.907   3.5466  145.609   3.9092 -3.702209 5.278324 
1 1 1    6   11   16 o  200.145   2.8289  822.717   23.292  887.038   34.460  768.609   31.605  207.311   4.0302  192.979   3.9709 14.33235 5.657737 
1 1 1    6   11   17 o  306.329   3.3032  1956.76   40.279  2014.48   51.118  1862.23   65.417  312.401   3.9673  300.257   5.2824 12.14471 6.606307 
1 1 1    6   11   18 o  346.854   2.9549  2483.52   42.269  2464.06   59.377  2503.52   60.187  345.477   4.1671  348.230   4.1905 -2.753357 5.909758 
1 1 1    6   11   19 o  172.768   2.8179  614.753   19.933  604.269   26.525  628.354   30.211  171.091   3.7589  174.445   4.1990 -3.354416 5.635705 
1 1 1    6   11   20 o   80.550   4.3322  134.041   14.113  135.079   22.299  133.346   18.230   80.786   6.6923   80.313   5.5033 0.4726410 8.664460 
1 1 1    6   11   21 o  176.463   2.7020  642.750   19.660  624.535   27.461  661.903   28.160  173.900   3.8287  179.027   3.8137 -5.127945 5.404021 
1 1 1    6   11   22 o  126.686   3.6479  333.571   18.937  314.931   27.950  349.387   25.746  123.373   5.4928  129.998   4.8019 -6.624672 7.295845 
1 1 1    6   11   23 f  234.042   3.3656  1138.08   32.215  1083.32   48.124  1182.53   43.363  228.873   5.0981  239.210   4.3952 -10.33740 6.731111 
1 1 1    6   11   24 o  147.367   3.3218  448.395   19.666  446.080   25.085  452.086   31.680  146.919   4.1397  147.815   5.1963 -0.8957672 6.643676 
1 1 1    6   11   25 o   30.045   7.8203   15.063   12.769   13.360   18.254   16.695   17.867   29.378   11.066   30.712   11.053 -1.333420 15.64062 
1 1 1    6   11   26 o   73.190   5.6237  115.539   16.317   92.374   25.172  132.330   21.430   66.521   9.1746   79.859   6.5063 -13.33832 11.24744 
1 1 1    6   11   27 o  163.666   3.1401  551.246   21.095  527.226   28.240  581.567   31.728  159.670   4.2882  167.663   4.5882 -7.992981 6.280174 
1 1 1    6   11   28 o  105.710   3.7466  231.606   16.325  222.655   23.121  240.505   23.053  103.662   5.4077  107.757   5.1870 -4.095467 7.493222 
1 1 1    6   11   29 o  121.685   3.6900  307.336   18.438  313.275   25.071  300.339   27.212  122.997   4.9420  120.373   5.4811 2.623428 7.380094 
1 1 1    6   11   30 o  123.769   3.9776  320.396   20.034  299.419   30.344  336.606   26.675  120.081   6.1268  127.457   5.0743 -7.376328 7.955214 
1 1 1    6   11   31 o   99.322   4.7250  205.221   19.301  184.899   26.879  226.853   27.732   94.216   6.9171  104.429   6.4387 -10.21232 9.450027 
1 1 1    6   11   32 o  136.372   3.6534  386.465   20.510  358.546   28.957  414.573   29.055  131.393   5.3434  141.351   4.9837 -9.958115 7.306813 
1 1 1    6   11   33 o   40.767   9.2451   35.747   19.292   51.829   24.075   6.8961   32.248   48.197   12.123   33.336   13.962 14.86140 18.49023 
1 1 1    6   11   34 o   44.364   9.7687   44.003   19.966   35.174   30.845   50.369   26.193   41.487   14.564   47.242   13.023 -5.755692 19.53740 
1 1 1    6   11   35 o   51.792   8.2088   60.797   17.118   55.513   24.384   65.932   24.039   49.384   12.073   54.201   11.126 -4.816830 16.41762 
1 1 1    6   11   36 o   36.383   8.7629   27.612   16.256   16.874   23.376   37.666   22.621   32.055   12.410   40.710   12.375 -8.654186 17.52580 
1 1 1    6   11   37 o   97.348   4.5516  200.359   18.260  192.523   25.949  208.044   25.699   95.404   6.5946   99.293   6.2752 -3.888664 9.103176 
1 1 1    6   11   38 o   73.104   6.7487  118.260   18.981  165.556   28.252   79.345   25.627   87.569   7.8222   58.640   11.000 28.92856 13.49749 
1 1 1    6   11   39 o   38.707   9.1032   34.167   17.511   22.558   24.610   46.070   24.920   33.783   12.820   43.632   12.928 -9.848530 18.20637 
1 1 1    6   11   40 o   36.608   8.5922   28.206   16.720   7.6921   23.763   48.320   23.530   28.453   11.954   44.763   12.345 -16.30991 17.18446 
1 1 1    6   11   41 o   21.614   7.4052 -45.7283   18.779 -67.2558   23.536  -8.0107   31.153   15.756   7.9330   27.471   12.507 -11.71429 14.81043 
1 1 1    6   11   42 o   31.467   8.7899   18.734   16.869   21.098   24.249   16.516   23.483   32.369   12.610   30.564   12.250 1.804672 17.57984 
1 1 1    6   11   43 o   48.796   8.2922   59.564   16.658   47.664   23.353   71.893   23.769   43.197   12.435   54.394   10.973 -11.19724 16.58446 
1 1 1    6   11   44 o   26.158   8.0167   5.0727   16.132   11.029   22.536  -1.1864   23.102   27.718   11.644   24.597   11.023 3.120962 16.03346 
1 1 1    6   11   45 o   21.980   7.3230 -16.8043   17.477  -5.9492   23.881 -29.3208   25.644   23.551   10.808   20.409   9.8841 3.142147 14.64596 
1 1 1    6   11   46 o   27.529   8.1640   8.2929   16.903   27.958   23.839 -11.5884   23.970   32.846   12.580   22.213   10.408 10.63274 16.32792 
1 1 1    6   11   47 o   28.538   9.5189   1.1874   25.319   0.8516   53.848   1.2827   28.688   31.063   14.857   26.013   11.904 5.050348 19.03786 
1 1 1    6   11   48 o   24.985   8.3843 -13.8741   23.705   9.0663   33.874 -35.8892   33.184   28.159   12.904   21.811   10.709 6.347500 16.76869 
1 1 1    6   11   49 o   27.941   9.2701   9.1771   25.456   20.335   44.551   3.7684   31.018   30.106   14.133   25.777   11.999 4.329586 18.54019 
1 1 1    6   11   50 o   28.092   9.5239   8.9573   27.071   29.614   57.409   3.0511   30.698   30.992   14.956   25.192   11.796 5.800352 19.04773 
1 1 1    6   12    0 o   20.704   5.5164   11.941   6.2348   11.941   6.2348   11.941   6.2348   20.704   7.8014   20.704   7.8014 0.000000 0.000000 
1 1 1    6   12    1 o  389.742   3.5306  3155.35   52.078  3082.75   94.311  3187.19   62.466  386.439   5.9172  393.046   3.8533 -6.606567 7.061224 
1 1 1    6   12    2 o  172.941   2.1523  616.903   15.191  617.278   23.232  616.624   20.077  172.984   3.2563  172.899   2.8154 0.8493042E-01 4.304669 
1 1 1    6   12    3 o  339.057   3.1569  2341.19   43.589  2560.23   68.359  2191.11   56.585  352.237   4.7054  325.878   4.2100 26.35934 6.313856 
1 1 1    6   12    4 o  385.569   3.6469  3069.06   54.798  3064.85   94.456  3071.19   67.277  385.324   5.9434  385.815   4.2279 -0.4912109 7.293791 
1 1 1    6   12    5 o  455.948   3.6374  4296.83   68.293  4123.00   98.043  4460.66   95.182  446.965   5.3184  464.931   4.9636 -17.96527 7.274788 
1 1 1    6   12    6 o  224.316   2.2699  1045.71   20.610  995.271   31.986  1081.53   26.951  219.649   3.5307  228.983   2.8537 -9.333511 4.539769 
1 1 1    6   12    7 o  477.810   3.8110  4718.86   74.605  4650.74  111.723  4773.68  100.226  474.669   5.7067  480.950   5.0526 -6.281158 7.622028 
1 1 1    6   12    8 o  311.771   3.0299  2005.10   38.943  2021.94   56.051  1989.38   54.145  313.033   4.3414  310.508   4.2278 2.525818 6.059885 
1 1 1    6   12    9 o  378.016   3.4654  2937.01   53.804  3075.45   80.521  2825.33   72.320  386.022   5.0575  370.010   4.7389 16.01205 6.930742 
1 1 1    6   12   10 o  329.476   3.5852  2247.10   47.843  2276.54   62.268  2204.67   74.750  332.145   4.5454  326.807   5.5457 5.337799 7.170442 
1 1 1    6   12   11 o  355.770   2.9987  2609.01   42.452  2601.26   53.383  2622.33   70.020  355.081   3.6451  356.460   4.7626 -1.378754 5.997449 
1 1 1    6   12   12 o  416.138   5.0726  3625.25   78.087  3686.91   92.373  3470.85  146.171  422.603   5.2996  409.673   8.6508 12.93060 10.14511 
1 1 1    6   12   13 o  245.356   2.8747  1230.50   26.047  1216.05   30.555  1268.93   49.827  242.784   3.0514  247.928   4.8728 -5.144577 5.749320 
1 1 1    6   12   14 o  579.417   5.0683  6985.92  116.007  7102.89  145.235  6779.79  192.809  586.373   6.0053  572.461   8.1661 13.91174 10.13651 
1 1 1    6   12   15 o  135.788   2.8489  379.130   15.925  354.404   21.759  407.654   23.370  131.038   4.0260  140.538   4.0319 -9.499924 5.697799 
1 1 1    6   12   16 o  131.712   2.9338  358.224   15.137  358.448   18.686  357.797   25.816  131.793   3.4377  131.631   4.7551 0.1619263 5.867639 
1 1 1    6   12   17 o   65.700   3.8265   90.133   9.4890   91.589   11.378   86.806   17.198   66.607   4.1416   64.794   6.4355 1.812340 7.653023 
1 1 1    6   12   18 o  170.934   2.5618  603.480   17.300  604.386   21.573  601.847   28.957  171.137   3.0563  170.731   4.1122 0.4060516 5.123605 
1 1 1    6   12   19 o   82.279   3.8366  139.344   12.809  176.527   18.872  107.585   17.441   92.429   4.9504   72.128   5.8628 20.30069 7.673280 
1 1 1    6   12   20 o  141.403   3.0091  411.815   17.494  398.459   23.668  427.899   25.974  138.890   4.1316  143.916   4.3758 -5.025436 6.018124 
1 1 1    6   12   21 o  186.180   2.9135  718.820   22.088  698.804   33.804  733.732   29.177  183.880   4.4572  188.480   3.7533 -4.599182 5.827019 
1 1 1    6   12   22 o  154.337   3.1316  492.262   19.934  491.088   28.102  493.452   28.281  154.152   4.4200  154.521   4.4375 -0.3693237 6.263196 
1 1 1    6   12   23 o  102.452   3.4732  217.464   14.650  205.844   20.938  228.608   20.505   99.756   5.0890  105.149   4.7281 -5.393379 6.946429 
1 1 1    6   12   24 o   88.037   4.8671  163.825   17.251  177.972   22.712  144.536   26.520   92.682   5.9414   83.391   7.7106 9.291023 9.734173 
1 1 1    6   12   25 f   63.229   5.2860   83.601   13.458  107.699   19.489   61.635   18.608   72.050   6.5584   54.409   8.2919 17.64162 10.57205 
1 1 1    6   12   26 o  170.452   3.3218  595.251   22.520  579.549   28.149  623.169   37.534  167.430   4.0763  173.474   5.2460 -6.044220 6.643517 
1 1 1    6   12   27 o  242.479   3.0145  1206.51   29.753  1160.30   38.730  1273.05   46.477  236.906   3.9638  248.052   4.5428 -11.14680 6.028981 
1 1 1    6   12   28 o   92.707   4.1536  178.742   15.837  167.118   22.716  189.736   22.092   89.742   6.1372   95.672   5.5987 -5.929893 8.307224 
1 1 1    6   12   29 o  115.639   3.6615  277.254   17.453  266.971   24.744  287.434   24.620  113.493   5.2861  117.786   5.0680 -4.293343 7.323069 
1 1 1    6   12   30 o  115.778   4.1848  279.348   19.880  266.246   29.222  290.637   27.125  113.195   6.2591  118.361   5.5564 -5.165955 8.369592 
1 1 1    6   12   31 o   71.817   6.1297  109.596   17.873  128.876   24.957   89.300   25.607   78.514   7.7070   65.121   9.5338 13.39244 12.25937 
1 1 1    6   12   32 o   26.897   8.0707   0.8700   15.776  -6.2805   22.706   7.5437   21.935   25.070   11.099   28.724   11.720 -3.654078 16.14142 
1 1 1    6   12   33 o   49.010   9.7546   55.221   21.056   67.107   27.549   38.525   32.652   54.741   12.479   43.278   14.996 11.46344 19.50916 
1 1 1    6   12   34 o   39.432   9.8509   31.851   19.901   27.621   31.240   34.740   25.818   38.698   14.496   40.166   13.342 -1.468601 19.70185 
1 1 1    6   12   35 o   63.702   6.4586   87.519   16.873   81.762   24.633   92.608   23.159   61.558   9.7022   65.846   8.5275 -4.288273 12.91713 
1 1 1    6   12   36 o   38.963   8.8926   33.992   16.341   38.237   23.168   29.789   23.052   40.874   12.543   37.052   12.609 3.821560 17.78522 
1 1 1    6   12   37 o   50.120   8.1119   58.227   16.505   68.990   23.413   47.594   23.270   55.098   10.688   45.142   12.206 9.955929 16.22388 
1 1 1    6   12   38 o   26.363   8.0531   1.9134   16.024   0.1650   22.507   3.7109   22.820   25.785   11.244   26.940   11.532 -1.155485 16.10624 
1 1 1    6   12   39 o   28.473   8.1929   7.9994   15.929  -6.2862   22.883   21.432   22.189   24.262   10.914   32.683   12.222 -8.420139 16.38583 
1 1 1    6   12   40 o   28.246   8.3399   8.4793   16.228   11.928   23.383   5.2753   22.540   29.455   12.069   27.036   11.513 2.419882 16.67975 
1 1 1    6   12   41 o   73.349   10.457  139.968   30.950  177.398   43.571  101.849   43.971   86.247   12.249   60.451   16.951 25.79622 20.91314 
1 1 1    6   12   42 f   73.795   5.9588  121.624   18.115  129.904   26.140  113.972   25.128   76.289   8.3076   71.300   8.5449 4.988152 11.91770 
1 1 1    6   12   43 o   24.603   7.7697  -2.7299   16.313   6.5540   23.291 -11.6708   22.856   26.884   11.581   22.322   10.361 4.561882 15.53943 
1 1 1    6   12   44 o  118.524   4.0576  304.052   19.811  284.126   27.429  325.781   28.643  114.395   5.8135  122.652   5.6621 -8.257133 8.115164 
1 1 1    6   12   45 o   28.801   8.3620   7.2813   17.719 -17.8917   24.030   37.283   26.233   21.182   10.073   36.421   13.350 -15.23908 16.72406 
1 1 1    6   12   46 o   30.500   9.1588   19.040   20.251   25.452   25.057   6.9617   34.390   31.924   12.700   29.076   13.200 2.847828 18.31765 
1 1 1    6   12   47 o   30.126   9.4169   15.226   25.279 -26.8242   44.147   35.739   30.834   26.012   12.682   34.239   13.924 -8.227493 18.83371 
1 1 1    6   12   48 o   23.056   11.191 -23.5076   33.346 -23.5076   33.346   0.0000   0.0000   23.056   11.191  ?   ?       ?      ? 
1 1 1    6   12   49 o   28.730   8.9715   12.071   21.725   48.431   33.396 -14.6057   28.606   35.345   14.446   22.116   10.643 13.22833 17.94305 
1 1 1    6   13    0 f  123.933   2.3611  317.482   17.040  317.482   17.040  317.482   17.040  123.933   3.3391  123.933   3.3391 0.000000 0.000000 
1 1 1    6   13    1 o  363.066   3.3597  2740.69   46.188  2667.67   83.492  2772.89   55.445  359.509   5.6308  366.622   3.6667 -7.112915 6.719436 
1 1 1    6   13    2 o  528.416   3.9103  5783.11   83.340  5665.58  131.809  5861.40  107.573  523.879   6.1002  532.953   4.8938 -9.074463 7.820629 
1 1 1    6   13    3 o  237.209   2.3093  1164.27   22.018  1144.74   35.199  1176.83   28.220  235.562   3.6229  238.857   2.8645 -3.294800 4.618552 
1 1 1    6   13    4 o  547.597   4.6174  6212.33   95.177  6140.79  174.503  6242.63  113.555  545.203   7.7603  549.990   5.0059 -4.787231 9.234822 
1 1 1    6   13    5 o  494.450   3.9121  5029.97   78.441  5135.47  123.295  4958.23  101.670  498.751   5.9937  490.148   5.0292 8.602570 7.824157 
1 1 1    6   13    6 o  530.378   4.1408  5797.94   89.319  5863.02  138.708  5751.83  116.746  532.870   6.3112  527.885   5.3621 4.985046 8.281541 
1 1 1    6   13    7 o  189.691   2.1295  741.673   16.654  721.550   23.150  763.256   23.976  187.027   3.0011  192.356   3.0221 -5.328812 4.259071 
1 1 1    6   13    8 o  174.419   2.3065  628.250   16.400  623.136   25.130  632.044   21.646  173.795   3.5057  175.042   2.9982 -1.247147 4.612990 
1 1 1    6   13    9 o  491.208   3.9296  4975.01   78.602  4943.79  103.108  5018.32  121.450  489.410   5.1080  493.006   5.9728 -3.595795 7.859171 
1 1 1    6   13   10 o  118.514   2.3143  288.670   10.910  285.675   13.689  293.887   18.066  117.680   2.8203  119.348   3.6701 -1.667435 4.628536 
1 1 1    6   13   11 o  187.314   2.7476  733.373   20.337  758.516   25.594  690.301   33.498  191.744   3.2363  182.884   4.4410 8.859787 5.495125 
1 1 1    6   13   12 o  267.399   2.8566  1474.47   31.456  1455.73   43.168  1495.69   45.930  265.593   3.9408  269.205   4.1367 -3.611328 5.713298 
1 1 1    6   13   13 o  219.905   3.0061  1003.28   27.094  1055.84   36.937  942.057   39.863  226.185   3.9594  213.625   4.5244 12.56021 6.012219 
1 1 1    6   13   14 o   90.419   3.8487  170.113   11.209  170.870   12.453  166.883   25.736   90.999   3.3179   89.840   6.9456 1.158485 7.697419 
1 1 1    6   13   15 o  350.176   3.1509  2522.55   44.709  2483.38   57.835  2580.72   70.481  346.847   4.0429  353.504   4.8340 -6.657166 6.301785 
1 1 1    6   13   16 o  294.485   3.2332  1803.71   37.430  1834.60   46.592  1747.47   62.857  298.129   3.7891  290.841   5.2401 7.287903 6.466496 
1 1 1    6   13   17 o  121.810   3.3114  309.193   16.064  317.409   20.383  295.724   26.097  123.991   3.9857  119.629   5.2893 4.362762 6.622852 
1 1 1    6   13   18 o  125.384   3.5493  321.618   14.750  319.436   16.490  330.348   32.987  124.406   3.2138  126.362   6.3294 -1.955170 7.098555 
1 1 1    6   13   19 o   50.499   6.4462   54.113   12.789   31.173   17.273   81.947   19.027   38.121   10.601   62.878   7.3368 -24.75665 12.89249 
1 1 1    6   13   20 o  306.494   3.2264  1941.06   40.772  1920.02   56.804  1963.41   58.556  304.789   4.5187  308.199   4.6065 -3.410980 6.452808 
1 1 1    6   13   21 o   97.814   4.1277  193.594   15.741  211.523   27.668  185.014   19.141  101.034   6.6395   94.594   4.9060 6.440086 8.255457 
1 1 1    6   13   22 o  259.057   3.4029  1385.22   35.616  1375.63   45.885  1399.75   56.490  257.999   4.3121  260.114   5.2655 -2.115082 6.805864 
1 1 1    6   13   23 o  113.831   3.2404  268.015   15.210  262.922   21.591  273.032   21.430  112.753   4.6428  114.909   4.5217 -2.155777 6.480843 
1 1 1    6   13   24 o   53.769   6.6063   62.662   13.842   55.590   21.835   67.414   17.899   50.588   10.794   56.951   7.6202 -6.363014 13.21265 
1 1 1    6   13   25 o   31.846   9.0963   10.015   18.438   15.831   23.431   0.5557   29.882   32.668   12.482   31.024   13.235 1.643663 18.19256 
1 1 1    6   13   26 o  163.262   2.9443  551.147   19.822  551.906   28.326  550.419   27.748  163.368   4.2038  163.156   4.1235 0.2117157 5.888621 
1 1 1    6   13   27 f  177.700   3.2320  653.427   23.687  653.957   33.411  652.891   33.588  177.775   4.5567  177.626   4.5847 0.1486664 6.463977 
1 1 1    6   13   28 o  123.922   3.4325  318.037   17.542  314.535   24.884  321.497   24.733  123.240   4.8956  124.605   4.8126 -1.365150 6.865031 
1 1 1    6   13   29 o   58.066   6.6588   72.197   15.459   64.058   22.264   79.774   21.481   54.344   10.310   61.787   8.4294 -7.443287 13.31757 
1 1 1    6   13   30 o  104.582   4.3487  226.710   18.722  216.213   25.537  238.909   27.530  101.983   6.0712  107.180   6.2278 -5.196846 8.697393 
1 1 1    6   13   31 o   98.161   4.4328  203.231   17.670  165.243   25.280  239.523   24.709   88.977   6.8886  107.346   5.5809 -18.36900 8.865649 
1 1 1    6   13   32 o   43.066   8.5020   41.079   15.678   40.515   22.447   41.617   21.907   42.807   12.149   43.326   11.897 -0.5191650 17.00393 
1 1 1    6   13   33 o   64.684   6.9693   88.668   18.328   93.427   28.716   85.396   23.809   65.975   10.553   63.394   9.1058 2.580872 13.93867 
1 1 1    6   13   34 o   33.375   9.3493   16.203   19.061   22.948   23.371   2.8012   32.942   34.642   12.615   32.107   13.802 2.535007 18.69859 
1 1 1    6   13   35 o   56.943   7.1881   72.023   16.429   65.245   23.622   78.374   22.864   53.630   11.047   60.256   9.2000 -6.626308 14.37617 
1 1 1    6   13   36 o   32.833   8.6667   19.563   15.970   26.351   22.659   12.863   22.513   35.489   12.481   30.176   12.028 5.313503 17.33343 
1 1 1    6   13   37 o   33.972   8.6004   23.274   15.852   33.913   22.185   12.177   22.658   38.317   12.347   29.626   11.976 8.690830 17.20079 
1 1 1    6   13   38 o   81.980   6.1341  145.283   20.552  121.492   27.476  175.500   30.966   74.300   8.9661   89.661   8.3736 -15.36163 12.26814 
1 1 1    6   13   39 o   48.849   8.6282   56.158   17.562   74.694   26.388   41.418   23.531   56.157   11.769   41.540   12.620 14.61709 17.25650 
1 1 1    6   13   40 o   41.022   9.0018   41.535   16.834   39.843   24.019   43.168   23.602   40.252   12.834   41.792   12.626 -1.540569 18.00357 
1 1 1    6   13   41 o   36.962   8.9628   27.953   19.415  -4.0530   28.267   56.535   26.712   26.880   12.107   47.044   13.219 -20.16386 17.92559 
1 1 1    6   13   42 o   21.859   7.2180 -14.6270   16.066 -16.1948   23.289 -13.2032   22.193   21.865   10.250   21.854   10.166 0.1069450E-01 14.43595 
1 1 1    6   13   43 o   19.886   6.7441 -23.7521   15.929 -25.5348   22.348 -21.9110   22.710   19.498   9.3893   20.274   9.6835 -0.7756329 13.48813 
1 1 1    6   13   44 o   43.433   9.3663   50.212   17.855   42.251   22.473   63.841   29.403   39.660   12.384   47.206   14.055 -7.546181 18.73269 
1 1 1    6   13   45 o   30.474   9.3194   15.783   20.092   26.296   35.994   11.024   24.216   33.493   14.413   27.455   11.818 6.038675 18.63877 
1 1 1    6   13   46 o   35.254   9.6179   35.140   20.361   22.280   28.506   48.534   29.091   31.035   13.069   39.472   14.114 -8.437773 19.23571 
1 1 1    6   13   47 o   22.810   7.8012 -24.9716   22.412  -9.2207   32.375 -39.4660   31.057   24.894   11.796   20.726   10.212 4.168934 15.60245 
1 1 1    6   13   48 o   30.499   10.349   12.224   37.845 -14.2299   52.910   39.935   54.153   27.708   13.588   33.291   15.613 -5.582747 20.69795 
1 1 1    6   13   49 o   20.435   7.1186 -31.2539   21.086 -38.7476   33.163 -26.1685   27.319   20.760   10.288   20.111   9.8414 0.6492023 14.23725 
1 1 1    6   14    0 o  274.819   2.8230  1558.88   45.231  1558.88   45.231  1558.88   45.231  274.819   3.9923  274.819   3.9923 0.000000 0.000000 
1 1 1    6   14    1 o  355.737   3.0553  2612.99   44.418  2598.25   67.436  2624.29   59.033  354.835   4.6079  356.638   4.0133 -1.802979 6.110564 
1 1 1    6   14    2 o  289.787   2.6745  1727.08   31.491  1763.96   49.181  1701.45   40.997  292.390   4.0782  287.184   3.4612 5.205811 5.348986 
1 1 1    6   14    3 o  197.416   2.4436  806.980   18.232  796.592   33.187  811.470   21.820  196.488   4.0951  198.344   2.6673 -1.856537 4.887143 
1 1 1    6   14    4 o  210.706   2.5835  915.742   21.225  916.603   36.570  915.305   26.064  210.766   4.2068  210.646   3.0000 0.1202698 5.166969 
1 1 1    6   14    5 o  156.774   2.1219  510.080   13.636  466.954   19.839  548.692   18.772  150.452   3.1971  163.096   2.7907 -12.64365 4.243754 
1 1 1    6   14    6 o  293.250   2.5895  1775.44   30.428  1769.03   49.218  1779.40   38.712  292.807   4.0755  293.694   3.1959 -0.8878174 5.179078 
1 1 1    6   14    7 o  147.821   2.2586  450.613   13.768  439.045   19.274  462.663   19.672  145.884   3.2033  149.757   3.1850 -3.872879 4.517235 
1 1 1    6   14    8 o  578.896   4.1437  6919.77   98.933  6902.77  139.339  6937.05  140.491  578.181   5.8431  579.611   5.8769 -1.429749 8.287334 
1 1 1    6   14    9 o  326.208   2.9456  2198.77   39.311  2218.17   52.494  2174.02   59.317  327.863   3.8820  324.554   4.4312 3.309906 5.891158 
1 1 1    6   14   10 o  306.524   2.7231  1944.37   33.430  1962.10   42.575  1915.86   53.985  308.377   3.3474  304.671   4.2961 3.705444 5.446211 
1 1 1    6   14   11 o  329.452   3.2430  2250.32   40.112  2264.28   47.782  2217.01   73.814  331.260   3.4973  327.643   5.4622 3.616180 6.485916 
1 1 1    6   14   12 o  419.773   3.7539  3634.58   64.901  3558.27   89.071  3720.96   94.762  415.094   5.2026  424.452   5.4130 -9.358337 7.507871 
1 1 1    6   14   13 o  233.645   2.5944  1118.61   24.500  1087.92   31.441  1166.05   39.090  229.611   3.3200  237.679   3.9876 -8.068359 5.188767 
1 1 1    6   14   14 o  221.261   2.9593  1011.02   23.814  1011.40   27.766  1009.97   46.311  221.396   3.0407  221.125   5.0779 0.2706604 5.918648 
1 1 1    6   14   15 o  498.494   4.5534  5149.65   88.352  5172.18  108.453  5105.20  152.346  500.347   5.2554  496.641   7.4374 3.705933 9.106853 
1 1 1    6   14   16 o  260.203   2.9758  1397.65   28.911  1397.05   34.252  1399.14   53.915  260.180   3.1919  260.227   5.0233 -0.4742432E-01 5.951656 
1 1 1    6   14   17 o  391.573   3.2571  3145.80   50.230  3095.75   62.142  3240.13   85.314  387.209   3.8911  395.937   5.2243 -8.728424 6.514142 
1 1 1    6   14   18 o  166.345   2.7342  573.301   18.661  592.106   25.382  551.180   27.530  169.337   3.6342  163.353   4.0861 5.984695 5.468410 
1 1 1    6   14   19 o  208.109   2.7564  893.080   23.460  882.945   31.132  906.396   35.686  206.767   3.6506  209.452   4.1309 -2.684921 5.512834 
1 1 1    6   14   20 o  125.155   3.3560  324.600   17.216  316.330   25.641  331.389   23.232  123.681   5.0265  126.629   4.4482 -2.947441 6.712094 
1 1 1    6   14   21 o  226.882   3.7263  1065.33   34.764  1059.51   51.107  1070.34   47.427  226.276   5.4762  227.488   5.0548 -1.211288 7.452514 
1 1 1    6   14   22 o  149.473   2.8440  461.572   17.527  444.569   24.566  479.202   25.014  146.667   4.0610  152.279   3.9827 -5.612015 5.688055 
1 1 1    6   14   23 o  169.878   2.9524  592.762   20.494  570.512   26.977  623.125   31.514  166.154   3.9365  173.602   4.4013 -7.447250 5.904880 
1 1 1    6   14   24 o   64.116   5.6185   86.037   14.753   80.865   21.791   90.415   20.046   62.286   8.4823   65.947   7.3702 -3.661293 11.23696 
1 1 1    6   14   25 o   67.402   7.8192  101.055   19.862  111.028   24.963   83.850   32.790   72.989   8.2924   61.815   13.259 11.17451 15.63839 
1 1 1    6   14   26 o   44.494   7.6857   43.457   13.988   39.590   20.568   46.784   19.080   42.633   11.453   46.355   10.252 -3.722027 15.37143 
1 1 1    6   14   27 o   43.657   7.0284   37.148   14.369   75.447   21.624   6.8676   19.228   60.095   8.7242   27.218   11.022 32.87728 14.05688 
1 1 1    6   14   28 o   27.060   7.8745   4.2401   14.276   10.790   20.918  -1.4704   19.531   29.545   11.651   24.576   10.596 4.968937 15.74892 
1 1 1    6   14   29 o   34.249   8.2411   19.605   14.929   37.460   22.096   4.6075   20.251   41.559   12.134   26.939   11.154 14.62029 16.48227 
1 1 1    6   14   30 o   94.459   5.2501  190.831   19.951  225.832   27.304  150.739   29.223  104.137   6.3571   84.781   8.3572 19.35683 10.50024 
1 1 1    6   14   31 o   93.062   4.8247  179.928   18.366  188.890   28.094  173.238   24.271   95.010   7.1693   91.113   6.4586 3.897034 9.649498 
1 1 1    6   14   32 f  167.477   3.4564  575.675   23.668  531.238   31.084  636.981   36.510  159.927   4.7124  175.027   5.0576 -15.10002 6.912727 
1 1 1    6   14   33 o  169.769   4.8719  619.608   33.212  533.078   50.873  683.881   43.845  158.756   7.7695  180.783   5.8803 -22.02667 9.743859 
1 1 1    6   14   34 o   33.597   9.3690   14.893   18.530   8.0151   23.054   27.446   31.147   28.955   11.938   38.239   14.443 -9.283440 18.73804 
1 1 1    6   14   35 o   38.926   8.5915   32.871   15.818   47.210   23.266   20.546   21.570   45.091   12.210   32.762   12.090 12.32902 17.18294 
1 1 1    6   14   36 o   54.383   7.4653   66.767   16.357   55.991   23.066   77.667   23.199   49.113   11.576   59.653   9.4291 -10.54016 14.93055 
1 1 1    6   14   37 o   45.061   8.3483   48.357   16.345   31.228   23.117   65.481   23.113   37.059   12.626   53.063   10.925 -16.00370 16.69653 
1 1 1    6   14   38 o  111.878   4.6223  268.125   21.274  278.697   29.471  256.622   30.742  114.356   6.2484  109.399   6.8133 4.956268 9.244640 
1 1 1    6   14   39 o   28.793   8.5391   8.2635   17.110   13.826   25.236   3.5317   23.277   30.724   12.557   26.862   11.575 3.861399 17.07826 
1 1 1    6   14   40 o   35.288   9.4122   27.306   18.414   22.638   31.117   29.821   22.843   34.783   14.044   35.793   12.535 -1.010117 18.82434 
1 1 1    6   14   41 o   29.875   9.0423   9.6038   19.873   13.886   26.292   3.8972   30.351   30.478   12.672   29.272   12.902 1.205896 18.08457 
1 1 1    6   14   42 o   45.975   9.6178   53.788   20.705   30.116   27.407   85.262   31.602   35.409   13.506   56.541   13.696 -21.13190 19.23570 
1 1 1    6   14   43 o   37.350   9.0720   33.349   17.599   55.800   27.194   17.170   23.085   44.936   13.548   29.764   12.069 15.17182 18.14401 
1 1 1    6   14   44 o   32.768   8.7746   25.600   17.008   12.057   23.655   40.096   24.472   27.724   11.800   37.813   12.989 -10.08965 17.54914 
1 1 1    6   14   45 o   28.405   7.7702  -6.3102   17.417   46.816   25.081 -55.7931   24.205   40.249   13.140   16.561   8.2976 23.68785 15.54038 
1 1 1    6   14   46 o   38.537   11.179   50.793   28.131   74.468   44.241   34.723   36.449   42.931   16.940   34.143   14.593 8.788219 22.35874 
1 1 1    6   14   47 o   18.945   6.6889 -56.0879   21.540 -76.3176   31.657 -38.6477   29.394   17.813   8.9969   20.077   9.9006 -2.264118 13.37783 
1 1 1    6   14   48 o   24.229   8.5721 -26.9958   25.390  -6.6334   59.198 -31.5860   28.106   28.550   14.073   19.909   9.7912 8.640676 17.14423 
1 1 1    6   15    0 o  344.987   3.2148  2456.52   64.665  2456.52   64.665  2456.52   64.665  344.987   4.5465  344.987   4.5465 0.000000 0.000000 
1 1 1    6   15    1 o   94.922   2.2335  186.529   8.6152  181.947   13.294  189.846   11.312   93.911   3.4323   95.934   2.8589 -2.022957 4.466948 
1 1 1    6   15    2 o  528.250   3.6212  5758.04   78.321  5774.95  118.191  5744.79  104.579  528.912   5.4180  527.587   4.8060 1.325378 7.242368 
1 1 1    6   15    3 o  144.729   2.4123  422.438   13.904  468.620   23.373  397.145   17.298  150.706   3.7603  138.751   3.0226 11.95589 4.824544 
1 1 1    6   15    4 o  401.592   3.5444  3303.57   58.215  3517.45   89.331  3145.69   76.751  412.786   5.2470  390.398   4.7666 22.38776 7.088858 
1 1 1    6   15    5 o  297.220   2.9010  1791.99   35.015  1995.07   55.613  1658.61   45.070  310.923   4.3367  283.517   3.8543 27.40564 5.801934 
1 1 1    6   15    6 o  436.541   3.3921  3925.77   58.941  3963.81   97.255  3903.69   74.099  438.155   5.3817  434.927   4.1307 3.227966 6.784232 
1 1 1    6   15    7 o  159.376   2.0850  523.657   13.699  512.826   19.014  535.344   19.752  157.665   2.9240  161.088   2.9729 -3.423431 4.169915 
1 1 1    6   15    8 o  180.677   2.2798  665.875   16.763  629.657   21.749  718.869   26.309  174.699   3.0185  186.654   3.4174 -11.95490 4.559566 
1 1 1    6   15    9 o  485.947   3.8843  4879.31   77.114  4893.64  102.338  4860.47  117.297  486.823   5.0968  485.070   5.8629 1.752899 7.768631 
1 1 1    6   15   10 o  495.667   3.9529  5075.35   79.986  5078.33  105.843  5071.38  122.132  495.895   5.1750  495.440   5.9769 0.4546204 7.905897 
1 1 1    6   15   11 o  343.976   3.4659  2456.92   46.704  2487.48   57.835  2399.64   79.185  347.143   4.0394  340.809   5.6333 6.334106 6.931859 
1 1 1    6   15   12 o   92.658   2.6795  177.873   9.8936  179.838   12.511  174.594   16.164   93.354   3.2494   91.961   4.2615 1.392464 5.359019 
1 1 1    6   15   13 o  139.506   2.5404  401.099   14.406  398.286   18.810  405.090   22.405  138.925   3.2828  140.087   3.8777 -1.162521 5.080706 
1 1 1    6   15   14 o  209.132   2.4589  900.946   20.442  896.132   25.657  909.316   33.829  208.392   2.9851  209.872   3.9081 -1.480240 4.917703 
1 1 1    6   15   15 o  100.891   4.9835  201.910   17.646  194.436   20.039  227.720   37.239   97.005   5.0086  104.778   8.6172 -7.772911 9.967054 
1 1 1    6   15   16 o  181.468   2.4965  683.137   17.955  692.036   22.550  667.722   29.679  183.118   2.9857  179.818   4.0018 3.300247 4.992912 
1 1 1    6   15   17 o  196.573   2.5251  805.870   19.815  831.417   25.267  765.060   31.936  200.694   3.0525  192.451   4.0234 8.242859 5.050286 
1 1 1    6   15   18 o   69.149   3.5971   97.337   9.7888   93.908   12.049  103.997   16.789   67.412   4.3335   70.885   5.7426 -3.473763 7.194190 
1 1 1    6   15   19 o  313.996   2.8839  2046.67   36.383  2081.48   46.681  1992.81   58.069  317.480   3.5650  310.512   4.5342 6.968292 5.767846 
1 1 1    6   15   20 o   99.007   3.3933  203.048   13.832  212.899   19.337  192.725   19.793  101.480   4.6200   96.534   4.9714 4.946472 6.786660 
1 1 1    6   15   21 o  228.071   3.0586  1077.26   26.894  1080.79   32.702  1069.88   47.271  228.750   3.4662  227.392   5.0403 1.357224 6.117120 
1 1 1    6   15   22 f  134.208   2.8908  368.294   15.593  355.305   19.773  389.661   25.361  131.142   3.6556  137.275   4.4792 -6.132233 5.781607 
1 1 1    6   15   23 f  209.999   2.8731  908.478   24.649  889.295   32.532  934.335   37.770  207.438   3.8024  212.561   4.3082 -5.123367 5.746190 
1 1 1    6   15   24 o   85.434   4.5945  151.285   15.539  152.242   25.935  150.749   19.409   85.567   7.3486   85.300   5.5168 0.2674408 9.189016 
1 1 1    6   15   25 o  171.219   3.3841  597.306   23.061  572.248   28.761  642.423   38.592  166.343   4.1921  176.096   5.3135 -9.752319 6.768120 
1 1 1    6   15   26 o   38.323   8.3342   23.978   14.691   52.354   25.729   10.252   17.894   48.826   12.668   27.819   10.833 21.00695 16.66833 
1 1 1    6   15   27 o  153.764   3.6762  493.189   23.152  452.834   33.868  528.592   31.722  147.766   5.5571  159.761   4.8141 -11.99487 7.352348 
1 1 1    6   15   28 o  284.604   3.2158  1670.51   37.260  1636.42   48.695  1718.65   57.873  281.203   4.1986  288.007   4.8720 -6.804108 6.431514 
1 1 1    6   15   29 o   80.021   5.2984  133.062   17.431  119.721   23.751  148.634   25.661   75.681   7.6092   84.360   7.3753 -8.679161 10.59687 
1 1 1    6   15   30 o   68.032   6.7361   96.681   18.783   84.214   25.130  112.463   28.273   63.098   9.6561   72.966   9.3948 -9.867733 13.47227 
1 1 1    6   15   31 o  163.923   4.7378  580.003   29.997  620.506   37.271  505.522   50.542  172.745   5.2312  155.102   7.9008 17.64276 9.475659 
1 1 1    6   15   32 o   34.361   8.1682   18.768   16.569 -13.1622   24.962   43.913   22.152   24.587   11.194   44.136   11.898 -19.54959 16.33637 
1 1 1    6   15   33 o   37.443   9.1561   27.096   20.028 -13.9958   34.673   47.671   24.535   29.265   13.273   45.622   12.616 -16.35736 18.31227 
1 1 1    6   15   34 o   53.930   9.4462   66.780   20.870   54.199   27.477   83.936   32.085   48.030   13.375   59.829   13.342 -11.79857 18.89237 
1 1 1    6   15   35 o   36.958   8.6923   28.835   16.078   41.324   23.023   16.946   22.463   42.289   12.397   31.627   12.187 10.66172 17.38463 
1 1 1    6   15   36 o   46.681   8.3467   51.818   16.297   40.844   23.064   62.759   23.030   41.475   12.471   51.887   11.097 -10.41226 16.69344 
1 1 1    6   15   37 o   70.542   6.0637  109.089   17.599  110.612   24.188  107.376   25.654   71.227   8.2337   69.857   8.9039 1.369629 12.12742 
1 1 1    6   15   38 o   32.424   8.6260   18.421   16.568   3.9657   23.477   32.761   23.384   27.229   11.677   37.619   12.700 -10.39038 17.25203 
1 1 1    6   15   39 o   33.480   9.8617   15.078   21.108   8.9017   25.430   28.759   37.850   29.096   12.303   37.864   15.416 -8.767660 19.72350 
1 1 1    6   15   40 o   40.282   11.590   34.246   23.885   42.108   64.694   33.005   25.701   43.473   19.008   37.092   13.266 6.380722 23.17943 
1 1 1    6   15   41 o   31.833   8.6053   16.682   17.222  -3.1854   23.936   38.004   24.797   24.914   11.188   38.752   13.078 -13.83816 17.21053 
1 1 1    6   15   42 o   35.773   8.6504   31.246   18.384   52.255   23.190  -4.2976   30.163   44.733   12.222   26.812   12.245 17.92133 17.30089 
1 1 1    6   15   43 o   27.161   7.9215   10.580   14.910   21.420   20.956  -0.5348   21.219   30.632   11.780   23.691   10.594 6.941324 15.84307 
1 1 1    6   15   44 o   37.856   9.0070   39.554   17.436   24.949   24.436   54.704   24.888   31.814   12.578   43.898   12.895 -12.08418 18.01390 
1 1 1    6   15   45 o   26.615   8.1817   8.8252   16.994   16.401   23.601   0.6683   24.489   28.543   11.948   24.687   11.180 3.855808 16.36343 
1 1 1    6   15   46 o   29.849   9.5263   9.5984   24.932 -12.7850   32.430   41.947   38.986   24.408   11.634   35.290   15.088 -10.88194 19.05261 
1 1 1    6   15   47 o   24.766   8.1463  -9.9990   22.307 -55.4977   35.104   20.817   28.890   20.351   10.166   29.181   12.732 -8.830227 16.29261 
1 1 1    6   15   48 o   25.038   8.4715  -7.2834   25.862 -79.0486   55.541   12.584   29.223   23.374   11.819   26.702   12.140 -3.328218 16.94306 
1 1 1    6   16    0 o  163.602   2.0255  552.574   19.315  552.574   19.315  552.574   19.315  163.602   2.8644  163.602   2.8644 0.000000 0.000000 
1 1 1    6   16    1 o  228.015   2.4153  1072.18   22.450  1076.27   34.513  1069.18   29.558  228.383   3.6640  227.647   3.1481 0.7359009 4.830668 
1 1 1    6   16    2 o  242.794   2.2813  1215.99   22.840  1204.82   31.945  1227.68   32.669  241.654   3.2051  243.933   3.2471 -2.279587 4.562504 
1 1 1    6   16    3 o  378.216   3.6412  2916.44   52.391  3049.24   95.590  2859.43   62.637  384.207   6.0322  372.225   4.0800 11.98212 7.282478 
1 1 1    6   16    4 o  308.386   2.7654  1967.03   34.976  1918.36   51.951  2007.38   47.302  304.876   4.1314  311.895   3.6771 -7.019318 5.530798 
1 1 1    6   16    5 o  255.873   2.6977  1274.26   27.216  1616.18   47.754  1109.78   33.121  279.832   4.1376  231.913   3.4627 47.91924 5.395370 
1 1 1    6   16    6 o  226.524   2.2741  1064.73   20.792  1028.71   32.694  1089.19   26.942  223.277   3.5502  229.771   2.8429 -6.494995 4.548236 
1 1 1    6   16    7 o  192.846   2.7918  754.017   20.025  736.933   23.537  798.789   38.103  188.992   3.0195  196.699   4.6966 -7.706421 5.583549 
1 1 1    6   16    8 o  231.571   2.5417  1107.90   23.963  1114.58   31.515  1098.75   36.895  232.412   3.2877  230.730   3.8771 1.682556 5.083360 
1 1 1    6   16    9 o  387.693   3.1413  3109.80   48.772  3131.03   62.072  3075.55   78.846  389.480   3.8641  385.905   4.9538 3.574524 6.282594 
1 1 1    6   16   10 o  187.452   2.7532  724.705   20.147  723.450   24.764  727.162   34.648  187.240   3.2067  187.663   4.4764 -0.4233551 5.506438 
1 1 1    6   16   11 o  179.614   2.5627  665.759   18.961  663.887   26.161  667.830   27.522  179.352   3.5365  179.876   3.7097 -0.5246124 5.125321 
1 1 1    6   16   12 o   72.960   2.8678  107.490   8.3813  100.458   10.511  119.770   13.889   69.763   3.6530   76.157   4.4217 -6.394554 5.735514 
1 1 1    6   16   13 o  218.475   2.7679  984.311   24.921  1013.22   36.151  958.135   34.400  221.525   3.9567  215.425   3.8717 6.100388 5.535827 
1 1 1    6   16   14 o   92.279   3.8559  180.266   13.921  161.928   23.107  190.715   17.442   88.467   6.3328   96.090   4.4010 -7.623726 7.711871 
1 1 1    6   16   15 f  239.991   4.0043  1198.08   28.696  1201.16   31.245  1181.47   72.545  241.231   3.1404  238.752   7.3671 2.479156 8.008506 
1 1 1    6   16   16 o   89.918   4.0181  158.475   11.428  153.842   12.531  181.387   27.866   86.314   3.5199   93.522   7.2244 -7.208458 8.036269 
1 1 1    6   16   17 o  233.600   2.5861  1132.32   24.125  1148.86   30.633  1105.30   39.148  235.902   3.1484  231.299   4.1036 4.602966 5.172259 
1 1 1    6   16   18 o  212.926   2.5420  929.889   21.389  914.401   26.564  958.440   36.066  210.464   3.0602  215.388   4.0599 -4.924576 5.084053 
1 1 1    6   16   19 o   43.134   5.4518   45.040   8.4082   54.256   10.276   26.367   14.627   51.220   4.8641   35.048   9.7585 16.17179 10.90359 
1 1 1    6   16   20 o  133.320   2.8990  343.406   14.292  316.547   16.555  421.991   28.317  123.808   3.2420  142.831   4.8069 -19.02261 5.797985 
1 1 1    6   16   21 o  182.109   2.9550  683.353   22.160  729.724   32.426  642.721   30.354  187.887   4.1844  176.332   4.1736 11.55501 5.910022 
1 1 1    6   16   22 o  165.461   2.7746  567.911   18.646  578.036   24.453  553.846   28.820  167.264   3.5445  163.657   4.2697 3.606552 5.549203 
1 1 1    6   16   23 o  138.004   2.8080  393.516   15.374  393.016   19.263  394.392   25.517  137.929   3.3860  138.079   4.4805 -0.1502075 5.616086 
1 1 1    6   16   24 o  234.481   3.4498  1132.12   32.990  1099.21   43.245  1177.93   51.022  230.486   4.5492  238.476   5.1873 -7.990402 6.899504 
1 1 1    6   16   25 o   62.136   5.7355   79.849   14.306   83.298   23.264   77.751   18.143   63.134   8.9341   61.138   7.1949 1.996372 11.47102 
1 1 1    6   16   26 o   95.550   4.6343  189.632   17.641  189.290   22.234  190.214   28.983   95.529   5.6429   95.570   7.3529 -0.4044342E-01 9.268620 
1 1 1    6   16   27 o   87.316   4.3044  157.459   15.449  169.388   23.035  147.707   20.827   90.294   6.1854   84.337   5.9876 5.956970 8.608725 
1 1 1    6   16   28 o  188.869   3.1625  738.863   24.486  737.700   32.862  740.314   36.715  188.749   4.2212  188.989   4.7102 -0.2398071 6.324938 
1 1 1    6   16   29 o  100.807   4.3290  211.230   17.979  198.880   24.839  224.821   26.057   97.711   6.1635  103.902   6.0805 -6.191238 8.657971 
1 1 1    6   16   30 o   43.593   7.9719   41.281   15.034   59.627   21.911   24.960   20.666   52.046   10.568   35.139   11.938 16.90664 15.94388 
1 1 1    6   16   31 o  124.260   3.9511  321.188   20.218  299.547   27.769  345.601   29.493  119.811   5.6195  128.709   5.5557 -8.898132 7.902213 
1 1 1    6   16   32 o   77.888   6.4679  137.882   19.092  105.241   31.697  156.468   23.918   69.546   11.050   86.230   6.7252 -16.68355 12.93589 
1 1 1    6   16   33 o   38.966   9.1311   24.621   17.711   59.018   30.433   7.0046   21.779   49.995   14.131   27.938   11.568 22.05662 18.26227 
1 1 1    6   16   34 o   66.947   8.9194  100.094   20.636  107.653   42.304   97.734   23.639   66.477   15.683   67.417   8.5014 -0.9398346 17.83888 
1 1 1    6   16   35 o   32.452   9.5578  -0.2093   19.746 -14.4555   23.076   38.743   38.157   22.734   10.502   42.171   15.972 -19.43691 19.11558 
1 1 1    6   16   36 o   30.755   9.4703  -0.5174   19.587  -8.4112   22.560   23.653   39.477   23.632   10.714   37.878   15.619 -14.24547 18.94064 
1 1 1    6   16   37 o   35.761   9.3977   20.736   20.444   47.764   29.519  -4.1790   28.342   44.077   14.246   27.446   12.260 16.63084 18.79531 
1 1 1    6   16   38 o   37.425   9.1700   32.533   17.731   42.129   24.591   22.140   25.590   41.382   12.960   33.468   12.977 7.913940 18.34007 
1 1 1    6   16   39 o   26.992   8.2841   3.1094   17.138  -0.0161   24.082   6.3171   24.396   26.075   11.493   27.908   11.934 -1.832975 16.56821 
1 1 1    6   16   40 o   37.192   8.3829   23.714   17.526   65.604   26.901  -7.1756   23.100   50.715   12.846   23.668   10.773 27.04663 16.76585 
1 1 1    6   16   41 o   23.345   7.5096  -6.1973   15.839  -1.5111   23.132 -10.3338   21.733   24.690   11.049   21.999   10.173 2.690477 15.01920 
1 1 1    6   16   42 o   34.258   9.3541   28.013   19.299   38.087   26.467   16.579   28.200   37.703   13.465   30.814   12.988 6.888739 18.70825 
1 1 1    6   16   43 o   25.499   7.8916   5.7766   15.791   7.7671   21.244   3.3184   23.608   25.667   11.059   25.331   11.261 0.3363247 15.78326 
1 1 1    6   16   44 o   31.229   7.9629   12.894   16.937   51.256   23.969 -25.3650   23.937   42.557   12.694   19.902   9.6170 22.65474 15.92589 
1 1 1    6   16   45 o   23.380   7.6290  -6.1409   17.450   7.4064   25.028 -18.9572   24.343   26.063   11.590   20.697   9.9231 5.366238 15.25796 
1 1 1    6   16   46 o   21.714   7.5286 -34.9733   22.747 -49.0551   31.194 -18.9840   33.240   19.757   9.8229   23.671   11.412 -3.913462 15.05721 
1 1 1    6   16   47 f   24.340   8.0931  -4.0391   21.305 -20.9121   31.634   9.9661   28.821   22.328   10.852   26.352   12.010 -4.024202 16.18619 
1 1 1    6   17    0 o   82.818   2.1166  142.029   10.194  142.029   10.194  142.029   10.194   82.818   2.9934   82.818   2.9934 0.000000 0.000000 
1 1 1    6   17    1 o  387.035   3.2530  3088.25   51.247  3118.85   79.327  3066.33   67.137  388.645   4.9488  385.425   4.2234 3.219421 6.505970 
1 1 1    6   17    2 o  142.449   2.3920  417.831   13.465  421.794   22.592  415.648   16.769  142.960   3.8316  141.939   2.8644 1.021057 4.783924 
1 1 1    6   17    3 o  338.498   3.5424  2347.47   47.899  2439.92   78.872  2293.45   60.291  343.684   5.5641  333.313   4.3857 10.37073 7.084758 
1 1 1    6   17    4 o  201.639   2.2618  841.489   18.665  817.163   27.975  861.007   25.059  198.997   3.4085  204.282   2.9742 -5.284424 4.523652 
1 1 1    6   17    5 o  308.458   2.7761  1968.56   35.179  1904.96   51.622  2023.70   48.068  303.782   4.1201  313.135   3.7218 -9.353485 5.552263 
1 1 1    6   17    6 o  155.787   2.1188  490.069   13.305  549.858   21.684  453.968   16.849  163.238   3.2207  148.336   2.7541 14.90265 4.237691 
1 1 1    6   17    7 o  271.075   2.4750  1514.84   27.641  1483.09   38.057  1550.29   40.213  268.076   3.4420  274.075   3.5574 -5.999237 4.949988 
1 1 1    6   17    8 o  142.078   2.1055  416.245   12.332  397.659   17.219  435.815   17.669  138.824   3.0074  145.333   2.9477 -6.509308 4.211091 
1 1 1    6   17    9 o  107.979   2.3313  240.898   10.001  241.674   12.567  239.557   16.514  108.227   2.8154  107.730   3.7167 0.4961090 4.662643 
1 1 1    6   17   10 o  204.289   3.8325  861.547   32.292  861.547   32.292   0.0000   0.0000  204.289   3.8325  ?   ?       ?      ? 
1 1 1    6   17   11 o  174.561   2.5567  629.329   18.394  638.136   25.631  619.977   26.412  175.824   3.5344  173.297   3.6953 2.527588 5.113414 
1 1 1    6   17   12 o   57.809   3.2110   66.288   7.4980   52.555   9.6014   87.755   12.004   50.438   4.6154   65.180   4.4653 -14.74188 6.421916 
1 1 1    6   17   13 o  107.604   2.5454  239.671   10.911  241.461   13.778  236.661   17.867  108.160   3.0885  107.047   4.0469 1.113647 5.090743 
1 1 1    6   17   14 o  106.366   2.8628  234.737   12.500  248.199   17.198  219.662   18.199  109.623   3.8037  103.108   4.2794 6.515205 5.725536 
1 1 1    6   17   15 o  171.723   2.6773  605.380   17.443  599.731   20.861  618.510   31.803  170.451   2.9673  172.994   4.4573 -2.543060 5.354653 
1 1 1    6   17   16 o  163.964   3.0891  573.860   17.897  592.337   20.738  519.931   35.429  169.398   2.9681  158.529   5.4186 10.86839 6.178267 
1 1 1    6   17   17 o  112.937   2.6341  258.724   11.741  247.929   14.482  279.430   20.057  109.584   3.2041  116.290   4.1818 -6.706398 5.268232 
1 1 1    6   17   18 o  137.449   2.8017  389.906   15.835  384.544   21.509  396.252   23.400  136.428   3.8225  138.471   4.0973 -2.042252 5.603468 
1 1 1    6   17   19 o  153.012   2.7917  478.863   17.489  445.444   23.098  523.769   26.774  146.829   3.8141  159.194   4.0778 -12.36469 5.583486 
1 1 1    6   17   20 o  202.691   3.0790  840.177   24.642  818.264   30.511  881.286   41.788  199.004   3.7173  206.378   4.9094 -7.374115 6.157937 
1 1 1    6   17   21 f   47.964   6.2242   50.481   11.764   35.086   17.010   64.596   16.288   40.170   10.237   55.757   7.0827 -15.58728 12.44831 
1 1 1    6   17   22 o   98.141   3.6617  199.791   14.669  163.998   20.371  238.343   21.141   88.965   5.5516  107.317   4.7763 -18.35201 7.323470 
1 1 1    6   17   23 o  150.657   3.2547  470.352   20.151  461.405   29.634  478.047   27.482  149.299   4.8125  152.016   4.3833 -2.717239 6.509442 
1 1 1    6   17   24 o  150.010   3.0799  454.504   17.301  439.978   20.389  491.861   32.697  145.925   3.3876  154.095   5.1446 -8.170242 6.159756 
1 1 1    6   17   25 o   42.319   6.0607   50.138   10.409   68.953   12.459   6.6547   18.941   57.680   5.2373   26.959   10.932 30.72125 12.12145 
1 1 1    6   17   26 o  229.677   3.5646  1108.76   31.862  1142.43   39.384  1044.98   54.205  234.992   4.0635  224.362   5.8577 10.63042 7.129123 
1 1 1    6   17   27 o  140.161   3.2050  406.949   18.510  408.585   26.788  405.453   25.607  140.418   4.6254  139.905   4.4377 0.5124359 6.409982 
1 1 1    6   17   28 o   45.429   7.8602   45.976   14.730   37.197   21.279   54.053   20.410   41.211   11.872   49.648   10.305 -8.436462 15.72042 
1 1 1    6   17   29 o   50.848   7.7146   56.339   15.716   71.277   23.463   44.185   21.165   57.094   10.345   44.602   11.447 12.49184 15.42920 
1 1 1    6   17   30 o   86.455   4.7283  155.888   16.758  181.584   24.548  133.461   22.933   93.156   6.3890   79.754   6.9718 13.40223 9.456537 
1 1 1    6   17   31 o   53.043   7.7127   63.139   16.306   58.206   23.266   67.901   22.859   50.794   11.387   55.291   10.406 -4.496738 15.42534 
1 1 1    6   17   32 o  101.699   5.8021  223.034   22.645  214.450   39.632  227.194   27.593   99.564   9.6511  103.834   6.4430 -4.269417 11.60413 
1 1 1    6   17   33 o   48.721   8.6283   59.851   18.739   78.030   23.184   25.591   31.826   59.963   9.3741   37.479   14.489 22.48480 17.25668 
1 1 1    6   17   34 o   73.904   6.5976  118.876   19.038  120.114   32.593  118.235   23.455   73.531   10.747   74.277   7.6562 -0.7459717 13.19520 
1 1 1    6   17   35 o   45.491   9.9332   51.046   20.560   54.810   27.261   46.079   31.310   47.378   13.369   43.603   14.695 3.775005 19.86639 
1 1 1    6   17   36 o   60.303   7.2629   83.075   17.548   89.228   24.263   76.326   25.410   63.487   9.2660   57.118   11.186 6.368664 14.52571 
1 1 1    6   17   37 o   24.517   7.6277 -18.2288   16.493   17.700   25.125 -45.4317   21.862   32.027   12.725   17.006   8.4145 15.02053 15.25548 
1 1 1    6   17   38 o   31.214   8.6211   18.232   16.121   14.972   23.408   21.173   22.234   30.259   12.194   32.170   12.191 -1.911333 17.24215 
1 1 1    6   17   39 o   34.805   9.4508   23.082   20.545   1.6700   29.405   43.506   28.718   28.477   12.618   41.133   14.073 -12.65597 18.90152 
1 1 1    6   17   40 o   31.061   9.3719   12.733   19.171   18.808   37.125   10.524   22.387   34.222   14.680   27.901   11.655 6.321569 18.74383 
1 1 1    6   17   41 o   37.330   8.4049   34.566   18.071  -3.6587   28.520   60.209   23.359   26.273   11.963   48.387   11.809 -22.11344 16.80981 
1 1 1    6   17   42 o   24.965   7.9681  -1.3594   17.537  -7.7269   25.894   4.0366   23.837   24.071   11.121   25.858   11.414 -1.786427 15.93627 
1 1 1    6   17   43 o   34.473   8.4270   25.881   17.399  -3.7528   24.257   57.286   24.971   23.889   10.937   45.056   12.823 -21.16693 16.85403 
1 1 1    6   17   44 o   22.551   7.5328 -12.3214   18.092  -7.2854   22.728 -21.0320   29.891   22.238   10.325   22.864   10.971 -0.6264858 15.06555 
1 1 1    6   17   45 o   30.596   9.3962   20.989   22.788   4.7759   33.409   35.095   31.162   27.385   12.645   33.808   13.901 -6.422632 18.79244 
1 1 1    6   17   46 o   26.142   8.5138   5.2891   21.094   12.553   31.484  -0.6274   28.413   27.693   12.594   24.590   11.460 3.102360 17.02758 
1 1 1    6   17   47 o   27.521   9.0482   4.9522   23.589   42.050   39.538 -15.5507   29.394   32.897   14.602   22.144   10.690 10.75277 18.09639 
1 1 1    6   18    0 o  311.544   3.6821  2004.95   66.868  2004.95   66.868  2004.95   66.868  311.544   5.2072  311.544   5.2072 0.000000 0.000000 
1 1 1    6   18    1 o  221.759   2.4009  1014.31   21.707  1018.57   33.354  1011.17   28.590  222.151   3.6403  221.367   3.1314 0.7846375 4.801805 
1 1 1    6   18    2 o  106.965   2.6010  222.155   10.829  278.653   19.557  197.172   13.005  116.182   4.0813   97.749   3.2257 18.43267 5.202098 
1 1 1    6   18    3 f  118.355   2.0116  288.661   9.8125  279.793   13.565  298.396   14.212  116.451   2.8242  120.259   2.8653 -3.808136 4.023201 
1 1 1    6   18    4 o  132.166   2.3562  373.567   12.373  457.987   16.843  274.614   18.236  148.989   2.7410  115.343   3.8332 33.64639 4.712374 
1 1 1    6   18    5 f  149.976   2.0468  462.851   12.332  469.618   19.900  458.633   15.712  150.855   3.1984  149.098   2.5550 1.756729 4.093628 
1 1 1    6   18    6 o  348.160   3.0351  2470.85   42.308  2633.33   69.630  2375.75   53.269  357.071   4.7280  339.249   3.8070 17.82254 6.070186 
1 1 1    6   18    7 o  301.702   2.4582  1869.54   30.172  1933.39   47.041  1824.92   39.326  306.037   3.7268  297.367   3.2065 8.670074 4.916335 
1 1 1    6   18    8 o   52.447   2.7022   54.663   5.6855   76.895   8.9678   39.722   7.3519   61.034   3.5625   43.860   4.0641 17.17371 5.404436 
1 1 1    6   18    9 o  157.990   2.2692  519.795   14.229  532.856   17.961  497.783   23.316  160.698   2.7099  155.282   3.6406 5.415482 4.538461 
1 1 1    6   18   10 o  155.400   2.6255  508.141   15.845  528.658   19.595  469.387   26.931  160.051   2.9684  150.749   4.3314 9.302185 5.250966 
1 1 1    6   18   11 o  242.899   2.5081  1211.01   24.113  1193.23   30.021  1243.32   40.476  240.441   3.0273  245.357   3.9997 -4.916214 5.016201 
1 1 1    6   18   12 o  143.593   2.7052  418.364   15.360  400.701   18.988  451.809   26.128  139.313   3.3046  147.873   4.2840 -8.559845 5.410438 
1 1 1    6   18   13 o  142.281   2.4018  419.049   13.560  421.880   17.029  414.142   22.418  142.964   2.8880  141.597   3.8386 1.367050 4.803655 
1 1 1    6   18   14 o  417.075   4.1673  3605.48   70.510  3626.79   91.934  3575.04  109.883  418.719   5.3234  415.432   6.4131 3.287292 8.334596 
1 1 1    6   18   15 o  282.112   2.7011  1650.20   30.572  1671.67   39.087  1616.36   49.064  284.539   3.3306  279.684   4.2533 4.854889 5.402201 
1 1 1    6   18   16 o  445.716   3.5542  4102.08   62.861  4082.98   78.720  4135.69  104.428  444.469   4.2942  446.964   5.6647 -2.495270 7.108390 
1 1 1    6   18   17 o   68.858   5.3865  101.473   13.507  105.103   15.918   92.137   25.527   71.253   5.4166   66.464   9.3122 4.788956 10.77297 
1 1 1    6   18   18 o  156.001   2.7333  502.703   17.481  501.402   23.459  504.328   26.214  155.790   3.6509  156.211   4.0687 -0.4205322 5.466518 
1 1 1    6   18   19 o   50.526   4.2092   51.417   8.4178   47.921   10.371   58.166   14.410   48.110   5.2268   52.942   6.5993 -4.831631 8.418434 
1 1 1    6   18   20 o  119.037   3.0614  284.433   14.031  270.159   16.837  316.877   25.384  114.347   3.5701  123.728   4.9741 -9.381233 6.122737 
1 1 1    6   18   21 o  238.180   2.8286  1174.46   27.640  1189.43   37.353  1156.34   41.092  239.893   3.7752  236.468   4.2133 3.424896 5.657224 
1 1 1    6   18   22 f  169.663   2.6559  598.817   18.024  611.285   22.985  578.906   29.047  172.021   3.2396  167.305   4.2094 4.716431 5.311730 
1 1 1    6   18   23 o   59.554   5.3261   80.982   11.622   98.912   14.987   53.943   18.405   69.093   5.2592   50.014   9.2634 19.07889 10.65224 
1 1 1    6   18   24 o   82.164   4.3830  140.088   14.814  154.536   21.300  126.554   20.615   86.283   5.9854   78.045   6.4045 8.238144 8.765989 
1 1 1    6   18   25 o   83.820   5.0753  137.616   13.184  133.386   14.376  159.982   33.060   80.277   4.3420   87.363   9.1750 -7.086174 10.15059 
1 1 1    6   18   26 o  112.530   3.3063  250.208   14.818  218.846   18.295  310.019   25.266  102.798   4.3151  122.261   5.0105 -19.46381 6.612500 
1 1 1    6   18   27 o   70.999   5.7492   94.733   12.540   89.769   13.590  123.198   32.542   65.763   5.0104   76.235   10.349 -10.47260 11.49846 
1 1 1    6   18   28 o  109.211   3.9407  247.966   17.742  239.038   24.664  257.539   25.541  107.174   5.5796  111.247   5.5665 -4.072670 7.881471 
1 1 1    6   18   29 o  158.587   3.8944  524.690   25.094  527.424   32.842  520.854   38.899  159.230   5.0008  157.944   5.9713 1.285767 7.788704 
1 1 1    6   18   30 o   59.229   8.1973   81.333   18.614   89.947   23.305   66.155   30.935   64.991   8.6943   53.467   13.899 11.52356 16.39462 
1 1 1    6   18   31 o   56.361   7.6774   70.296   17.027   79.324   26.475   63.928   22.234   59.319   11.233   53.402   10.469 5.917255 15.35488 
1 1 1    6   18   32 o   42.814   9.3537   43.015   18.188   34.811   29.937   47.815   22.899   40.212   14.324   45.417   12.032 -5.204922 18.70741 
1 1 1    6   18   33 o   39.181   8.7224   34.905   15.784   31.419   22.355   38.370   22.289   37.564   12.412   40.797   12.258 -3.233250 17.44473 
1 1 1    6   18   34 o   33.621   8.6146   23.710   15.374   22.220   22.789   24.954   20.828   33.273   12.398   33.969   11.964 -0.6967621 17.22910 
1 1 1    6   18   35 o   54.865   8.7416   69.084   18.810   58.831   23.551   87.150   31.262   49.754   11.677   59.977   13.012 -10.22360 17.48316 
1 1 1    6   18   36 o   68.103   6.2359  103.688   17.143  122.586   23.754   83.148   24.764   75.215   7.6571   60.992   9.8445 14.22337 12.47178 
1 1 1    6   18   37 o   36.090   8.7444   30.631   15.793   26.211   23.158   34.474   21.592   34.356   12.551   37.825   12.180 -3.468929 17.48880 
1 1 1    6   18   38 o   36.261   8.7888   31.367   16.057   24.895   23.189   37.328   22.255   33.615   12.510   38.907   12.348 -5.292740 17.57750 
1 1 1    6   18   39 o   62.975   7.9500   94.301   20.142  107.184   30.371   84.186   26.912   67.312   10.939   58.637   11.539 8.675587 15.90009 
1 1 1    6   18   40 o   40.724   8.9564   43.265   18.041   22.650   25.874   62.771   25.168   32.403   12.901   49.045   12.427 -16.64203 17.91280 
1 1 1    6   18   41 o   42.053   8.5788   46.808   15.701   47.590   22.412   46.054   22.003   42.366   12.178   41.739   12.086 0.6270866 17.15756 
1 1 1    6   18   42 o   28.725   7.9927   13.274   16.121 -13.9136   24.480   34.095   21.423   22.029   10.383   35.421   12.154 -13.39270 15.98539 
1 1 1    6   18   43 o   28.214   8.4616   12.924   18.012   24.100   22.579  -6.6359   29.871   31.142   12.158   25.285   11.772 5.857357 16.92313 
1 1 1    6   18   44 o   27.375   8.2953   13.907   16.768  10.0000   23.361   18.059   24.084   26.158   11.430   28.592   12.025 -2.433279 16.59051 
1 1 1    6   18   45 o   29.123   8.9502   16.299   21.372  -6.6774   32.179   34.435   28.589   24.961   11.808   33.284   13.453 -8.322428 17.90046 
1 1 1    6   18   46 o   26.613   8.6184   9.5901   20.984   19.359   32.522   2.6225   27.467   28.651   12.938   24.575   11.389 4.076262 17.23675 
1 1 1    6   19    0 o  506.425   4.2561  5298.25  125.681  5298.25  125.681  5298.25  125.681  506.425   6.0190  506.425   6.0190 0.000000 0.000000 
1 1 1    6   19    1 o  140.685   2.2074  407.053   12.612  416.362   19.737  400.629   16.396  142.031   3.3692  139.339   2.8530 2.692688 4.414876 
1 1 1    6   19    2 f  360.872   3.0987  2684.59   45.512  2719.40   70.525  2659.75   59.578  362.832   4.7127  358.912   4.0247 3.919678 6.197406 
1 1 1    6   19    3 o  183.063   2.2426  686.381   16.686  662.329   21.650  721.571   26.188  179.154   2.9300  186.973   3.3959 -7.819382 4.485196 
1 1 1    6   19    4 o  315.960   2.8700  2036.58   36.399  1958.59   46.023  2166.85   59.481  308.021   3.6227  323.898   4.4525 -15.87711 5.740062 
1 1 1    6   19    5 o  125.432   2.3086  299.418   11.246  255.507   13.434  402.255   20.558  111.271   2.9272  139.592   3.5708 -28.32053 4.617209 
1 1 1    6   19    6 o  115.556   2.1496  270.832   10.141  309.711   15.775  243.447   13.240  122.500   3.1223  108.612   2.9555 13.88773 4.299247 
1 1 1    6   19    7 o  292.982   2.4256  1756.94   28.774  1848.86   45.747  1696.77   37.012  299.244   3.7066  286.721   3.1298 12.52313 4.851264 
1 1 1    6   19    8 o   79.768   2.2170  128.694   7.2138  158.176   11.079  106.994   9.5048   87.541   3.0684   71.995   3.2009 15.54553 4.434073 
1 1 1    6   19    9 o  322.136   3.1895  2156.72   38.624  2174.57   46.079  2114.56   70.822  324.530   3.4426  319.742   5.3703 4.787659 6.379005 
1 1 1    6   19   10 o  210.296   2.4425  913.414   20.825  914.393   27.079  911.997   32.581  210.459   3.1196  210.133   3.7593 0.3264313 4.885085 
1 1 1    6   19   11 o  137.364   3.3071  398.455   17.819  419.702   22.359  361.463   29.502  142.547   3.8030  132.181   5.4115 10.36659 6.614143 
1 1 1    6   19   12 o  137.723   2.3645  385.265   12.874  370.276   15.920  413.590   21.884  133.936   2.8819  141.509   3.7496 -7.572662 4.729086 
1 1 1    6   19   13 o   31.723   5.0948   21.715   6.8470   12.336   9.7881   30.703   9.5815   24.939   8.2118   38.508   6.0328 -13.56952 10.18962 
1 1 1    6   19   14 o  112.126   2.7163  263.705   11.751  271.461   14.399  248.234   20.336  114.669   3.0445  109.583   4.4994 5.086510 5.432681 
1 1 1    6   19   15 o   90.126   2.8276  168.249   10.324  169.988   13.433  165.740   16.136   90.715   3.5903   89.538   4.3693 1.176758 5.655197 
1 1 1    6   19   16 o  136.945   2.4702  384.984   13.436  378.686   16.800  396.163   22.382  135.429   3.0077  138.462   3.9193 -3.032242 4.940359 
1 1 1    6   19   17 o  248.151   3.1329  1260.39   27.722  1247.76   31.910  1299.24   55.974  245.810   3.1475  250.491   5.4178 -4.681366 6.265727 
1 1 1    6   19   18 o  129.571   2.5566  344.722   13.167  338.916   16.477  354.978   21.901  128.104   3.1185  131.039   4.0522 -2.934952 5.113229 
1 1 1    6   19   19 o  278.008   3.2683  1587.87   35.466  1564.96   43.459  1633.54   61.365  275.169   3.8293  280.846   5.2977 -5.677704 6.536695 
1 1 1    6   19   20 o  204.992   2.9181  868.787   24.669  878.708   35.224  859.237   34.559  206.138   4.1430  203.846   4.1105 2.292221 5.836164 
1 1 1    6   19   21 o  121.965   2.7938  304.115   13.531  295.276   16.865  320.083   22.667  119.544   3.4205  124.385   4.4184 -4.840721 5.587636 
1 1 1    6   19   22 o  101.482   3.5965  213.596   15.026  198.716   21.249  228.477   21.250   97.927   5.2611  105.037   4.9051 -7.110390 7.192997 
1 1 1    6   19   23 o  164.851   3.1007  547.599   19.906  519.635   24.146  606.934   35.172  158.539   3.6927  171.163   4.9822 -12.62460 6.201481 
1 1 1    6   19   24 o  103.410   3.5628  226.165   14.874  254.043   19.968  191.416   22.294  110.779   4.3703   96.040   5.6281 14.73949 7.125690 
1 1 1    6   19   25 o  238.537   2.8052  1180.25   26.705  1188.03   33.810  1167.34   43.543  239.695   3.4200  237.378   4.4475 2.316986 5.610391 
1 1 1    6   19   26 o   77.527   4.1775  128.066   12.531  134.401   15.493  116.079   21.312   80.499   4.6663   74.555   6.9306 5.944023 8.355093 
1 1 1    6   19   27 o  126.777   4.3634  333.725   21.528  330.851   26.347  339.498   37.342  126.188   5.0622  127.365   7.1086 -1.176765 8.726898 
1 1 1    6   19   28 o   22.081   6.4514   2.6737   9.9285   10.617   11.162 -27.4133   21.724   24.262   8.7358   19.900   9.4956 4.361832 12.90275 
1 1 1    6   19   29 o   67.178   6.9916  104.958   17.464   71.280   27.076  128.948   22.852   56.120   12.057   78.237   7.0819 -22.11626 13.98311 
1 1 1    6   19   30 o   41.813   8.4432   39.449   15.385   46.584   22.285   32.950   21.266   45.136   11.828   38.489   12.052 6.646473 16.88631 
1 1 1    6   19   31 o   32.090   9.0751   14.357   17.699   18.310   28.960   12.000   22.362   34.366   13.659   29.815   11.952 4.550934 18.15011 
1 1 1    6   19   32 o   53.776   7.4032   65.394   15.822   66.161   22.783   64.679   21.989   54.031   10.602   53.521   10.335 0.5107346 14.80639 
1 1 1    6   19   33 o   42.904   8.5827   43.481   15.819   47.697   23.579   40.030   21.332   44.652   12.375   41.156   11.896 3.496254 17.16533 
1 1 1    6   19   34 o   65.365   6.1504   94.915   16.292   77.681   23.450  110.994   22.650   59.117   9.6176   71.613   7.6687 -12.49625 12.30071 
1 1 1    6   19   35 o   50.618   7.6205   52.860   16.793  107.898   27.232   19.088   21.332   69.717   9.4705   31.519   11.941 38.19829 15.24093 
1 1 1    6   19   36 f   43.376   10.172   46.735   20.446   44.635   25.024   50.954   35.464   42.370   13.041   44.382   15.614 -2.011131 20.34399 
1 1 1    6   19   37 o   26.278   7.6317  -0.2726   15.442 -28.3911   22.733   23.818   21.042   19.662   9.4687   32.895   11.972 -13.23265 15.26348 
1 1 1    6   19   38 o   34.959   9.0658   28.760   17.350   17.815   29.500   34.547   21.452   32.494   13.459   37.424   12.149 -4.930550 18.13154 
1 1 1    6   19   39 o   31.858   8.5833   22.653   15.633   23.207   22.541   22.139   21.701   32.139   12.251   31.577   12.025 0.5621948 17.16660 
1 1 1    6   19   40 o   34.053   8.6269   28.338   15.539   21.133   21.241   36.634   22.791   30.772   11.853   37.334   12.538 -6.561747 17.25376 
1 1 1    6   19   41 f   29.481   8.2835   17.054   15.491   30.114   22.908   6.0481   21.029   33.836   12.464   25.127   10.914 8.708918 16.56701 
1 1 1    6   19   42 o   23.312   7.5231  -3.6632   16.083   0.6917   23.138  -7.7346   22.372   24.408   10.977   22.216   10.290 2.191706 15.04614 
1 1 1    6   19   43 o   25.440   8.1789   2.5315   18.185   2.5619   22.755   2.4776   30.254   24.276   10.905   26.604   12.193 -2.328560 16.35771 
1 1 1    6   19   44 o   29.654   8.7818   17.394   20.330 -14.0669   31.852   39.022   26.410   23.987   11.460   35.320   13.309 -11.33273 17.56353 
1 1 1    6   19   45 o   29.636   9.1517   23.430   21.029   25.185   31.858   22.075   27.994   30.138   13.254   29.135   12.624 1.003569 18.30343 
1 1 1    6   19   46 o   30.711   9.2171   28.943   21.172   12.538   30.691   43.840   29.246   26.869   12.302   34.553   13.729 -7.684011 18.43413 
1 1 1    6   20    0 o  433.724   3.2709  3884.50   82.727  3884.50   82.727  3884.50   82.727  433.724   4.6257  433.724   4.6257 0.000000 0.000000 
1 1 1    6   20    1 o  191.072   2.7689  764.758   21.441  683.802   32.450  827.490   28.565  181.938   4.3244  200.205   3.4594 -18.26651 5.537866 
1 1 1    6   20    2 o  207.060   2.3555  887.318   20.014  860.890   29.595  909.589   27.168  204.200   3.5140  209.920   3.1379 -5.720734 4.711085 
1 1 1    6   20    3 o  153.667   2.1437  488.797   13.483  499.541   18.101  475.403   20.210  155.579   2.8208  151.756   3.2288 3.823334 4.287479 
1 1 1    6   20    4 o  124.029   2.1248  314.089   10.734  297.203   13.959  338.514   16.789  120.001   2.8203  128.056   3.1787 -8.055099 4.249525 
1 1 1    6   20    5 o  263.297   2.3994  1430.31   26.027  1410.13   35.866  1452.76   37.828  261.343   3.3274  265.251   3.4577 -3.908264 4.798717 
1 1 1    6   20    6 o   47.351   2.8895   46.820   5.5318   35.909   7.7666   58.054   7.8810   41.683   4.5176   53.020   3.6039 -11.33784 5.779017 
1 1 1    6   20    7 o  184.551   2.4679  706.366   17.160  695.793   31.382  710.876   20.496  183.511   4.1463  185.591   2.6776 -2.080582 4.935704 
1 1 1    6   20    8 o   57.024   4.7185   68.443   8.3934   69.019   9.2515   65.766   19.955   57.804   3.8805   56.244   8.6022 1.559635 9.436959 
1 1 1    6   20    9 o  145.170   2.5126  418.218   13.444  398.893   15.632  473.105   26.345  139.022   2.7263  151.318   4.2213 -12.29518 5.025167 
1 1 1    6   20   10 o  199.994   3.0668  840.276   24.054  873.756   30.053  780.594   40.125  205.698   3.5424  194.290   5.0073 11.40796 6.133613 
1 1 1    6   20   11 o  202.245   2.3501  848.810   18.964  861.767   24.053  827.526   30.829  204.328   2.8541  200.162   3.7343 4.165985 4.700117 
1 1 1    6   20   12 o  118.318   2.3857  290.503   11.250  294.698   14.242  283.543   18.345  119.481   2.8901  117.154   3.7966 2.326569 4.771431 
1 1 1    6   20   13 o  104.300   2.7843  224.802   11.977  226.076   16.912  223.520   16.965  104.598   3.9203  104.003   3.9548 0.5946808 5.568596 
1 1 1    6   20   14 o  235.984   2.9281  1155.99   27.260  1168.34   34.016  1133.81   45.572  237.833   3.4678  234.134   4.7192 3.699402 5.856257 
1 1 1    6   20   15 o  212.296   2.5899  931.374   22.357  932.498   29.273  929.801   34.633  212.482   3.3403  212.109   3.9588 0.3732910 5.179715 
1 1 1    6   20   16 o  144.607   2.4752  426.688   14.193  413.350   17.648  451.111   23.881  141.481   3.0243  147.734   3.9192 -6.253311 4.950459 
1 1 1    6   20   17 o  124.528   2.5468  322.705   12.639  329.611   16.030  311.360   20.548  126.335   3.0765  122.722   4.0595 3.612450 5.093592 
1 1 1    6   20   18 o   47.208   7.1384   51.789   9.5235   53.480   10.205   40.385   26.499   50.830   4.8679   43.586   13.421 7.244591 14.27681 
1 1 1    6   20   19 o   75.931   3.5008  116.829   10.528  110.752   13.017  128.324   17.901   73.173   4.3131   78.689   5.5155 -5.515854 7.001695 
1 1 1    6   20   20 o  109.791   3.2494  249.461   14.714  249.022   20.872  249.894   20.746  109.694   4.6133  109.888   4.5773 -0.1947403 6.498818 
1 1 1    6   20   21 o  106.359   2.9605  232.213   12.447  227.829   15.460  240.292   20.987  104.988   3.5704  107.729   4.7233 -2.741211 5.920933 
1 1 1    6   20   22 o  129.475   3.6020  350.755   18.892  327.690   29.069  367.619   24.857  125.688   5.6076  133.262   4.5225 -7.573349 7.204024 
1 1 1    6   20   23 o  190.480   3.2219  744.213   24.527  723.110   30.863  780.387   40.408  186.943   4.0028  194.016   5.0496 -7.071976 6.443719 
1 1 1    6   20   24 o   97.171   5.0553  211.658   15.657  221.309   17.552  174.058   34.644  103.386   4.1161   90.957   9.2348 12.42943 10.11058 
1 1 1    6   20   25 o   52.293   5.9938   65.435   11.129   78.061   13.744   41.399   18.963   61.280   5.4380   43.306   10.683 17.97367 11.98756 
1 1 1    6   20   26 o  116.408   4.0485  285.512   19.050  263.231   29.371  301.692   25.029  112.314   6.3404  120.501   5.0360 -8.186989 8.097013 
1 1 1    6   20   27 f  228.394   3.0779  1081.71   28.857  1069.64   38.867  1096.55   43.076  227.045   4.1505  229.743   4.5460 -2.698120 6.155699 
1 1 1    6   20   28 o   80.748   4.5482  142.290   13.403  149.405   15.892  124.763   24.942   84.739   4.5471   76.758   7.8784 7.980911 9.096422 
1 1 1    6   20   29 f  112.153   3.3836  260.177   14.781  255.728   18.070  269.174   25.698  110.921   3.9498  113.386   5.4950 -2.464417 6.767294 
1 1 1    6   20   30 o   31.575   6.6756   23.973   9.6976   29.787   11.125   5.5783   19.789   36.762   7.5889   26.388   10.985 10.37325 13.35116 
1 1 1    6   20   31 o   39.033   6.4260   43.688   10.907   56.130   12.360  -0.0861   23.183   51.646   5.8024   26.420   11.468 25.22593 12.85192 
1 1 1    6   20   32 o   79.169   5.0303  134.359   16.422  131.139   22.987  137.716   23.470   78.195   7.1274   80.144   7.1003 -1.948479 10.06052 
1 1 1    6   20   33 f   27.663   7.8375   3.0697   14.697   26.406   22.701 -13.7702   19.284   34.878   12.468   20.449   9.4999 14.42926 15.67506 
1 1 1    6   20   34 o   46.892   7.8535   52.819   14.993   43.533   22.739   59.960   19.941   42.595   12.273   51.189   9.8022 -8.593479 15.70697 
1 1 1    6   20   35 o   58.152   7.8272   85.310   17.485   55.751   27.581  105.172   22.609   47.016   13.508   69.289   7.9114 -22.27326 15.65448 
1 1 1    6   20   36 o   35.516   9.3129   24.868   17.987   14.215   22.721   42.752   29.440   29.733   12.002   41.299   14.243 -11.56666 18.62589 
1 1 1    6   20   37 o   27.402   8.0542   8.8128   15.338   0.2731   22.390   16.364   21.055   25.132   11.079   29.671   11.693 -4.539888 16.10840 
1 1 1    6   20   38 o   34.091   9.1710   26.421   18.550   13.037   28.401   36.378   24.498   30.453   12.945   37.729   12.994 -7.276224 18.34198 
1 1 1    6   20   39 o   74.606   5.4403  125.551   16.668  115.316   23.858  135.309   23.296   71.278   8.1155   77.935   7.2474 -6.657005 10.88054 
1 1 1    6   20   40 o   24.208   7.5945   1.6527   15.106   2.0998   20.998   1.1733   21.747   24.170   10.689   24.245   10.792 -0.7552338E-01 15.18905 
1 1 1    6   20   41 o   20.902   6.9240 -11.7801   14.827  -7.0132   22.424 -15.4830   19.764   22.413   10.353   19.390   9.1964 3.022894 13.84792 
1 1 1    6   20   42 o   23.923   7.6698  -0.5205   16.421  -4.8877   23.477   3.6628   22.977   23.052   10.629   24.794   11.060 -1.741909 15.33952 
1 1 1    6   20   43 o   32.651   9.0156   31.030   17.975   22.078   28.855   36.707   22.978   30.225   12.953   35.077   12.544 -4.851801 18.03125 
1 1 1    6   20   44 f   22.136   7.5411 -23.4827   20.431   2.7040   30.207 -45.5626   27.738   25.715   11.927   18.556   9.2316 7.159201 15.08229 
1 1 1    6   20   45 f   32.303   8.8636   24.466   21.508 -25.5050   31.749   66.852   29.240   21.699   10.617   42.907   14.196 -21.20717 17.72724 
1 1 1    6   21    0 o  241.988   2.2988  1208.95   32.434  1208.95   32.434  1208.95   32.434  241.988   3.2510  241.988   3.2510 0.000000 0.000000 
1 1 1    6   21    1 o  172.067   2.6067  615.395   17.274  600.427   30.290  622.609   21.028  170.460   4.3084  173.674   2.9357 -3.214462 5.213448 
1 1 1    6   21    2 o  263.582   2.3906  1434.45   25.986  1429.41   36.484  1439.65   37.023  263.113   3.3620  264.050   3.3995 -0.9374390 4.781174 
1 1 1    6   21    3 o  119.730   2.1123  296.699   10.366  303.535   13.993  288.385   15.431  121.269   2.7976  118.190   3.1656 3.079185 4.224655 
1 1 1    6   21    4 o   91.120   2.0932  171.527   7.8587  175.206   10.944  167.610   11.292   92.132   2.8801   90.108   3.0384 2.023849 4.186469 
1 1 1    6   21    5 o  148.033   2.1530  455.150   13.020  475.770   17.496  429.557   19.491  151.826   2.7940  144.241   3.2763 7.584961 4.305912 
1 1 1    6   21    6 o  188.840   2.2853  733.500   17.636  755.932   27.002  716.810   23.291  191.335   3.4216  186.344   3.0304 4.991119 4.570649 
1 1 1    6   21    7 o  269.457   2.6164  1501.08   29.036  1410.74   41.093  1591.16   41.035  261.340   3.8124  277.575   3.5843 -16.23511 5.232729 
1 1 1    6   21    8 o  154.681   2.5828  492.067   15.561  487.847   19.051  500.525   26.972  153.727   3.0047  155.634   4.2019 -1.907684 5.165631 
1 1 1    6   21    9 o  126.782   3.7224  329.338   19.359  301.676   25.792  365.032   29.298  120.751   5.1787  132.812   5.3485 -12.06136 7.444848 
1 1 1    6   21   10 o  116.955   2.3632  286.697   11.105  303.616   14.429  262.115   17.393  121.272   2.8848  112.638   3.7439 8.634171 4.726388 
1 1 1    6   21   11 o  238.234   2.4923  1166.61   23.442  1152.81   29.117  1192.05   39.524  236.295   2.9876  240.173   3.9900 -3.877701 4.984550 
1 1 1    6   21   12 o  181.856   2.3441  678.740   16.848  668.366   20.935  697.809   28.383  179.932   2.8209  183.779   3.7445 -3.846527 4.688136 
1 1 1    6   21   13 o   68.512   3.0348   95.294   8.3050   90.403   10.393  103.933   13.813   66.143   3.8098   70.881   4.7250 -4.738251 6.069605 
1 1 1    6   21   14 o   38.019   4.4209   31.243   6.5862   38.214   9.1088   23.606   9.5344   42.963   5.1405   33.075   7.1940 9.887630 8.841823 
1 1 1    6   21   15 o   82.595   3.2107  141.837   10.880  128.114   15.626  154.751   15.158   78.681   4.8152   86.508   4.2483 -7.827164 6.421395 
1 1 1    6   21   16 o  155.389   2.8911  499.851   18.505  482.385   26.545  516.363   25.810  152.732   4.2139  158.045   3.9595 -5.313095 5.782213 
1 1 1    6   21   17 o  208.761   2.6919  895.800   22.937  867.523   30.121  934.826   35.386  204.892   3.5643  212.630   4.0350 -7.737991 5.383810 
1 1 1    6   21   18 o  148.515   3.4176  447.832   16.811  442.020   18.765  471.469   37.842  146.287   3.1100  150.743   6.0866 -4.455475 6.835127 
1 1 1    6   21   19 o   59.768   4.0630   77.448   9.4988   87.994   12.222   61.358   15.095   65.205   4.5445   54.332   6.7364 10.87287 8.125976 
1 1 1    6   21   20 o  114.693   3.9815  279.243   14.722  283.270   16.405  262.592   33.360  117.077   3.3974  112.309   7.2019 4.768585 7.962983 
1 1 1    6   21   21 o   83.491   3.3745  141.657   11.139  135.257   13.762  153.819   18.971   80.854   4.1267   86.128   5.3403 -5.274467 6.749008 
1 1 1    6   21   22 o   42.394   10.772   25.619   14.707   49.816   53.200   23.617   15.303   51.414   18.985   33.373   10.186 18.04190 21.54473 
1 1 1    6   21   23 o  126.601   3.3609  332.520   17.537  327.761   25.168  337.010   24.449  125.706   4.8544  127.497   4.6495 -1.791603 6.721813 
1 1 1    6   21   24 o   63.511   4.3192   82.837   10.757   80.246   13.201   87.959   18.557   62.149   5.1499   64.872   6.9355 -2.723614 8.638381 
1 1 1    6   21   25 o   82.294   3.8599  142.753   12.580  147.963   15.895  134.018   20.582   84.440   4.5641   80.148   6.2262 4.292442 7.719851 
1 1 1    6   21   26 o   61.894   4.5402   78.563   10.844   75.658   13.081   84.947   19.389   60.257   5.2634   63.531   7.3994 -3.273331 9.080491 
1 1 1    6   21   27 o   34.863   6.7658   18.104   9.4854   8.8375   10.816   48.969   19.740   22.965   8.5441   46.760   10.493 -23.79450 13.53170 
1 1 1    6   21   28 o  102.541   5.0787  243.051   16.114  255.722   17.974  191.144   36.379  110.916   3.9290   94.166   9.3668 16.74954 10.15746 
1 1 1    6   21   29 o  101.971   4.0691  218.500   17.104  229.163   24.486  208.340   23.901  104.423   5.6854   99.520   5.8228 4.902664 8.138108 
1 1 1    6   21   30 o   45.433   6.3706   46.407   10.716   47.873   12.815   42.997   19.544   47.566   6.5320   43.300   10.939 4.265774 12.74117 
1 1 1    6   21   31 o   84.756   3.9045  148.152   12.606  142.666   15.045  161.077   23.094   82.542   4.4193   86.970   6.4382 -4.427940 7.808995 
1 1 1    6   21   32 o   69.918   5.5384  106.005   15.943  105.374   23.193  106.570   21.952   69.612   8.0779   70.224   7.5792 -0.6111908 11.07690 
1 1 1    6   21   33 o   38.299   6.9766   32.329   9.8006   31.166   11.148   36.286   20.565   37.402   7.4878   39.195   11.774 -1.793125 13.95318 
1 1 1    6   21   34 o   54.377   5.5324   60.135   10.826   55.744   12.385   74.354   22.286   51.136   5.8723   57.619   9.3780 -6.482895 11.06481 
1 1 1    6   21   35 o   18.219   6.2907 -35.4539   15.378 -29.4625   22.727 -40.5135   20.885   19.526   9.4194   16.912   8.3408 2.614632 12.58148 
1 1 1    6   21   36 o   19.756   6.6449 -21.4368   14.574 -13.6718   22.227 -27.2922   19.301   21.847   10.166   17.664   8.5597 4.183104 13.28973 
1 1 1    6   21   37 o   21.855   7.1571 -12.5107   15.374  -4.4675   22.297 -19.8002   21.227   23.727   10.714   19.983   9.4930 3.743988 14.31429 
1 1 1    6   21   38 o   44.228   8.4444   50.818   15.871   44.266   22.435   57.383   22.456   41.062   12.289   47.395   11.585 -6.333557 16.88887 
1 1 1    6   21   39 o   23.717   7.4522  -0.6022   14.762   7.4804   21.336  -8.0250   20.446   25.922   11.124   21.512   9.9191 4.410555 14.90444 
1 1 1    6   21   40 o   22.845   7.2723  -1.0864   14.423   1.1811   20.293  -3.4006   20.501   23.372   10.412   22.319   10.155 1.053009 14.54451 
1 1 1    6   21   41 o   30.168   8.3652   21.910   15.183   19.126   21.061   24.922   21.908   29.037   11.613   31.300   12.043 -2.263618 16.73042 
1 1 1    6   21   42 o   28.574   8.3920   17.961   16.401   25.702   23.892   11.063   22.554   30.955   12.373   26.194   11.340 4.761078 16.78393 
1 1 1    6   21   43 o   24.013   7.7979  -1.3429   18.180 -17.7457   28.284   10.203   23.731   22.103   10.623   25.922   11.418 -3.818592 15.59589 
1 1 1    6   21   44 o   27.649   9.3537  -6.9400   25.947 -30.9633   30.728   52.753   48.437   20.863   10.256   34.436   15.646 -13.57377 18.70744 
1 1 1    6   22    0 o   76.771   2.4078  122.340   10.734  122.340   10.734  122.340   10.734   76.771   3.4051   76.771   3.4051 0.000000 0.000000 
1 1 1    6   22    1 o   84.766   2.8468  145.573   8.8581  154.775   17.232  142.268   10.327   86.516   4.8292   83.015   3.0161 3.501129 5.693668 
1 1 1    6   22    2 o  198.760   2.1324  815.299   17.478  834.827   24.964  796.523   24.479  201.094   3.0099  196.426   3.0215 4.668304 4.264877 
1 1 1    6   22    3 o   82.556   2.2024  141.938   7.4339  155.277   10.207  126.868   10.849   86.731   2.8533   78.382   3.3558 8.349174 4.404881 
1 1 1    6   22    4 o  232.015   2.2584  1111.60   21.609  1124.35   30.486  1098.73   30.634  233.354   3.1675  230.675   3.2199 2.678268 4.516746 
1 1 1    6   22    5 o   32.772   3.7425   21.786   4.7836   31.936   7.5015   14.829   6.2101   39.299   4.6280   26.244   5.8827 13.05488 7.484990 
1 1 1    6   22    6 o   75.362   2.4450  118.164   7.5438  106.768   10.984  128.337   10.379   71.889   3.7046   78.835   3.1919 -6.945824 4.890015 
1 1 1    6   22    7 o  146.184   2.1902  440.675   13.149  447.301   19.586  435.238   17.741  147.175   3.2267  145.193   2.9625 1.982498 4.380400 
1 1 1    6   22    8 o  130.118   2.6938  349.485   14.457  349.485   14.457   0.0000   0.0000  130.118   2.6938  ?   ?       ?      ? 
1 1 1    6   22    9 o  319.846   3.4121  2087.30   40.794  2048.92   48.162  2184.75   76.740  314.917   3.7081  324.776   5.7289 -9.858582 6.824248 
1 1 1    6   22   10 o  208.060   2.5071  888.903   21.150  866.061   27.338  922.958   33.380  204.781   3.2368  211.339   3.8295 -6.558167 5.014151 
1 1 1    6   22   11 o   42.056   3.3419   37.169   5.6417   47.322   8.0223   27.235   7.9356   47.845   4.0653   36.266   5.3053 11.57918 6.683833 
1 1 1    6   22   12 o  134.603   2.7423  372.196   15.121  315.466   20.596  438.533   22.272  123.531   4.0424  145.675   3.7068 -22.14413 5.484670 
1 1 1    6   22   13 o   29.832   4.6915   19.408   5.6456   22.977   7.8255   15.535   8.1528   32.782   6.0092   26.882   7.2062 5.899778 9.382934 
1 1 1    6   22   14 o  148.801   2.3985  451.031   14.134  435.413   17.534  480.012   23.885  145.208   2.9277  152.393   3.8000 -7.185394 4.797010 
1 1 1    6   22   15 o  171.453   2.5705  606.494   17.938  601.300   23.491  613.759   27.783  170.602   3.3385  172.303   3.9095 -1.700516 5.140997 
1 1 1    6   22   16 o  219.670   2.8888  997.547   26.167  969.432   36.677  1026.70   37.345  216.515   4.1071  222.825   4.0635 -6.309662 5.777597 
1 1 1    6   22   17 o  252.302   3.4475  1313.60   34.340  1302.66   42.690  1333.66   57.804  250.965   4.1243  253.640   5.5255 -2.674835 6.894985 
1 1 1    6   22   18 o  100.017   3.9278  211.413   15.842  164.199   22.772  255.690   22.053   88.919   6.2093  111.115   4.8120 -22.19583 7.855590 
1 1 1    6   22   19 o  115.968   4.5046  274.128   21.190  252.109   27.182  308.236   33.831  110.197   5.9807  121.738   6.7378 -11.54125 9.009233 
1 1 1    6   22   20 o  152.790   2.7623  480.407   17.128  469.158   22.198  496.959   26.927  150.631   3.5731  154.949   4.2135 -4.318512 5.524504 
1 1 1    6   22   21 o  126.910   2.8199  334.432   14.333  337.877   18.262  328.904   23.129  127.821   3.4639  125.998   4.4508 1.823425 5.639879 
1 1 1    6   22   22 o   44.756   5.1986   38.574   8.9406   30.702   10.761   56.122   16.066   37.727   7.1777   51.786   7.5220 -14.05841 10.39713 
1 1 1    6   22   23 o   88.744   3.9811  162.958   14.516  174.546   21.719  153.604   19.514   91.561   5.7512   85.927   5.5063 5.634094 7.962124 
1 1 1    6   22   24 f  167.729   2.7397  580.192   18.278  572.720   22.921  593.244   30.292  166.355   3.3407  169.103   4.3432 -2.748611 5.479381 
1 1 1    6   22   25 o   63.602   4.1565   82.468   10.496   77.226   12.999   92.290   17.794   60.868   5.1778   66.337   6.5035 -5.468384 8.312942 
1 1 1    6   22   26 o  101.488   3.3789  215.660   13.465  218.123   16.720  211.115   22.710  102.481   3.9558  100.495   5.4791 1.985390 6.757886 
1 1 1    6   22   27 o   33.825   6.7792   27.474   9.7326   31.944   11.215   13.842   19.587   38.204   7.3847   29.446   11.371 8.758280 13.55847 
1 1 1    6   22   28 f   28.417   6.4814   18.236   8.9596   23.352   10.304   2.3865   18.139   32.445   7.7971   24.388   10.356 8.057121 12.96290 
1 1 1    6   22   29 o   21.300   6.5082   1.2955   8.7221   1.6562   9.7685  -0.1226   19.370   18.327   7.6805   24.273   10.509 -5.946272 13.01638 
1 1 1    6   22   30 o   50.647   5.9594   46.517   11.021   34.433   12.661   84.334   22.396   39.210   8.0969   62.084   8.7464 -22.87391 11.91887 
1 1 1    6   22   31 o  126.554   4.6094  338.633   22.172  333.291   26.562  350.907   40.264  125.756   5.1211  127.351   7.6656 -1.594994 9.218860 
1 1 1    6   22   32 o   31.913   8.2575   19.802   14.809   8.5484   21.579   29.821   20.361   27.786   11.511   36.040   11.843 -8.253407 16.51499 
1 1 1    6   22   33 o   59.327   5.0897   73.857   11.253   70.749   13.220   82.034   21.442   57.710   5.5542   60.944   8.5305 -3.234215 10.17932 
1 1 1    6   22   34 f   18.842   5.9145  -2.5828   9.1144   4.3525   10.263 -28.4762   19.830   19.767   8.0353   17.918   8.6810 1.849606 11.82905 
1 1 1    6   22   35 o   27.747   5.9553   17.578   9.9234   30.635   11.373 -24.0839   20.315   36.672   7.7610   18.822   9.0348 17.85016 11.91054 
1 1 1    6   22   36 o   50.636   6.8134   70.736   11.908   82.826   13.977   38.738   22.739   62.201   5.4484   39.071   12.490 23.13011 13.62687 
1 1 1    6   22   37 o   31.350   8.4438   22.566   11.316   25.148   11.551 -38.8342   56.331   32.608   8.5015   30.092   14.592 2.516489 16.88764 
1 1 1    6   22   38 o   38.041   8.6386   38.351   15.371   39.053   21.385   37.600   22.108   38.434   12.094   37.647   12.339 0.7869377 17.27712 
1 1 1    6   22   39 f   31.387   8.4083   24.555   14.944   22.969   20.628   26.308   21.680   30.678   11.714   32.096   12.066 -1.418644 16.81661 
1 1 1    6   22   40 o   58.745   6.4321   83.221   15.137   94.359   21.753   72.764   21.077   63.446   8.3128   54.043   9.8176 9.403336 12.86420 
1 1 1    6   22   41 o   35.196   9.0434   36.862   16.987   38.178   23.067   35.304   25.109   35.912   12.595   34.481   12.981 1.431614 18.08683 
1 1 1    6   22   42 o   36.257   9.2090   41.053   17.458   40.964   27.249   41.115   22.738   35.731   13.506   36.783   12.522 -1.052433 18.41808 
1 1 1    6   22   43 o   27.841   8.8343   15.523   20.811   22.959   31.958   10.047   27.424   29.519   13.114   26.163   11.841 3.356344 17.66865 
1 1 1    6   22   44 o   27.625   9.2091   11.109   26.025   10.812   31.335   11.768   46.727   26.640   12.282   28.610   13.725 -1.969172 18.41824 
1 1 1    6   23    0 o  122.310   2.0362  309.186   14.508  309.186   14.508  309.186   14.508  122.310   2.8796  122.310   2.8796 0.000000 0.000000 
1 1 1    6   23    1 o   79.659   2.3941  131.353   7.7415  129.371   12.020  132.758   10.120   79.134   3.6829   80.185   3.0599 -1.051331 4.788158 
1 1 1    6   23    2 o  114.748   2.4019  269.661   11.247  257.216   14.722  287.102   17.428  111.606   3.1984  117.891   3.5843 -6.285240 4.803856 
1 1 1    6   23    3 o   98.707   2.4092  195.211   9.6578  165.317   12.434  240.677   15.334   89.467   3.3696  107.946   3.4442 -18.47890 4.818335 
1 1 1    6   23    4 o  180.059   2.0817  669.555   15.454  676.529   21.621  662.271   22.097  181.022   2.8958  179.097   2.9914 1.924438 4.163438 
1 1 1    6   23    5 o  259.604   2.5577  1391.85   27.182  1396.14   41.051  1388.49   36.274  259.933   3.8291  259.276   3.3921 0.6572876 5.115476 
1 1 1    6   23    6 o  109.467   2.1871  245.870   9.8390  266.496   14.696  229.112   13.246  113.600   3.1365  105.335   3.0490 8.264847 4.374199 
1 1 1    6   23    7 o  122.751   2.1565  309.438   10.881  331.861   16.226  291.117   14.667  126.767   3.1035  118.736   2.9950 8.030884 4.312979 
1 1 1    6   23    8 o   63.044   3.3448   81.878   8.3321   80.999   10.362   83.486   14.014   62.596   4.0137   63.491   5.3517 -0.8943863 6.689611 
1 1 1    6   23    9 o  262.285   3.5367  1413.14   37.800  1357.47   49.343  1492.20   58.809  256.144   4.6707  268.425   5.3119 -12.28143 7.073312 
1 1 1    6   23   10 o  207.362   2.9114  878.734   21.051  869.915   23.980  908.362   43.951  205.260   2.8325  209.463   5.0874 -4.202713 5.822786 
1 1 1    6   23   11 o  154.871   2.4431  495.306   15.429  493.977   20.337  497.109   23.684  154.647   3.1885  155.094   3.7025 -0.4468689 4.886231 
1 1 1    6   23   12 o  117.810   3.3485  279.704   13.567  273.810   15.326  301.039   29.161  115.132   3.2276  120.489   5.8679 -5.357323 6.697015 
1 1 1    6   23   13 o  257.683   4.0590  1396.83   31.037  1405.91   33.785  1347.67   78.574  260.893   3.1397  254.474   7.4863 6.418411 8.118047 
1 1 1    6   23   14 o  159.053   2.5278  516.457   16.311  489.802   21.011  556.887   25.877  153.974   3.3085  164.131   3.8226 -10.15628 5.055595 
1 1 1    6   23   15 o  155.504   2.8374  499.986   18.179  502.062   26.339  498.097   25.123  155.803   4.0988  155.206   3.9246 0.5975037 5.674726 
1 1 1    6   23   16 o  142.975   2.6379  420.269   15.342  408.944   19.979  436.545   23.950  140.668   3.4436  145.283   3.9970 -4.615067 5.275806 
1 1 1    6   23   17 o  136.781   3.0456  388.173   17.136  366.811   24.681  408.053   23.809  133.117   4.4954  140.444   4.1103 -7.327454 6.091272 
1 1 1    6   23   18 o   56.761   3.7530   65.943   8.6229   62.514   11.051   71.280   13.787   54.925   4.8782   58.598   5.7047 -3.672363 7.506030 
1 1 1    6   23   19 o  117.715   2.7341  287.487   12.836  289.738   16.241  283.743   20.953  118.383   3.3263  117.048   4.3402 1.334396 5.468252 
1 1 1    6   23   20 o   33.048   7.8387   20.419   9.0234   20.718   9.4985   17.648   28.891   30.872   7.5276   35.223   13.752 -4.351233 15.67737 
1 1 1    6   23   21 o  126.260   3.4359  332.340   17.687  320.994   26.881  341.003   23.488  124.283   5.2441  128.237   4.4409 -3.953987 6.871845 
1 1 1    6   23   22 o  110.921   3.5625  252.029   16.182  221.062   21.472  292.742   24.620  103.144   5.0473  118.698   5.0290 -15.55347 7.125066 
1 1 1    6   23   23 o   81.508   4.2956  142.142   14.063  109.868   20.468  170.997   19.354   72.388   6.8557   90.629   5.1777 -18.24048 8.591203 
1 1 1    6   23   24 o   84.214   4.1011  148.320   14.194  148.583   20.983  148.099   19.271   84.233   6.0399   84.196   5.5495 0.3730774E-01 8.202221 
1 1 1    6   23   25 o   36.418   7.5633   29.653   12.020   27.105   19.078   31.330   15.479   35.403   11.454   37.434   9.8809 -2.030983 15.12668 
1 1 1    6   23   26 o   80.653   3.8080  140.450   12.038  151.854   15.242  121.545   19.626   85.365   4.3292   75.942   6.2659 9.422928 7.615995 
1 1 1    6   23   27 o   41.198   6.1579   40.744   9.5024   46.128   11.378   28.333   17.276   46.814   5.8929   35.581   10.814 11.23283 12.31576 
1 1 1    6   23   28 o   38.206   6.6762   30.179   9.6007   26.299   11.239   40.654   18.467   34.333   8.0726   42.079   10.636 -7.745750 13.35230 
1 1 1    6   23   29 o   77.242   5.7128  111.557   12.839  104.852   13.744  157.493   35.975   70.675   4.7149   83.809   10.407 -13.13393 11.42562 
1 1 1    6   23   30 o   51.449   6.6505   69.973   11.326   80.052   13.131   40.690   22.382   61.614   5.1672   41.283   12.256 20.33138 13.30109 
1 1 1    6   23   31 o   30.611   7.1263   17.325   9.0902   13.887   10.317   29.254   19.219   25.551   8.4317   35.672   11.491 -10.12073 14.25267 
1 1 1    6   23   32 o   63.151   4.7045   80.407   11.284   72.692   13.299  100.244   21.324   58.500   5.5117   67.801   7.6256 -9.300983 9.408965 
1 1 1    6   23   33 o   42.038   8.1583   42.899   14.595   46.163   20.842   39.759   20.445   43.622   11.442   40.453   11.632 3.168724 16.31670 
1 1 1    6   23   34 o   58.223   6.0010   77.486   11.900   78.551   13.770   74.342   23.650   60.646   5.5052   55.799   10.665 4.847725 12.00208 
1 1 1    6   23   35 o   45.291   6.4366   41.516   10.344   34.599   11.835   63.910   21.294   38.982   7.6341   51.601   10.365 -12.61957 12.87320 
1 1 1    6   23   36 o   21.513   6.6692   1.3682   9.3706   0.5273   10.519   4.6011   20.625   17.948   7.7574   25.078   10.851 -7.130180 13.33843 
1 1 1    6   23   37 o   37.675   7.7046   36.283   11.099   37.195   12.194   31.880   26.793   40.107   7.6508   35.243   13.376 4.863873 15.40912 
1 1 1    6   23   38 o   67.896   4.8392  101.034   12.174   97.871   14.312  109.311   23.155   67.213   5.1628   68.579   8.1863 -1.365608 9.678379 
1 1 1    6   23   39 o   52.617   6.4944   68.620   11.710   70.559   13.616   63.117   22.944   56.645   5.8282   48.589   11.608 8.055561 12.98876 
1 1 1    6   23   40 o   53.135   6.7781   78.615   12.064   87.573   14.096   54.095   23.321   63.112   5.4152   43.158   12.428 19.95367 13.55615 
1 1 1    6   23   41 o   26.075   8.0939   7.9365   17.032  -3.3206   23.366   20.699   24.879   22.880   10.569   29.270   12.261 -6.389812 16.18775 
1 1 1    6   23   42 o   21.199   6.5048   4.1211   11.060   12.049   12.310 -29.0738   25.189   23.240   9.0033   19.158   9.3911 4.081678 13.00970 
1 1 1    6   23   43 o   21.763   7.5240 -25.8037   22.366 -39.4659   31.049 -11.0689   32.245   20.010   9.9231   23.516   11.312 -3.505938 15.04793 
1 1 1    6   24    0 o   70.628   2.8445  103.991   11.631  103.991   11.631  103.991   11.631   70.628   4.0227   70.628   4.0227 0.000000 0.000000 
1 1 1    6   24    1 o  120.571   2.1870  301.047   10.748  294.688   16.422  305.811   14.215  119.440   3.3336  121.702   2.8319 -2.261551 4.374053 
1 1 1    6   24    2 o  158.872   2.3101  519.807   15.114  491.914   20.703  551.641   22.117  154.323   3.2526  163.421   3.2814 -9.098236 4.620252 
1 1 1    6   24    3 o   97.330   2.1533  196.322   8.5806  201.893   11.553  189.467   12.814   98.885   2.8327   95.776   3.2440 3.109436 4.306693 
1 1 1    6   24    4 o  216.922   2.1998  971.968   19.678  986.253   27.718  957.451   27.941  218.533   3.0752  215.311   3.1464 3.221771 4.399628 
1 1 1    6   24    5 o  174.985   2.2267  633.245   16.040  616.385   23.227  648.615   22.177  172.746   3.2600  177.224   3.0340 -4.477905 4.453460 
1 1 1    6   24    6 o  182.649   3.3676  671.138   20.093  722.214   46.313  659.295   22.302  186.622   6.0170  178.676   3.0262 7.945541 6.735127 
1 1 1    6   24    7 o  179.791   2.8129  669.869   20.780  647.036   30.434  689.810   28.442  176.892   4.1715  182.690   3.7746 -5.798080 5.625723 
1 1 1    6   24    8 o  185.074   4.1991  708.346   32.053  708.346   32.053   0.0000   0.0000  185.074   4.1991  ?   ?       ?      ? 
1 1 1    6   24    9 f  125.654   3.3642  330.141   15.428  334.089   18.080  319.568   29.587  127.158   3.4474  124.149   5.7782 3.009682 6.728467 
1 1 1    6   24   10 o  223.182   3.2438  992.546   27.846  930.760   33.310  1135.92   50.742  212.196   3.8060  234.168   5.2538 -21.97244 6.487556 
1 1 1    6   24   11 o  203.145   3.5830  855.270   29.998  879.444   42.045  830.205   42.813  206.091   4.9464  200.198   5.1850 5.892334 7.165981 
1 1 1    6   24   12 o  199.743   2.5433  828.659   20.782  861.131   27.999  788.825   31.011  204.153   3.3252  195.332   3.8492 8.821579 5.086577 
1 1 1    6   24   13 o   81.684   4.6359  140.448   12.646  141.749   14.237  135.583   27.525   82.778   4.1701   80.590   8.2810 2.188377 9.271702 
1 1 1    6   24   14 o  110.306   2.4610  250.062   10.889  245.529   13.811  257.508   17.701  109.020   3.0716  111.593   3.8459 -2.572830 4.921925 
1 1 1    6   24   15 o  148.686   2.6629  452.515   16.156  427.575   21.122  487.682   25.081  143.819   3.5608  153.552   3.9603 -9.732910 5.325753 
1 1 1    6   24   16 o  168.744   2.4521  596.090   16.505  620.074   21.075  558.052   26.541  173.246   2.9495  164.241   3.9180 9.005234 4.904124 
1 1 1    6   24   17 o  125.694   2.8996  327.527   14.515  328.877   18.310  325.243   23.813  126.106   3.5203  125.282   4.6085 0.8245697 5.799206 
1 1 1    6   24   18 o  164.784   2.7032  560.991   18.264  552.962   24.456  571.117   27.464  163.483   3.6270  166.085   4.0093 -2.602097 5.406457 
1 1 1    6   24   19 o  176.431   2.7953  640.256   20.180  611.658   26.661  678.613   30.877  171.886   3.7607  180.975   4.1367 -9.089508 5.590641 
1 1 1    6   24   20 o   47.034   4.1796   45.596   7.9079   43.947   10.043   48.285   12.828   45.974   5.2966   48.093   6.4670 -2.118797 8.359167 
1 1 1    6   24   21 o   59.427   8.9538   78.828   12.289   79.115   12.803   75.466   43.805   61.685   5.0324   57.169   17.186 4.516273 17.90759 
1 1 1    6   24   22 f  116.337   2.9028  281.545   13.393  283.022   16.805  278.975   22.173  116.865   3.4865  115.809   4.6420 1.055939 5.805541 
1 1 1    6   24   23 o  130.351   2.8805  351.306   15.145  345.040   19.404  361.075   24.227  128.966   3.6479  131.736   4.4588 -2.769989 5.760904 
1 1 1    6   24   24 o   58.051   5.2680   72.769   12.288   64.615   18.992   78.640   16.116   54.990   8.3738   61.112   6.3941 -6.121307 10.53591 
1 1 1    6   24   25 o   85.312   3.4544  153.902   11.682  158.828   14.764  145.654   19.106   87.332   4.0988   83.292   5.5617 4.040070 6.908886 
1 1 1    6   24   26 o   74.746   4.9021  121.646   14.625   90.153   21.167  150.410   20.230   64.928   7.9044   84.564   5.8001 -19.63633 9.804148 
1 1 1    6   24   27 o   46.782   5.0996   42.857   9.1566   33.659   11.016   63.422   16.471   39.155   7.0818   54.409   7.3397 -15.25405 10.19920 
1 1 1    6   24   28 o  129.588   3.2546  354.025   17.227  366.665   23.082  338.131   25.884  132.384   4.2274  126.793   4.9496 5.591476 6.509226 
1 1 1    6   24   29 o   56.869   5.6228   72.747   11.446   75.241   13.644   66.823   21.028   59.626   5.5479   54.112   9.7817 5.514248 11.24552 
1 1 1    6   24   30 o   40.623   8.2699   32.574   10.287   30.814   10.870   47.688   31.852   37.229   7.3398   44.017   14.822 -6.787823 16.53975 
1 1 1    6   24   31 o   36.229   6.9128   28.115   9.5455   25.116   11.044   36.974   18.981   33.187   8.1319   39.270   11.181 -6.083515 13.82566 
1 1 1    6   24   32 o   53.183   5.3461   60.152   10.627   57.899   12.529   65.935   20.067   52.064   5.8344   54.302   8.9601 -2.237362 10.69226 
1 1 1    6   24   33 o   34.756   7.3461   26.478   13.881  -1.4655   20.545   49.947   18.829   23.772   10.540   45.741   10.236 -21.96877 14.69225 
1 1 1    6   24   34 o   26.612   6.1377   15.398   9.8340   26.779   11.336 -19.2140   19.769   33.980   8.1858   19.244   9.1475 14.73571 12.27532 
1 1 1    6   24   35 o   76.961   5.5827  133.389   17.642  134.272   26.197  132.656   23.866   76.885   8.2611   77.038   7.5113 -0.1533508 11.16539 
1 1 1    6   24   36 o   38.725   6.9421   40.341   11.051   45.889   12.811   24.210   21.844   45.494   6.8274   31.956   12.090 13.53817 13.88414 
1 1 1    6   24   37 f   38.270   7.1516   38.397   10.809   40.217   12.550   33.171   21.272   41.479   7.6166   35.061   12.106 6.418179 14.30311 
1 1 1    6   24   38 o   20.074   6.5832  -1.0879   9.7107   2.5450   10.233 -33.9619   30.783   18.351   7.7845   21.797   10.619 -3.446058 13.16637 
1 1 1    6   24   39 o   43.871   6.8691   54.719   11.191   61.075   12.958   36.063   22.200   52.366   5.9995   35.375   12.359 16.99141 13.73816 
1 1 1    6   24   40 o   30.880   6.4560   27.963   11.325   39.639   12.842 -12.8804   24.019   40.379   7.9941   21.381   10.140 18.99808 12.91204 
1 1 1    6   24   41 o   25.778   7.8930   10.438   16.111   22.881   22.329  -3.0734   23.268   29.073   11.839   22.484   10.442 6.589649 15.78608 
1 1 1    6   24   42 o   22.611   7.2327   4.6179   11.599   3.7882   12.789   8.4657   27.540   19.649   8.5229   25.574   11.688 -5.924252 14.46532 
1 1 1    6   25    0 o   16.313   6.2058   7.8520   8.1659   7.8520   8.1659   7.8520   8.1659   16.313   8.7764   16.313   8.7764 0.000000 0.000000 
1 1 1    6   25    1 f  148.622   2.7626  471.021   16.380  382.280   25.026  537.531   21.665  135.934   4.4637  161.311   3.2564 -25.37706 5.525253 
1 1 1    6   25    2 o  128.401   2.1380  337.881   11.199  323.781   14.660  357.640   17.355  125.220   2.8386  131.582   3.1979 -6.361549 4.276027 
1 1 1    6   25    3 o  298.140   2.7471  1836.24   33.378  1829.07   43.908  1846.07   51.376  297.506   3.5783  298.774   4.1692 -1.267975 5.494199 
1 1 1    6   25    4 o  124.785   2.1442  321.741   11.019  299.393   15.497  344.591   15.670  120.395   3.1209  129.175   2.9412 -8.779915 4.288391 
1 1 1    6   25    5 f   62.272   3.7218   77.061   7.6519   85.876   17.530   74.987   8.5048   64.301   6.6100   60.243   3.4229 4.058094 7.443652 
1 1 1    6   25    6 o   53.514   4.4131   59.509   7.3860   59.316   17.660   59.550   8.1314   53.350   8.0257   53.677   3.6729 -0.3277740 8.826184 
1 1 1    6   25    7 o  118.083   4.1490  288.371   20.207  288.371   20.207   0.0000   0.0000  118.083   4.1490  ?   ?       ?      ? 
1 1 1    6   25    8 o  144.640   2.5489  432.253   15.125  431.129   20.357  433.638   22.598  144.446   3.4170  144.834   3.7829 -0.3874512 5.097735 
1 1 1    6   25    9 o  221.287   3.1649  1007.58   27.195  996.364   33.176  1030.56   47.480  219.548   3.6638  223.026   5.1617 -3.477829 6.329796 
1 1 1    6   25   10 o  169.293   3.0973  590.454   19.027  587.562   22.131  598.648   37.254  168.641   3.1818  169.946   5.3149 -1.305664 6.194534 
1 1 1    6   25   11 o   36.626   7.5085   23.852   9.5686   21.150   10.452   37.849   23.786   31.254   8.0567   41.998   12.673 -10.74376 15.01701 
1 1 1    6   25   12 o  128.770   4.7806  375.789   16.957  387.810   18.325  304.214   44.718  136.997   3.2432  120.543   8.9944 16.45427 9.561252 
1 1 1    6   25   13 o  123.321   3.7622  318.110   18.007  323.656   22.120  307.215   31.005  125.049   4.2889  121.592   6.1824 3.456673 7.524459 
1 1 1    6   25   14 o   77.563   2.8513  124.058   9.0793  141.917   13.244  108.224   12.471   82.821   3.8772   72.305   4.1818 10.51581 5.702635 
1 1 1    6   25   15 o  207.510   2.6326  889.941   22.262  884.840   29.264  896.948   34.298  206.855   3.4300  208.164   3.9948 -1.308578 5.265278 
1 1 1    6   25   16 o   84.124   2.7105  143.512   9.2390  131.726   11.819  162.029   14.815   79.792   3.5913   88.456   4.0607 -8.663406 5.420950 
1 1 1    6   25   17 o  249.331   3.1330  1274.23   30.306  1246.41   36.849  1332.39   53.272  245.393   3.6408  253.269   5.0998 -7.875412 6.266066 
1 1 1    6   25   18 o   20.439   5.1134   5.3277   6.0780  -2.7966   8.4871   13.881   8.7083   15.301   6.7794   25.577   7.6567 -10.27625 10.22673 
1 1 1    6   25   19 o  118.109   3.4001  295.128   16.241  238.061   23.594  346.515   22.389  106.955   5.3486  129.262   4.1996 -22.30785 6.800279 
1 1 1    6   25   20 o   84.945   3.1694  148.956   10.972  143.734   14.339  156.333   17.043   83.204   4.1782   86.686   4.7668 -3.481895 6.338778 
1 1 1    6   25   21 o   35.904   5.3613   28.653   7.5703   31.213   9.5538   24.333   12.410   38.603   6.0006   33.205   8.8864 5.397739 10.72261 
1 1 1    6   25   22 o  176.497   3.1347  649.768   22.776  619.877   32.701  677.929   31.741  172.485   4.5967  180.510   4.2633 -8.025040 6.269444 
1 1 1    6   25   23 o  104.988   2.9242  227.260   12.278  220.664   15.465  238.504   20.192  103.061   3.6382  106.916   4.5790 -3.855476 5.848353 
1 1 1    6   25   24 o   66.437   3.7873   95.551   9.8336  103.499   12.420   82.199   16.098   70.462   4.2738   62.412   6.2536 8.049862 7.574512 
1 1 1    6   25   25 o   22.192   6.6795   1.0874   10.374   4.7681   17.128  -1.0451   13.037   24.596   10.227   19.788   8.5943 4.807980 13.35893 
1 1 1    6   25   26 o   97.268   3.2901  198.973   12.703  200.527   15.976  196.302   20.945   98.012   3.9521   96.524   5.2612 1.487602 6.580217 
1 1 1    6   25   27 o   57.038   6.5162   78.550   13.747   51.209   21.611   97.128   17.815   46.578   11.353   67.498   6.3993 -20.91991 13.03231 
1 1 1    6   25   28 o   75.700   3.7379  116.021   11.102  105.868   13.500  137.233   19.515   71.007   4.6098   80.392   5.8855 -9.385452 7.475874 
1 1 1    6   25   29 o   40.770   6.3088   33.656   9.4617   27.932   11.039   49.502   18.366   35.245   7.8005   46.294   9.9175 -11.04918 12.61760 
1 1 1    6   25   30 o   45.046   7.8352   47.760   10.473   47.974   11.131   46.115   30.917   47.446   5.6881   42.645   14.602 4.801186 15.67040 
1 1 1    6   25   31 o   14.078   4.8935 -15.7607   7.3847 -14.7246   8.3007 -19.6937   16.172   11.219   5.4759   16.937   8.1116 -5.718072 9.786923 
1 1 1    6   25   32 o   44.443   6.1530   45.323   9.8740   45.638   11.600   44.492   18.814   46.029   6.1102   42.856   10.682 3.173409 12.30595 
1 1 1    6   25   33 o   24.938   6.2428   12.596   9.4887   21.326   10.678 -20.1782   20.690   30.284   8.3015   19.593   9.3261 10.69138 12.48560 
1 1 1    6   25   34 o   52.820   7.0810   70.391   14.916   34.866   21.130  105.672   21.058   36.835   12.062   68.806   7.4203 -31.97042 14.16201 
1 1 1    6   25   35 o   19.594   6.3249  -5.5929   9.0338  -8.3292   10.133   5.0033   19.941   14.491   6.7828   24.698   10.678 -10.20706 12.64986 
1 1 1    6   25   36 o   39.258   7.0933   43.977   11.305   49.332   12.716   23.784   24.693   47.032   6.5552   31.484   12.581 15.54816 14.18657 
1 1 1    6   25   37 o   34.446   7.3530   30.376   10.608   30.664   12.271   29.523   21.101   35.551   8.4865   33.342   12.010 2.209171 14.70600 
1 1 1    6   25   38 o   34.137   6.6305   36.345   11.396   44.338   12.286 -12.9163   30.499   44.197   6.7397   24.077   11.421 20.12061 13.26098 
1 1 1    6   25   39 o   25.487   7.1994   12.656   10.106   10.452   11.597   19.611   20.602   22.554   8.7383   28.420   11.444 -5.866308 14.39872 
1 1 1    6   25   40 o   21.128   6.5498   4.6023   10.348   8.6115   11.640 -10.4971   22.590   21.398   8.6072   20.858   9.8750 0.5402660 13.09960 
1 1 1    6   25   41 o   18.564   6.2442  -7.6172   10.270  -9.2824   11.545  -1.3032   22.480   14.873   7.0465   22.256   10.311 -7.383026 12.48838 
1 1 1    6   26    1 o   63.629   3.2055   83.461   8.3929   91.622   12.283   76.314   11.495   66.538   4.4757   60.720   4.5900 5.817841 6.410924 
1 1 1    6   26    2 o   64.980   2.7850   88.755   7.1285   92.525   8.9586   82.247   11.769   66.920   3.2458   63.039   4.5266 3.881409 5.570062 
1 1 1    6   26    3 o  104.152   2.5481  219.671   9.9886  213.401   11.823  235.310   18.672  101.654   2.8198  106.649   4.2449 -4.995438 5.096109 
1 1 1    6   26    4 o  112.392   2.3947  260.458   10.858  263.801   17.306  258.287   13.944  112.962   3.7144  111.822   3.0234 1.140282 4.789340 
1 1 1    6   26    5 o  184.972   3.3652  698.540   20.618  725.297   46.250  691.903   23.034  186.929   5.9989  183.016   3.0515 3.913116 6.730443 
1 1 1    6   26    6 f  191.806   2.6396  766.852   20.064  737.641   33.028  783.935   25.258  188.816   4.2411  194.796   3.1438 -5.979233 5.279298 
1 1 1    6   26    7 o  161.204   2.8070  534.959   18.005  528.095   22.589  546.919   29.818  159.852   3.4262  162.555   4.4474 -2.703537 5.614099 
1 1 1    6   26    8 o  158.445   2.5424  520.371   16.561  540.947   22.815  497.457   24.076  161.783   3.4192  155.108   3.7635 6.675522 5.084726 
1 1 1    6   26    9 o   84.873   3.9327  125.677   11.279  110.810   12.447  193.963   26.676   73.183   4.1236   96.564   6.6979 -23.38089 7.865467 
1 1 1    6   26   10 o   51.626   5.4677   40.586   8.9522   33.755   9.6445   83.116   24.064   40.319   5.7997   62.933   9.2708 -22.61460 10.93544 
1 1 1    6   26   11 o  198.524   3.6034  815.768   29.412  798.004   39.856  837.010   43.584  196.193   4.9254  200.855   5.2611 -4.662766 7.206834 
1 1 1    6   26   12 o  139.573   4.4675  395.115   17.380  391.487   18.616  419.762   48.518  137.609   3.2799  141.537   8.3113 -3.927612 8.935070 
1 1 1    6   26   13 o  147.467   3.4019  456.303   17.536  461.111   20.106  441.022   35.848  149.336   3.2644  145.599   5.9696 3.736893 6.803804 
1 1 1    6   26   14 o  178.151   3.5436  669.619   24.728  695.419   30.852  623.265   41.354  183.228   4.0824  173.074   5.7932 10.15390 7.087159 
1 1 1    6   26   15 o  173.598   3.5929  625.410   24.168  624.116   29.493  628.054   42.165  173.544   4.1204  173.653   5.8872 -0.1088257 7.185871 
1 1 1    6   26   16 o   91.254   5.3213  211.490   13.907  232.185   15.475  124.619   31.705  105.911   3.5426   76.598   10.036 29.31310 10.64257 
1 1 1    6   26   17 o  121.464   3.7090  305.629   18.581  305.629   18.581   0.0000   0.0000  121.464   3.7090  ?   ?       ?      ? 
1 1 1    6   26   18 o   73.026   3.8271  116.205   10.933   77.199   15.887  151.293   15.068   60.706   6.3453   85.346   4.2807 -24.64029 7.654226 
1 1 1    6   26   19 o   65.153   3.2152   85.186   8.4847   69.639   10.888  109.230   13.540   57.850   4.5632   72.456   4.5307 -14.60619 6.430381 
1 1 1    6   26   20 o   73.941   5.6834  133.035   13.832   86.671   27.089  149.385   16.087   63.203   10.392   84.679   4.6060 -21.47553 11.36686 
1 1 1    6   26   21 o   81.253   3.2314  139.839   10.250  144.763   12.735  130.777   17.275   83.474   3.6989   79.032   5.2997 4.442024 6.462890 
1 1 1    6   26   22 o   26.732   5.6594   15.936   6.8983   19.517   8.7354   10.004   11.244   29.734   7.1997   23.730   8.7338 6.004671 11.31875 
1 1 1    6   26   23 o   53.451   4.1866   63.891   8.5575   73.481   10.842   48.044   13.937   59.346   4.4294   47.555   7.1057 11.79038 8.373250 
1 1 1    6   26   24 o   80.087   3.2223  131.451   10.335  123.207   12.966  145.817   17.115   76.831   4.0917   83.344   4.9790 -6.513474 6.444602 
1 1 1    6   26   25 o   25.147   6.9217   10.002   10.360   3.4509   17.351   13.631   12.914   24.020   10.160   26.274   9.4030 -2.254005 13.84337 
1 1 1    6   26   26 o   96.109   3.3183  194.661   12.941  197.755   16.941  190.324   20.055   97.195   4.2259   95.022   5.1171 2.172501 6.636530 
1 1 1    6   26   27 o   58.225   4.2281   71.350   9.5483   70.023   11.630   74.096   16.724   57.687   4.8880   58.763   6.9004 -1.075848 8.456294 
1 1 1    6   26   28 o   58.538   7.6497   91.867   15.385   54.444   28.946  106.602   18.163   46.465   13.971   70.612   6.2365 -24.14635 15.29948 
1 1 1    6   26   29 o   15.534   5.2123  -9.9549   7.3888 -10.1154   8.4532  -9.4353   15.211   12.532   5.9640   18.537   8.5500 -6.004888 10.42460 
1 1 1    6   26   30 o   83.203   3.7085  149.507   11.966  154.669   14.782  139.695   20.380   85.772   4.1786   80.634   6.1280 5.138535 7.417052 
1 1 1    6   26   31 o   28.025   6.1362   20.436   9.6416   28.923   10.172 -54.6475   30.255   35.828   7.1343   20.222   9.9858 15.60604 12.27245 
1 1 1    6   26   32 o   37.880   6.4066   35.268   9.4269   38.026   11.111   28.183   17.810   41.766   6.4501   33.994   11.071 7.771778 12.81328 
1 1 1    6   26   33 o   36.297   7.1676   26.508   9.5892   21.176   10.779   46.747   21.000   29.977   8.3878   42.617   11.625 -12.64038 14.33526 
1 1 1    6   26   34 o   23.275   7.1778   0.8344   13.396  -9.3377   19.099   10.683   18.793   20.507   9.5015   26.043   10.761 -5.536594 14.35568 
1 1 1    6   26   35 o   24.145   6.8118   10.912   9.6857   12.654   11.271   5.9933   18.939   24.105   8.7635   24.185   10.431 -0.7941437E-01 13.62357 
1 1 1    6   26   36 o   25.938   6.6641   15.637   9.7509   21.014   11.246  -0.6482   19.571   29.361   8.6809   22.514   10.113 6.846273 13.32818 
1 1 1    6   26   37 o   24.129   6.9928   7.5267   9.6606   3.3626   11.049   21.039   19.904   19.057   8.0868   29.201   11.411 -10.14367 13.98568 
1 1 1    6   26   38 o   32.226   7.2350   28.866   10.897   32.050   12.862   20.770   20.511   35.625   8.8041   28.826   11.484 6.798733 14.47008 
1 1 1    6   26   39 o   28.011   7.6144   21.292   11.958   25.202   12.560 -16.5761   39.087   30.962   9.1786   25.059   12.152 5.903784 15.22881 
1 1 1    6   26   40 o   48.166   7.0204   62.050   11.941   61.736   13.799   62.986   23.827   51.578   6.4864   44.755   12.453 6.823689 14.04074 
1 1 1    6   27    0 o  208.993   3.2287  903.843   39.316  903.843   39.316  903.843   39.316  208.993   4.5661  208.993   4.5661 0.000000 0.000000 
1 1 1    6   27    1 o  106.743   2.6133  215.458   10.295  281.694   20.687  193.654   11.869  116.665   4.2992   96.822   2.9722 19.84354 5.226609 
1 1 1    6   27    2 o   66.398   2.3522   90.682   6.4042   77.779   8.7595  105.499   9.3867   61.341   3.4623   71.454   3.1851 -10.11236 4.704467 
1 1 1    6   27    3 o   73.602   2.4115  111.387   7.2948   99.377   9.9539  125.321   10.722   69.335   3.4808   77.869   3.3384 -8.533707 4.822908 
1 1 1    6   27    4 o  153.993   3.2832  490.106   20.853   0.0000   0.0000  490.106   20.853  ?   ?   153.993   3.2832      ?      ? 
1 1 1    6   27    5 o  133.600   2.7781  371.754   15.205  335.759   22.053  404.366   20.992  127.364   4.1982  139.835   3.6397 -12.47196 5.556261 
1 1 1    6   27    6 o   24.788   6.8844   7.9957   10.431   15.938   11.049 -57.0841   31.629   27.699   8.6892   21.877   10.681 5.822577 13.76876 
1 1 1    6   27    7 o   62.333   4.4701   80.486   11.492   80.486   11.492   0.0000   0.0000   62.333   4.4701  ?   ?       ?      ? 
1 1 1    6   27    8 o  131.747   2.6112  361.883   14.048  383.763   18.953  335.211   20.926  136.235   3.3732  127.258   3.9869 8.976288 5.222400 
1 1 1    6   27    9 o  176.174   3.4009  646.627   24.089  657.436   30.947  630.010   38.371  178.166   4.2114  174.183   5.3411 3.983109 6.801747 
1 1 1    6   27   10 o  150.664   2.5271  472.462   15.358  483.852   19.889  455.638   24.173  152.981   3.1521  148.346   3.9508 4.634445 5.054149 
1 1 1    6   27   11 o  174.161   3.3063  626.387   21.927  621.850   26.319  636.682   39.645  173.330   3.6815  174.991   5.4930 -1.660614 6.612608 
1 1 1    6   27   12 o   90.591   6.1398  179.480   14.795  181.676   15.819  164.146   41.801   93.635   4.0960   87.548   11.576 6.086853 12.27962 
1 1 1    6   27   13 o  135.249   3.4793  363.655   15.774  352.618   17.615  408.353   35.448  130.557   3.2712  139.941   6.1417 -9.384079 6.958525 
1 1 1    6   27   14 o  128.770   3.6906  356.897   16.025  366.439   18.192  323.846   33.857  133.072   3.3145  124.469   6.5952 8.603325 7.381231 
1 1 1    6   27   15 o  135.034   3.5935  384.806   16.444  388.928   18.621  370.209   35.041  137.061   3.2940  133.006   6.3877 4.055389 7.186983 
1 1 1    6   27   16 o   31.806   9.1419   4.5341   13.956  -0.2975   15.085   33.226   36.761   21.723   9.3391   41.889   15.719 -20.16638 18.28382 
1 1 1    6   27   17 o   55.544   6.6951   60.317   9.9661   58.050   10.608   77.364   29.087   52.779   4.8733   58.310   12.472 -5.531761 13.39025 
1 1 1    6   27   18 o   77.076   2.7519  119.637   8.5731  105.577   10.880  142.670   13.925   71.313   3.6989   82.840   4.0755 -11.52727 5.503817 
1 1 1    6   27   19 o   56.451   3.2418   65.321   7.4800   55.715   9.8873   78.177   11.438   51.674   4.6391   61.227   4.5294 -9.552860 6.483606 
1 1 1    6   27   20 o  109.133   3.4016  249.241   15.253  222.410   21.389  277.005   21.757  103.081   5.0309  115.185   4.5798 -12.10384 6.803255 
1 1 1    6   27   21 o   96.067   3.0885  192.449   12.225  192.012   16.912  192.928   17.693   95.976   4.2723   96.158   4.4613 -0.1821671 6.177023 
1 1 1    6   27   22 o   67.370   3.2557   93.734   8.8732   89.004   11.363  101.127   14.205   65.298   4.2191   69.443   4.9596 -4.144928 6.511449 
1 1 1    6   27   23 o   54.069   3.7632   59.923   8.2014   54.023   10.360   69.827   13.422   50.685   4.9560   57.454   5.6643 -6.769024 7.526334 
1 1 1    6   27   24 o   37.217   5.1809   31.174   7.4396   33.233   9.3097   27.536   12.375   39.614   5.6981   34.820   8.6545 4.793091 10.36185 
1 1 1    6   27   25 o   56.928   4.2713   71.556   9.4511   78.615   11.946   59.746   15.453   61.158   4.7359   52.697   7.1097 8.460926 8.542616 
1 1 1    6   27   26 o   23.715   6.7729   6.1372   9.8991   11.583   16.580   3.1205   12.340   26.687   10.418   20.742   8.6576 5.945122 13.54589 
1 1 1    6   27   27 o   23.214   5.9734   10.472   7.4146   13.018   9.0652   5.3260   12.888   24.502   7.8919   21.926   8.9689 2.576878 11.94673 
1 1 1    6   27   28 o   30.819   5.6352   24.002   8.4979   34.010   10.193   1.1925   15.388   39.816   6.2070   21.822   9.4071 17.99441 11.27032 
1 1 1    6   27   29 o   46.954   5.2378   48.704   9.2304   48.259   11.244   49.625   16.164   47.473   5.7426   46.435   8.7613 1.037327 10.47559 
1 1 1    6   27   30 o   72.170   3.9595  109.570   11.317  104.635   14.029  118.766   19.151   70.223   4.8439   74.117   6.2647 -3.894127 7.918977 
1 1 1    6   27   31 o   30.875   6.5617   22.679   8.5157   23.512   9.9160   20.337   16.621   31.883   7.6405   29.867   10.670 2.016520 13.12336 
1 1 1    6   27   32 o   33.325   8.1247   26.112   10.029   27.017   10.399   14.063   37.944   34.144   7.5818   32.507   14.372 1.636681 16.24935 
1 1 1    6   27   33 o   34.509   6.8371   27.742   9.3208   25.439   10.922   33.912   17.881   32.727   8.1284   36.292   10.996 -3.565815 13.67412 
1 1 1    6   27   34 o   21.926   6.3963   7.2724   8.8479   10.177   10.029  -2.9277   18.795   22.250   8.2373   21.602   9.7877 0.6474266 12.79264 
1 1 1    6   27   35 o   34.111   8.8529   31.790   16.377   29.040   24.011   34.181   22.395   33.063   12.635   35.160   12.404 -2.097454 17.70574 
1 1 1    6   27   36 o   18.651   5.8468  -0.5755   9.0934   5.9560   10.389 -21.9772   18.805   19.853   8.0789   17.450   8.4541 2.402964 11.69365 
1 1 1    6   27   37 o   23.098   6.7530   5.5558   9.5048   0.1362   11.090   20.556   18.450   17.678   7.7952   28.518   11.029 -10.84030 13.50608 
1 1 1    6   27   38 o   33.466   6.6409   33.292   10.694   42.018   12.818   13.306   19.398   41.438   7.7857   25.493   10.761 15.94464 13.28184 
1 1 1    6   27   39 o   20.791   6.3096   4.9452   10.216   11.864   11.692 -17.3907   21.007   22.822   8.7931   18.760   9.0514 4.062027 12.61926 
1 1 1    6   28    0 o   40.537   2.9100   34.991   6.7180   34.991   6.7180   34.991   6.7180   40.537   4.1153   40.537   4.1153 0.000000 0.000000 
1 1 1    6   28    1 o   84.141   2.3616  147.765   8.0908  136.443   12.181  156.704   10.823   81.209   3.6367   87.074   3.0138 -5.865189 4.723171 
1 1 1    6   28    2 o  239.408   2.2922  1184.64   22.620  1173.55   31.378  1196.64   32.638  238.251   3.1932  240.565   3.2894 -2.314011 4.584427 
1 1 1    6   28    3 o  101.975   3.2291  217.680   11.805  211.276   23.279  219.896   13.697  100.821   5.5981  103.128   3.2201 -2.306396 6.458207 
1 1 1    6   28    4 o  245.295   2.8926  1241.02   27.460  1261.00   48.176  1231.41   33.421  246.572   4.7372  244.018   3.3207 2.554626 5.785153 
1 1 1    6   28    5 o  139.137   2.5317  394.639   13.686  418.145   24.064  383.399   16.640  142.080   4.1064  136.194   2.9623 5.886505 5.063355 
1 1 1    6   28    6 o   96.870   2.9594  191.744   11.729  228.921   17.721  162.760   15.647  105.121   4.0873   88.619   4.2810 16.50258 5.918805 
1 1 1    6   28    7 o   49.193   4.0268   50.243   8.0744   49.610   10.606   51.116   12.452   48.857   5.2634   49.529   6.0957 -0.6711388 8.053669 
1 1 1    6   28    8 o   62.229   3.3738   79.609   8.5639   75.481   11.190   85.445   13.306   60.323   4.4974   64.134   5.0303 -3.810993 6.747607 
1 1 1    6   28    9 o  233.586   2.7500  1131.14   26.440  1145.93   36.391  1114.59   38.481  235.242   3.7507  231.931   4.0228 3.310730 5.500017 
1 1 1    6   28   10 o   28.231   5.4295   17.582   7.0994   25.959   9.4254   6.5989   10.793   34.651   6.8380   21.811   8.4358 12.83997 10.85910 
1 1 1    6   28   11 o  124.488   4.9614  349.225   17.792  360.261   19.394  290.559   44.716  131.900   3.5649  117.077   9.2604 14.82300 9.922867 
1 1 1    6   28   12 o   19.397   6.2027   0.9400   7.2522   5.1006   7.3829 -113.5222   38.724   18.461   7.0177   20.334   10.230 -1.872448 12.40540 
1 1 1    6   28   13 o   51.487   9.1864   51.277   9.1168   50.653   9.3019   66.495   45.932   49.350   4.5700   53.623   17.795 -4.273273 18.37272 
1 1 1    6   28   14 o   81.095   6.9427  137.094   11.736  136.424   12.160  146.190   44.819   81.102   3.6353   81.087   13.401 0.1499939E-01 13.88542 
1 1 1    6   28   15 o   47.160   8.7986   41.906   9.1398   41.099   9.3747   57.407   41.092   44.370   5.1227   49.950   16.835 -5.580597 17.59713 
1 1 1    6   28   16 o  104.161   5.6247  243.080   14.931  246.752   15.886  215.240   43.737  109.036   3.5324   99.287   10.680 9.749619 11.24942 
1 1 1    6   28   17 o   96.760   4.9456  204.383   17.841  213.525   21.418  183.665   32.244  101.001   5.1414   92.519   8.4500 8.482391 9.891213 
1 1 1    6   28   18 o   39.756   6.6353   49.190   9.6119   56.125   10.187  -7.0564   29.012   51.820   4.7664   27.692   12.385 24.12728 13.27059 
1 1 1    6   28   19 o   81.589   3.0007  138.757   10.096  142.331   14.308  135.212   14.247   82.645   4.1976   80.533   4.2892 2.111763 6.001405 
1 1 1    6   28   20 o   63.869   3.1217   81.060   8.0098   66.712   10.048  106.078   13.267   56.516   4.3105   71.222   4.5165 -14.70583 6.243304 
1 1 1    6   28   21 o   22.842   5.1269   10.705   5.5654   7.0130   7.6389   14.881   8.1250   19.748   7.2091   25.935   7.2916 -6.187323 10.25370 
1 1 1    6   28   22 o   87.931   3.1942  162.320   11.568  166.938   16.097  157.387   16.635   89.272   4.3720   86.590   4.6579 2.682045 6.388306 
1 1 1    6   28   23 o   25.011   5.5704   13.276   6.3454   11.708   8.2672   15.525   9.8994   23.437   7.5353   26.584   8.2061 -3.147564 11.14090 
1 1 1    6   28   24 o   23.579   5.2940   11.631   6.6338   18.674   8.3447  -0.4630   10.935   28.930   7.0564   18.228   7.8938 10.70234 10.58802 
1 1 1    6   28   25 o   61.490   3.6651   79.768   9.0216   79.036   11.440   80.972   14.671   61.304   4.5247   61.677   5.7672 -0.3733902 7.330284 
1 1 1    6   28   26 o   79.940   3.2822  132.806   10.431  127.755   13.008  141.904   17.459   78.052   4.0408   81.828   5.1733 -3.775558 6.564350 
1 1 1    6   28   27 o   34.324   7.4532   27.282   10.995   28.375   19.977   26.807   13.170   34.739   11.738   33.910   9.1879 0.8290482 14.90643 
1 1 1    6   28   28 o   26.797   6.2537   15.309   7.5059   14.449   8.9066   17.419   13.943   25.398   7.7744   28.195   9.7976 -2.797207 12.50735 
1 1 1    6   28   29 o   48.398   4.7093   48.617   8.8786   43.943   10.707   58.909   15.887   45.197   5.7436   51.600   7.4648 -6.403336 9.418682 
1 1 1    6   28   30 o   36.782   6.2037   30.287   8.8522   26.316   10.764   38.584   15.559   33.611   7.8985   39.952   9.5686 -6.340904 12.40742 
1 1 1    6   28   31 o   49.213   5.1948   55.186   9.6006   56.251   11.815   53.116   16.473   50.971   5.6198   47.454   8.7384 3.517021 10.38952 
1 1 1    6   28   32 o   30.383   5.6920   25.128   8.8506   34.798   10.278  -2.6057   17.406   39.691   6.2788   21.076   9.4959 18.61483 11.38399 
1 1 1    6   28   33 o   20.251   6.1837   0.8202   8.3304  -2.3056   9.6602   9.8871   16.453   15.945   7.1379   24.556   10.100 -8.610811 12.36734 
1 1 1    6   28   34 o   24.215   6.5990   12.251   9.0219   14.457   10.525   6.1366   17.520   24.943   8.5194   23.486   10.080 1.457108 13.19794 
1 1 1    6   28   35 o   20.014   6.5278 -11.9269   13.313   6.8613   18.837 -30.6767   18.818   23.864   10.347   16.163   7.9610 7.701509 13.05554 
1 1 1    6   28   36 o   24.688   6.6669   13.993   9.2349   16.374   10.713   7.1042   18.222   25.827   8.5951   23.549   10.194 2.277824 13.33389 
1 1 1    6   28   37 o   24.689   7.7463   4.8284   10.119   1.5516   10.731   31.120   30.396   17.795   7.7620   31.584   13.408 -13.78870 15.49268 
1 1 1    6   28   38 o   30.949   9.0338   14.175   11.523   8.2132   12.084   73.983   38.273   21.153   8.6725   40.746   15.850 -19.59237 18.06765 
1 1 1    6   29    0 f  122.763   2.0190  311.672   14.440  311.672   14.440  311.672   14.440  122.763   2.8553  122.763   2.8553 0.000000 0.000000 
1 1 1    6   29    1 o  178.845   2.2500  661.940   16.461  658.881   24.890  664.318   21.946  178.443   3.3819  179.247   2.9685 -0.8043823 4.499920 
1 1 1    6   29    2 o  207.483   2.7843  909.278   22.114  941.008   26.956  843.962   38.674  213.315   3.0638  201.650   4.6500 11.66533 5.568649 
1 1 1    6   29    3 o  116.011   3.2185  269.960   14.024  301.865   26.549  257.612   16.516  120.471   5.3431  111.551   3.5898 8.919212 6.437084 
1 1 1    6   29    4 o  166.460   2.8469  574.802   19.498  525.331   27.428  625.338   27.722  159.181   4.1777  173.739   3.8687 -14.55782 5.693865 
1 1 1    6   29    5 o   50.834   3.3811   53.008   6.2538   55.095   12.260   52.274   7.2709   51.418   5.7809   50.250   3.5082 1.167999 6.762136 
1 1 1    6   29    6 o   59.941   3.3005   74.623   8.1241   74.579   10.989   74.677   12.065   59.941   4.4448   59.941   4.8803 0.5683899E-03 6.601008 
1 1 1    6   29    7 o   47.021   3.9862   47.107   7.5539   53.030   10.120   39.655   11.351   50.498   4.8590   43.543   6.3205 6.955029 7.972359 
1 1 1    6   29    8 o  111.834   3.7179  266.786   15.744  277.079   19.052  244.624   27.956  115.562   3.9973  108.106   6.2699 7.455765 7.435711 
1 1 1    6   29    9 o   50.955   5.9592   58.377   10.595   50.962   20.202   61.190   12.444   47.780   10.535   54.129   5.5738 -6.348919 11.91836 
1 1 1    6   29   10 o   24.260   8.2568   11.647   9.8852   0.0000   0.0000   11.647   9.8852  ?   ?    24.260   8.2568      ?      ? 
1 1 1    6   29   11 o   70.827   4.8634  101.441   12.967  116.062   24.531   95.772   15.276   73.958   8.0422   67.696   5.4710 6.261734 9.726727 
1 1 1    6   29   12 o   37.245   8.4088   31.109   15.229   39.992   18.995   15.126   25.480   42.083   10.868   32.408   12.834 9.674511 16.81770 
1 1 1    6   29   13 o  109.642   4.5094  250.086   20.180  233.390   26.370  273.684   31.349  105.386   6.0667  113.899   6.6733 -8.512398 9.018800 
1 1 1    6   29   14 o   56.821   6.1279   61.041   9.7542   57.612   10.440   84.592   27.362   52.515   4.8201   61.127   11.268 -8.612206 12.25570 
1 1 1    6   29   15 o  141.366   3.5239  422.647   16.463  425.785   18.467  410.499   36.334  143.278   3.1251  139.454   6.3170 3.823837 7.047755 
1 1 1    6   29   16 o  102.713   4.3225  217.200   12.931  215.080   13.974  229.822   34.103  101.792   3.3285  103.634   7.9785 -1.842064 8.644960 
1 1 1    6   29   17 o   48.703   7.3289   55.412   9.3240   56.186   9.8653   48.938   28.543   51.856   4.6126   45.550   13.913 6.306549 14.65778 
1 1 1    6   29   18 o   22.396   7.1217   1.5709   7.6385   1.9971   7.9240  -4.0271   28.716   16.874   6.9813   27.918   12.415 -11.04477 14.24348 
1 1 1    6   29   19 o   64.699   7.4278  101.003   16.996  110.159   20.443   80.503   30.588   71.720   6.9108   57.678   13.150 14.04251 14.85550 
1 1 1    6   29   20 o   32.604   7.1808   23.672   9.3953   23.672   9.3953   0.0000   0.0000   32.604   7.1808  ?   ?       ?      ? 
1 1 1    6   29   21 o   28.758   4.7081   18.897   5.7766   10.385   8.6396   25.779   7.7684   22.591   7.7189   34.924   5.3931 -12.33384 9.416299 
1 1 1    6   29   22 o   14.793   4.4887  -0.1616   4.9055   0.9097   7.2279  -1.0765   6.6795   15.592   6.5742   13.993   6.1133 1.598969 8.977304 
1 1 1    6   29   23 o  122.081   3.0098  312.815   15.131  317.034   20.902  308.170   21.931  123.011   4.1197  121.151   4.3891 1.860336 6.019641 
1 1 1    6   29   24 o   22.176   5.4712   9.9334   6.2934   12.698   8.0950   5.7099   10.006   24.047   7.4202   20.304   8.0421 3.742811 10.94231 
1 1 1    6   29   25 o   45.513   4.3702   43.857   7.8766   42.354   9.7860   46.622   13.273   44.652   5.3137   46.373   6.9397 -1.720409 8.740430 
1 1 1    6   29   26 o   18.192   5.3122  -2.8885   6.5009  -9.2082   7.7933   11.569   11.788   12.056   5.7343   24.328   8.9440 -12.27216 10.62433 
1 1 1    6   29   27 o   25.201   5.8069   9.1464   7.3780   0.6775   9.0160   26.314   12.837   16.941   7.2497   33.461   9.0730 -16.52052 11.61371 
1 1 1    6   29   28 o   32.669   7.0636   23.204   10.543   37.946   17.167   14.277   13.359   39.252   10.427   26.085   9.5318 13.16784 14.12717 
1 1 1    6   29   29 o   67.236   3.7844   92.777   10.004   83.276   12.174  112.541   17.558   62.492   4.7232   71.979   5.9143 -9.486137 7.568841 
1 1 1    6   29   30 o   25.418   6.3317   11.755   7.7822   7.3227   9.2526   22.472   14.387   20.381   7.8301   30.455   9.9525 -10.07375 12.66345 
1 1 1    6   29   31 o   15.189   5.0676  -8.5380   7.6870  -6.7112   9.1971 -12.7719   14.001   14.034   6.5333   16.344   7.7484 -2.310121 10.13520 
1 1 1    6   29   32 o   48.327   5.6562   58.335   9.7928   65.262   11.974   44.346   17.017   54.795   5.2983   41.858   9.9949 12.93697 11.31237 
1 1 1    6   29   33 o   61.612   7.4479  102.113   12.206  104.733   13.222   86.995   31.759   69.723   4.5977   53.501   14.169 16.22191 14.89583 
1 1 1    6   29   34 o   36.232   5.5032   40.725   10.610   61.578   12.575 -10.7854   19.764   52.591   5.7975   19.872   9.3556 32.71900 11.00631 
1 1 1    6   29   35 o   38.205   7.3635   45.504   11.536   49.164   12.356   20.627   32.208   46.463   6.4476   29.946   13.241 16.51651 14.72704 
1 1 1    6   29   36 o   38.573   9.5975   52.585   20.647   69.958   27.894   31.533   30.707   45.629   13.714   31.518   13.431 14.11126 19.19493 
1 1 1    6   29   37 o   31.640   9.4353   32.754   21.022   23.486   28.136   44.466   31.629   28.970   12.604   34.309   14.044 -5.338198 18.87067 
1 1 1    6   30    0 o   97.214   2.3256  196.002   13.153  196.002   13.153  196.002   13.153   97.214   3.2889   97.214   3.2889 0.000000 0.000000 
1 1 1    6   30    1 o  140.304   2.3455  408.169   13.561  425.079   19.090  390.944   19.267  143.257   3.2308  137.352   3.4010 5.904800 4.690975 
1 1 1    6   30    2 o   84.652   2.6726  147.679   8.6508  151.328   15.555  146.046   10.409   85.311   4.4208   83.994   3.0047 1.316635 5.345235 
1 1 1    6   30    3 o  118.852   3.1853  299.538   13.795  281.456   26.288  306.409   16.205  116.081   5.4907  121.624   3.2304 -5.542603 6.370525 
1 1 1    6   30    4 o   89.007   2.6213  161.373   8.9955  172.687   16.088  156.227   10.850   91.148   4.2795   86.866   3.0284 4.281738 5.242693 
1 1 1    6   30    5 o   73.471   3.1732  113.006   9.5497  104.366   13.995  120.535   13.064   70.781   4.7938   76.161   4.1588 -5.380249 6.346382 
1 1 1    6   30    6 o   69.062   3.1966  103.702   8.6856  121.077   11.391   79.570   13.425   76.397   3.6151   61.727   5.2730 14.66964 6.393243 
1 1 1    6   30    7 o   21.702   6.1607   4.8549   7.3955   7.9460   15.060   3.8727   8.4897   24.886   9.8633   18.517   7.3845 6.368700 12.32130 
1 1 1    6   30    8 o   92.085   4.7242  179.363   17.833  202.026   25.246  156.795   25.192   98.037   6.2436   86.132   7.0915 11.90496 9.448365 
1 1 1    6   30    9 o   53.359   5.4468   61.717   10.391   60.329   19.551   62.264   12.268   52.191   9.4294   54.526   5.4549 -2.335033 10.89353 
1 1 1    6   30   10 o   53.054   5.5222   59.020   12.084   0.0000   0.0000   59.020   12.084  ?   ?    53.054   5.5222      ?      ? 
1 1 1    6   30   11 o   88.433   4.3636  164.806   14.814  164.880   26.234  164.771   17.949   88.096   7.2202   88.771   4.9023 -0.6749344 8.727186 
1 1 1    6   30   12 o  105.472   3.7185  241.088   15.179  208.213   25.386  259.381   18.937   99.354   6.1950  111.590   4.1145 -12.23644 7.436902 
1 1 1    6   30   13 o  120.114   4.3114  307.131   21.115  333.348   28.658  275.998   31.229  126.013   5.5139  114.214   6.6294 11.79906 8.622710 
1 1 1    6   30   14 o   55.883   7.5837   68.969   16.468   62.559   20.841   79.624   26.871   52.771   9.9402   58.995   11.456 -6.223839 15.16745 
1 1 1    6   30   15 o   37.045   8.2193   30.720   17.922   53.094   21.084 -27.5437   34.024   47.945   10.908   26.144   12.298 21.80140 16.43860 
1 1 1    6   30   16 o   70.305   6.7132  109.189   19.446  109.264   26.913  109.106   28.128   70.443   9.2630   70.167   9.7193 0.2755432 13.42643 
1 1 1    6   30   17 o   92.717   4.5755  192.824   11.915  196.755   12.895  169.878   31.155   97.269   3.2143   88.164   8.5679 9.104942 9.150997 
1 1 1    6   30   18 o   64.674   6.9904  114.894   10.412  121.295   11.119   69.252   29.690   76.294   3.5334   53.055   13.527 23.23904 13.98077 
1 1 1    6   30   19 o   74.422   5.1812  109.026   10.625  105.595   11.318  134.496   30.835   71.105   3.8592   77.739   9.6170 -6.633430 10.36240 
1 1 1    6   30   20 o   80.902   5.6760  149.902   15.467  156.615   17.701  128.240   31.799   86.238   4.9767   75.566   10.203 10.67174 11.35194 
1 1 1    6   30   21 o  152.792   3.6131  504.352   19.018  514.109   21.750  472.656   39.199  157.053   3.3577  148.531   6.3986 8.521561 7.226113 
1 1 1    6   30   22 o   68.850   2.7418  103.117   7.3819   85.278   11.907  114.252   9.4079   63.631   4.5372   74.070   3.0795 -10.43892 5.483555 
1 1 1    6   30   23 o   77.129   3.0455  123.642   9.6317  110.900   12.827  140.115   14.584   72.634   4.2817   81.624   4.3322 -8.990288 6.091006 
1 1 1    6   30   24 o   83.411   3.1040  145.087   10.588  135.117   13.926  158.747   16.301   80.123   4.2141   86.698   4.5586 -6.575294 6.208022 
1 1 1    6   30   25 o   39.032   4.6721   34.393   7.1351   39.136   9.5242   28.327   10.772   42.815   5.3935   35.249   7.6304 7.565823 9.344136 
1 1 1    6   30   26 o   16.659   4.9874  -1.3884   6.0441  -6.4832   7.6945   6.8199   9.7666   12.761   5.9523   20.558   8.0042 -7.797515 9.974807 
1 1 1    6   30   27 o   63.261   9.1739   70.113   15.580   59.905   16.392  165.468   50.101   51.668   7.6923   74.854   16.657 -23.18625 18.34778 
1 1 1    6   30   28 o   34.761   5.6137   27.919   7.6803   26.763   9.7004   29.860   12.573   34.153   7.1172   35.368   8.6832 -1.214661 11.22734 
1 1 1    6   30   29 o   62.640   4.5191   87.301   11.576   76.161   16.538   98.002   16.208   58.368   6.8698   66.912   5.8731 -8.543945 9.038115 
1 1 1    6   30   30 f   60.261   5.2267   84.605   11.967   55.966   16.741  114.535   17.114   48.238   8.7361   72.285   5.7404 -24.04729 10.45335 
1 1 1    6   30   31 o   49.787   4.9119   53.195   9.3999   48.537   11.220   64.160   17.214   46.979   5.7908   52.595   7.9355 -5.616047 9.823737 
1 1 1    6   30   32 o   26.732   7.3581   16.645   10.568   19.520   11.295  -3.5752   29.952   28.078   8.7815   25.386   11.809 2.691599 14.71618 
1 1 1    6   30   33 f   21.321   7.3656 -31.1053   21.377 -33.2831   30.832 -29.0892   29.665   21.296   10.428   21.346   10.405 -0.5037689E-01 14.73117 
1 1 1    6   30   34 o   32.425   10.226   19.196   24.949  -1.9094   29.353   74.130   47.355   24.795   11.586   40.055   16.855 -15.26034 20.45274 
1 1 1    6   30   35 o   24.089   8.0096  -2.8773   20.551   4.7143   27.925 -11.8477   30.355   25.101   11.580   23.077   11.068 2.024857 16.01928 
1 1 1    6   30   36 o   27.670   8.6700   10.355   20.704 -15.4789   27.920   41.919   30.861   21.661   10.447   33.678   13.840 -12.01655 17.34003 
1 1 1    6   31    0 o   44.681   2.5254   42.091   6.4850   42.091   6.4850   42.091   6.4850   44.681   3.5715   44.681   3.5715 0.000000 0.000000 
1 1 1    6   31    1 o  117.613   2.2973  287.136   11.112  290.253   15.195  283.553   16.291  118.326   3.1136  116.899   3.3788 1.427826 4.594660 
1 1 1    6   31    2 o   55.098   3.6265   66.203   6.8319   58.596   14.043   68.561   7.8198   52.707   6.4597   57.489   3.2980 -4.782089 7.252929 
1 1 1    6   31    3 o  113.323   3.6142  266.755   16.892   0.0000   0.0000  266.755   16.892  ?   ?   113.323   3.6142      ?      ? 
1 1 1    6   31    4 o   68.587   3.2221   97.679   9.0683  102.645   13.655   93.761   12.129   70.110   4.7222   67.065   4.3851 3.045258 6.444237 
1 1 1    6   31    5 o   61.591   3.0735   79.752   7.7342   85.930   10.526   72.504   11.401   64.260   3.9717   58.921   4.6916 5.338074 6.147008 
1 1 1    6   31    6 o   46.503   5.5415   51.469   9.2810   35.428   15.907   59.749   11.428   39.600   9.7938   53.406   5.1881 -13.80615 11.08306 
1 1 1    6   31    7 o   67.426   4.2538   98.724   10.858   87.887   19.086  103.909   13.202   64.299   7.1969   70.553   4.5368 -6.253593 8.507580 
1 1 1    6   31    8 o   57.136   6.5850   72.669   14.862   78.711   19.856   64.973   22.410   60.655   7.9373   53.617   10.509 7.038017 13.17001 
1 1 1    6   31    9 f   76.171   4.6884  135.251   12.706   95.449   22.883  152.993   15.277   66.682   8.3202   85.661   4.3242 -18.97860 9.376824 
1 1 1    6   31   10 o   61.899   5.1935   80.314   13.259   0.0000   0.0000   80.314   13.259  ?   ?    61.899   5.1935      ?      ? 
1 1 1    6   31   11 o   42.360   6.6382   46.689   10.722   23.154   20.547   55.497   12.569   33.441   11.872   51.279   5.9430 -17.83813 13.27641 
1 1 1    6   31   12 o   69.653   4.6423   91.665   11.826  129.878   24.381   79.909   13.523   77.704   7.6075   61.603   5.3225 16.10157 9.284521 
1 1 1    6   31   13 o   65.025   6.3797   91.846   16.656   88.432   21.117   97.468   27.097   63.862   8.0173   66.188   9.9261 -2.326172 12.75949 
1 1 1    6   31   14 o   68.355   6.3744  102.413   17.525  101.280   22.422  104.192   28.093   68.340   7.9549   68.370   9.9626 -0.2937317E-01 12.74888 
1 1 1    6   31   15 o   88.884   6.6991  189.428   21.544  214.057   26.238  138.467   37.743  100.210   6.3483   77.558   11.799 22.65162 13.39823 
1 1 1    6   31   16 o   82.554   6.2515  149.943   21.281  153.428   30.119  146.467   30.073   83.572   8.7380   81.536   8.9427 2.035988 12.50295 
1 1 1    6   31   17 o  128.130   4.4124  349.589   23.268  346.837   31.840  352.743   34.088  127.715   6.0446  128.544   6.4295 -0.8282776 8.824730 
1 1 1    6   31   18 o   68.376   10.217  125.454   25.596   93.261   48.509  137.876   30.132   57.909   18.213   78.842   9.2663 -20.93301 20.43486 
1 1 1    6   31   19 o  109.027   6.5163  264.190   25.627  262.691   29.852  268.389   49.968  110.539   6.5477  107.515   11.268 3.024475 13.03256 
1 1 1    6   31   20 o   26.844   6.4900   16.715   7.1272   19.041   7.3771 -15.8725   27.616   29.275   6.2967   24.412   11.350 4.862644 12.97990 
1 1 1    6   31   21 o   48.495   7.2343   74.438   9.7289   80.322   10.291   24.950   29.846   61.875   4.0325   35.115   13.895 26.76003 14.46862 
1 1 1    6   31   22 o   32.407   8.2581   9.8593   12.125   0.7048   13.378   51.980   28.695   20.256   8.7514   44.559   14.007 -24.30290 16.51622 
1 1 1    6   31   23 o   29.398   8.3661   10.350   7.9015   9.1923   8.1114   31.846   34.957   21.313   7.4692   37.482   14.972 -16.16937 16.73215 
1 1 1    6   31   24 o   28.022   4.2295   16.449   4.1049   18.876   8.8008   15.774   4.6407   28.695   7.3911   27.349   4.1140 1.345535 8.458919 
1 1 1    6   31   25 o   16.996   4.9370   2.5880   5.4656   4.8215   8.6521   1.1049   7.0504   18.670   7.4518   15.321   6.4782 3.349278 9.874037 
1 1 1    6   31   26 o   28.067   5.6323   18.314   6.9492   13.968   9.7721   22.760   9.8841   24.903   8.2054   31.231   7.7178 -6.328627 11.26467 
1 1 1    6   31   27 o   22.290   5.7085   9.5928   6.5686   7.3198   8.2266   13.591   10.910   19.817   7.4360   24.762   8.6635 -4.945272 11.41707 
1 1 1    6   31   28 o   28.349   7.9355   12.455   8.5001   10.750   8.8659   31.844   29.899   22.243   7.8081   34.456   13.817 -12.21332 15.87101 
1 1 1    6   31   29 o   20.928   6.9247  -0.3789   8.1364  -0.1621   8.4539  -3.1037   29.969   15.793   6.8891   26.062   12.014 -10.26926 13.84939 
1 1 1    6   31   30 o   35.599   8.9691   34.043   19.530   58.805   26.040   2.2081   29.526   44.613   13.214   26.585   12.131 18.02797 17.93828 
1 1 1    6   31   31 o   17.984   8.9953 -77.8570   20.673 -104.9479   30.793 -55.6254   27.895  ?   ?    17.984   8.9953      ?      ? 
1 1 1    6   31   32 o   31.068   9.1736   25.584   20.021   34.686   27.568   15.424   29.124   33.641   13.341   28.495   12.595 5.146307 18.34726 
1 1 1    6   31   33 o   28.099   9.3458   7.7800   25.437   21.964   46.865   1.8564   30.286   30.754   14.456   25.445   11.849 5.308777 18.69163 
1 1 1    6   31   34 o   35.022   9.6605   43.885   20.033   40.497   26.745   48.215   30.236   34.159   13.260   35.884   14.052 -1.724354 19.32104 
1 1 1    6   32    0 o  186.664   2.8114  722.957   30.579  722.957   30.579  722.957   30.579  186.664   3.9760  186.664   3.9760 0.000000 0.000000 
1 1 1    6   32    1 o   74.040   2.7219  114.052   7.5941  114.089   13.924  114.036   9.0604   73.914   4.5674   74.165   2.9620 -0.2516251 5.443704 
1 1 1    6   32    2 o   40.574   4.5414   40.324   5.7437   27.397   11.991   44.173   6.5431   35.032   8.4061   46.115   3.4402 -11.08278 9.082808 
1 1 1    6   32    3 o   49.042   3.2247   48.235   5.8442   54.812   11.399   45.890   6.8069   51.092   5.4093   46.993   3.5120 4.099045 6.449365 
1 1 1    6   32    4 o   65.017   3.1820   87.291   8.4782   97.515   12.913   79.545   11.240   68.309   4.5835   61.724   4.4151 6.584747 6.364070 
1 1 1    6   32    5 o   76.490   3.6553  119.754   10.818  131.640   19.309  114.316   13.060   78.977   5.9277   74.003   4.2788 4.973373 7.310694 
1 1 1    6   32    6 o  166.612   3.6320  583.496   23.738  582.000   40.280  584.292   29.383  165.971   5.8842  167.253   4.2595 -1.282059 7.264094 
1 1 1    6   32    7 o   33.574   5.9822   20.071   7.9363   41.829   15.283   12.037   9.2866   43.089   8.8943   24.060   8.0024 19.02902 11.96440 
1 1 1    6   32    8 o   50.445   7.0698   56.953   13.926   52.151   17.781   64.573   22.397   47.992   9.3188   52.899   10.634 -4.906940 14.13962 
1 1 1    6   32    9 f   70.369   4.4324  102.208   11.493  112.524   22.310   98.482   13.410   72.253   7.4865   68.485   4.7474 3.767258 8.864872 
1 1 1    6   32   10 o  116.269   4.0899  282.583   19.613   0.0000   0.0000  282.583   19.613  ?   ?   116.269   4.0899      ?      ? 
1 1 1    6   32   11 o   77.476   4.6279  129.553   13.766  124.152   24.050  132.185   16.789   75.753   7.6977   79.199   5.1397 -3.446564 9.255810 
1 1 1    6   32   12 o  104.743   4.8820  235.001   21.035  212.597   29.170  259.274   30.362   99.425   7.1134  110.061   6.6886 -10.63591 9.764081 
1 1 1    6   32   13 o   35.404   6.5864   31.722   9.7688   13.886   20.229   37.147   11.156   29.111   11.465   41.697   6.4868 -12.58615 13.17274 
1 1 1    6   32   14 o   74.377   5.9961  123.226   17.810  132.006   23.102  110.361   27.964   78.322   7.1517   70.432   9.6263 7.890282 11.99216 
1 1 1    6   32   15 o   27.877   8.5941   3.5182   17.295   7.0662   20.243  -6.0725   33.281   26.645   11.102   29.109   13.122 -2.464361 17.18824 
1 1 1    6   32   16 o   27.913   8.1897   4.0289   17.231   22.390   22.232 -23.5916   27.267   32.809   12.241   23.017   10.883 9.791988 16.37930 
1 1 1    6   32   17 o   24.113   7.7490  -7.0933   16.053  -8.2063   19.934  -5.0399   27.077   21.911   9.9867   26.315   11.851 -4.403439 15.49796 
1 1 1    6   32   18 o   35.703   10.536   20.954   23.509   25.327   45.875   19.397   27.377   38.533   16.418   32.874   13.208 5.659229 21.07139 
1 1 1    6   32   19 o  106.970   6.3287  247.736   24.525  237.857   28.394  276.758   48.667  104.932   6.5607  109.008   10.824 -4.076508 12.65749 
1 1 1    6   32   20 o   46.889   8.0087   58.496   18.027   87.286   23.332   15.859   28.394   62.082   9.1122   31.695   13.173 30.38661 16.01739 
1 1 1    6   32   21 o   49.345   8.9483   62.406   18.176   64.434   23.665   59.488   28.381   51.160   11.496   47.530   13.716 3.629993 17.89651 
1 1 1    6   32   22 o   79.725   5.4549  150.944   11.357  154.394   12.180  127.966   31.432   85.841   3.4402   73.609   10.353 12.23198 10.90989 
1 1 1    6   32   23 o   32.043   8.1706   18.786   7.7206   18.285   7.9059   29.115   35.877   28.289   6.8492   35.798   14.837 -7.509338 16.34127 
1 1 1    6   32   24 o   28.258   7.4946   14.433   7.8025   13.843   8.1462   20.990   27.150   24.629   7.4128   31.887   13.028 -7.258097 14.98920 
1 1 1    6   32   25 o   39.503   7.0798   44.047   9.3500   46.688   9.9389   23.724   27.572   46.549   5.1768   32.457   13.179 14.09261 14.15962 
1 1 1    6   32   26 o   43.476   9.1227   42.207   10.503   40.606   10.799   70.195   45.152   42.896   6.1038   44.055   17.194 -1.159073 18.24541 
1 1 1    6   32   27 o   37.008   9.5044   38.757   18.597   34.903   24.624   43.872   28.373   35.488   12.945   38.529   13.920 -3.040760 19.00889 
1 1 1    6   32   28 o   30.766   8.8358   16.007   18.617  -4.2736   24.649   42.943   28.406   23.759   10.932   37.772   13.885 -14.01244 17.67167 
1 1 1    6   32   29 o   32.037   9.1198   27.346   19.120   37.492   25.951   15.300   28.278   35.316   13.216   28.759   12.571 6.556587 18.23957 
1 1 1    6   32   30 o   44.894   10.551   68.817   22.383   66.196   27.494   73.969   38.546   45.981   13.567   43.807   16.163 2.174049 21.10228 
1 1 1    6   32   31 f   25.612   8.2811   1.0863   20.181 -16.8306   28.457   19.212   28.623   22.237   10.679   28.986   12.659 -6.748852 16.56213 
1 1 1    6   32   32 o   24.705   8.0959  -0.3202   19.864 -14.9753   27.335   16.078   28.915   21.741   10.448   27.668   12.370 -5.926258 16.19182 
1 1 1    6   32   33 o   28.393   9.0082   17.550   24.147   35.017   28.291 -29.3055   46.337   32.056   13.221   24.731   12.239 7.324644 18.01634 
1 1 1    6   33    0 o   31.481   5.3279   23.983   8.4870   23.983   8.4870   23.983   8.4870   31.481   7.5347   31.481   7.5347 0.000000 0.000000 
1 1 1    6   33    1 o   70.141   2.7605  101.922   7.0816  104.457   13.713  100.999   8.2698   70.534   4.7136   69.748   2.8747 0.7862396 5.521045 
1 1 1    6   33    2 f   71.785   4.6773  105.530   9.8357  116.752   25.948  103.647   10.629   73.060   8.6111   70.510   3.6548 2.550308 9.354604 
1 1 1    6   33    3 o  109.596   3.5405  250.247   16.004   0.0000   0.0000  250.247   16.004  ?   ?   109.596   3.5405      ?      ? 
1 1 1    6   33    4 o   40.372   5.0996   35.727   8.0678   35.002   12.904   36.192   10.337   39.474   8.1939   41.269   6.0732 -1.794872 10.19922 
1 1 1    6   33    5 o   52.733   5.8995   63.412   12.014   72.500   15.846   51.122   18.426   58.248   6.5959   47.219   9.7830 11.02855 11.79890 
1 1 1    6   33    6 o  127.986   3.5328  344.794   17.724  345.177   30.140  344.592   21.913  127.627   5.7258  128.344   4.1396 -0.7167511 7.065503 
1 1 1    6   33    7 o   45.191   4.8456   40.979   8.4681   52.151   15.511   36.235   10.107   49.077   7.6628   41.304   5.9331 7.773453 9.691256 
1 1 1    6   33    8 o   97.885   4.3859  204.056   17.705  201.145   24.822  207.071   25.260   97.180   6.1929   98.591   6.2121 -1.411354 8.771707 
1 1 1    6   33    9 o   22.749   6.3770   7.6407   8.0365   3.8027   16.758   8.7870   9.1583   23.753   10.012   21.744   7.9003 2.009398 12.75398 
1 1 1    6   33   10 o   67.474   4.8319   99.758   11.531   93.158   22.799  102.026   13.366   65.249   8.4717   69.700   4.6496 -4.450653 9.663740 
1 1 1    6   33   11 o   37.732   6.8169   31.108   9.7037   36.705   18.985   29.128   11.290   39.454   11.165   36.011   7.8250 3.443295 13.63372 
1 1 1    6   33   12 o   20.103   6.1817  -4.1783   7.8546   10.711   17.533  -7.9168   8.7856   26.656   10.618   13.550   6.3341 13.10580 12.36349 
1 1 1    6   33   13 o   35.886   7.0238   29.085   9.5513   30.862   20.263   28.578   10.830   36.166   11.811   35.607   7.6054 0.5591736 14.04762 
1 1 1    6   33   14 o   40.856   6.2872   45.960   10.471   15.416   18.905   59.477   12.577   28.912   11.170   52.799   5.7753 -23.88630 12.57433 
1 1 1    6   33   15 o   27.558   8.2756   6.0324   15.544   2.6255   19.038   12.846   26.924   24.361   10.483   30.755   12.808 -6.394012 16.55118 
1 1 1    6   33   16 o   72.168   6.6036  121.128   18.785  135.307   24.412  100.542   29.416   78.606   7.5297   65.730   10.851 12.87646 13.20719 
1 1 1    6   33   17 o   24.831   7.8676  -2.5699   16.229  -0.3172   20.392  -6.4619   26.803   24.025   10.583   25.637   11.644 -1.612770 15.73522 
1 1 1    6   33   18 o   29.797   8.9240   1.7696   22.504 -68.5362   42.337   29.455   26.567   23.965   11.830   35.628   13.364 -11.66255 17.84796 
1 1 1    6   33   19 o   49.038   8.7948   60.001   17.454   55.151   22.215   67.823   28.214   47.092   11.530   50.985   13.284 -3.892178 17.58958 
1 1 1    6   33   20 o   40.490   9.1824   40.841   17.492   28.807   22.694   58.455   27.455   34.397   12.446   46.583   13.505 -12.18590 18.36476 
1 1 1    6   33   21 o   35.818   9.0263   29.668   16.913   17.938   21.689   47.867   27.016   29.810   11.830   41.826   13.636 -12.01627 18.05251 
1 1 1    6   33   22 o   31.518   8.1874   16.713   17.405   43.971   22.811 -21.2701   26.927   40.662   12.441   22.373   10.647 18.28889 16.37482 
1 1 1    6   33   23 o   37.497   9.4345   37.013   19.804   16.752   28.443   56.076   27.590   30.587   12.977   44.406   13.698 -13.81853 18.86898 
1 1 1    6   33   24 o   34.230   9.0653   30.750   18.397   43.579   24.495   14.151   27.862   39.167   12.995   29.293   12.643 9.873999 18.13062 
1 1 1    6   33   25 o   39.662   10.591   49.403   23.659   42.725   42.265   52.451   28.552   37.535   15.866   41.788   14.033 -4.253269 21.18137 
1 1 1    6   33   26 f   23.783   8.0732 -15.8996   20.531  -9.1758   23.392 -38.4525   42.841   22.298   10.394   25.268   12.356 -2.969898 16.14647 
1 1 1    6   33   27 o   39.387   9.7981   48.044   19.746   40.322   26.504   57.678   29.603   36.462   13.410   42.312   14.289 -5.850529 19.59625 
1 1 1    6   33   28 f   25.099   8.1387   0.5050   19.351   8.5573   25.803  -9.8451   29.253   26.344   11.738   23.855   11.277 2.489330 16.27737 
1 1 1    6   33   29 o   27.176   8.5717   6.6613   19.813 -10.2014   26.316   28.728   30.105   22.610   10.690   31.742   13.402 -9.132519 17.14345 
1 1 1    6   33   30 o   24.501   8.2069  -7.2708   21.681   9.7621   33.554 -19.4791   28.407   27.385   12.655   21.616   10.453 5.768764 16.41386 
1 1 1    6   33   31 o   34.750   9.6678   42.778   20.320   34.494   27.336   53.008   30.378   32.121   13.092   37.379   14.229 -5.258354 19.33562 
1 1 1    6   34    0 o   18.685   6.0699   10.754   7.2448   10.754   7.2448   10.754   7.2448   18.685   8.5841   18.685   8.5841 0.000000 0.000000 
1 1 1    6   34    1 o   53.818   3.3801   64.666   6.0399   54.397   12.720   67.656   6.8631   50.564   6.0991   57.071   2.9156 -6.506729 6.760160 
1 1 1    6   34    2 o   22.411   5.9484   8.0471   4.0619   4.6983   19.319   8.2020   4.1547   25.440   10.738   19.381   5.1207 6.059193 11.89681 
1 1 1    6   34    3 o   55.048   3.2367   63.504   7.3424   66.682   10.645   60.620   10.141   56.359   4.5796   53.737   4.5753 2.621933 6.473499 
1 1 1    6   34    4 o   98.261   3.5421  201.378   14.029  213.038   22.615  194.085   17.886  100.352   5.4639   96.171   4.5092 4.180855 7.084298 
1 1 1    6   34    5 o  124.375   3.3180  314.600   15.441  350.756   29.359  300.775   18.154  128.692   5.5313  120.059   3.6662 8.633408 6.636020 
1 1 1    6   34    6 o   42.957   5.4710   43.300   8.6997   33.637   14.873   48.326   10.726   38.146   9.4915   47.769   5.4442 -9.622761 10.94201 
1 1 1    6   34    7 f  104.825   3.5292  229.462   13.997  238.438   25.678  225.668   16.695  105.792   5.8849  103.858   3.8974 1.934074 7.058472 
1 1 1    6   34    8 o   55.419   4.5798   62.436   9.6260   75.305   18.131   57.386   11.359   58.809   7.4752   52.028   5.2934 6.781231 9.159605 
1 1 1    6   34    9 o   18.360   5.6642   0.1482   7.5534  -6.9344   14.796   2.6446   8.7844   18.912   8.6134   17.809   7.3580 1.102999 11.32833 
1 1 1    6   34   10 o   55.567   5.7910   73.357   10.643   59.962   21.088   77.935   12.329   50.415   10.484   60.718   4.9230 -10.30276 11.58198 
1 1 1    6   34   11 o   30.561   6.3958   23.468   9.1814   5.0404   18.424   29.556   10.590   24.833   10.485   36.290   7.3279 -11.45706 12.79152 
1 1 1    6   34   12 o   54.207   6.3254   74.234   11.133   52.386   22.136   81.631   12.880   46.335   11.608   62.079   5.0304 -15.74425 12.65071 
1 1 1    6   34   13 o   69.907   5.3319  114.697   12.730   92.497   25.160  122.334   14.758   63.742   9.5703   76.071   4.7037 -12.32941 10.66375 
1 1 1    6   34   14 o   19.147   6.1009  -1.5361   8.6930 -15.1079   20.286   1.5167   9.6211   20.447   9.5790   17.848   7.5583 2.598604 12.20183 
1 1 1    6   34   15 o   20.217   5.7850   2.7320   8.6662 -39.0104   20.401   11.924   9.5729   16.698   8.2371   23.735   8.1251 -7.036777 11.57008 
1 1 1    6   34   16 o   59.901   7.1820   80.152   16.822   56.027   21.508  118.164   26.998   47.765   11.125   72.037   9.0866 -24.27267 14.36402 
1 1 1    6   34   17 o   40.265   8.5674   42.770   16.659   57.146   21.874   22.915   25.706   47.849   11.270   32.680   12.907 15.16930 17.13481 
1 1 1    6   34   18 o   51.719   8.8336   68.272   18.257   62.488   23.248   77.579   29.489   49.631   11.570   53.807   13.351 -4.176193 17.66727 
1 1 1    6   34   19 o   40.377   8.2588   43.225   17.488   68.538   22.963   8.2718   26.984   52.391   10.978   28.362   12.341 24.02873 16.51756 
1 1 1    6   34   20 o   50.601   8.7355   66.390   18.082   54.403   24.015   82.083   27.477   45.109   12.484   56.092   12.222 -10.98321 17.47105 
1 1 1    6   34   21 o   34.869   9.0848   30.355   17.158   21.417   22.291   43.350   26.879   30.646   12.046   39.092   13.602 -8.445614 18.16967 
1 1 1    6   34   22 o   36.523   9.6644   38.256   19.448   40.743   23.525   32.888   34.565   38.057   12.739   34.990   14.537 3.067146 19.32887 
1 1 1    6   34   23 o   29.589   8.6104   9.5757   19.760 -26.3544   29.424   39.094   26.669   22.241   10.726   36.936   13.472 -14.69438 17.22074 
1 1 1    6   34   24 f   31.245   8.9553   23.163   17.847   18.879   23.737   28.733   27.069   29.471   12.127   33.020   13.180 -3.549566 17.91050 
1 1 1    6   34   25 o   27.458   8.8874   4.3962   22.717 -13.2653   39.271   13.278   27.849   26.593   12.711   28.323   12.425 -1.730854 17.77482 
1 1 1    6   34   26 o   29.511   8.8553   19.910   18.568   15.903   24.546   25.269   28.388   27.957   11.963   31.064   13.060 -3.106695 17.71061 
1 1 1    6   34   27 o   23.950   7.8562  -2.9528   18.631   2.1767   25.060  -9.2929   27.860   24.556   11.194   23.344   11.026 1.211954 15.71249 
1 1 1    6   34   28 o   33.647   9.3515   36.707   19.534   46.007   26.759   26.095   28.582   36.899   13.489   30.396   12.955 6.502914 18.70297 
1 1 1    6   34   29 o   28.901   9.1474   21.053   21.995   21.439   27.368   20.349   36.963   28.605   12.438   29.198   13.416 -0.5925655 18.29479 
1 1 1    6   34   30 o   25.833   8.5125  -7.1973   22.688   37.175   34.739 -40.2036   29.961   32.108   13.986   19.557   9.7070 12.55052 17.02492 
1 1 1    6   35    0 o   41.932   3.9416   38.664   9.1642   38.664   9.1642   38.664   9.1642   41.932   5.5742   41.932   5.5742 0.000000 0.000000 
1 1 1    6   35    1 o   74.400   3.0536  116.508   9.3569  112.088   13.416  120.694   13.057   72.979   4.4571   75.822   4.1752 -2.843369 6.107231 
1 1 1    6   35    2 o   83.222   3.7996  152.040   10.845  137.792   22.259  156.475   12.418   79.877   6.7565   86.567   3.4781 -6.690186 7.599179 
1 1 1    6   35    3 o   55.357   3.7383   65.189   8.1276   64.455   13.710   65.587   10.092   54.872   6.0579   55.842   4.3819 -0.9699745 7.476532 
1 1 1    6   35    4 o   56.439   3.8043   67.437   8.3500   68.360   14.462   66.975   10.227   56.453   6.2113   56.425   4.3944 0.2819061E-01 7.608614 
1 1 1    6   35    5 o  126.249   3.8104  332.042   19.615  384.672   30.699  295.733   25.499  134.432   5.5368  118.066   5.2363 16.36644 7.620702 
1 1 1    6   35    6 o   37.763   5.6290   34.087   8.1468   25.620   14.114   38.317   9.9765   33.152   9.7034   42.373   5.7084 -9.221798 11.25795 
1 1 1    6   35    7 o   72.172   3.9234  109.991   10.796  113.845   19.497  108.286   12.965   72.633   6.5082   71.712   4.3835 0.9207535 7.846766 
1 1 1    6   35    8 f   20.326   5.8984   4.4711   7.0354   5.4471   14.142   4.1501   8.1102   22.589   9.3348   18.062   7.2129 4.526880 11.79683 
1 1 1    6   35    9 o   35.315   6.3444   26.517   8.4461   36.001   16.450   23.122   9.8424   38.791   10.161   31.838   7.6005 6.953030 12.68884 
1 1 1    6   35   10 o   65.410   4.5026   87.702   10.894  103.759   21.313   82.023   12.675   68.652   7.5271   62.168   4.9434 6.484138 9.005204 
1 1 1    6   35   11 o   67.260   4.9752  100.666   12.689   93.716   22.396  103.951   15.398   64.717   8.3906   69.802   5.3486 -5.085167 9.950307 
1 1 1    6   35   12 o   37.253   6.4771   35.985   9.5896   20.937   19.144   41.026   11.080   30.924   11.394   43.582   6.1640 -12.65755 12.95430 
1 1 1    6   35   13 o   26.142   6.3591   15.703   8.9085  -6.3280   19.750   21.331   9.9817   21.918   9.9705   30.367   7.8958 -8.449842 12.71828 
1 1 1    6   35   14 o   40.847   6.7372   45.048   10.775   25.385   20.990   52.083   12.555   32.767   11.952   48.926   6.2217 -16.15917 13.47438 
1 1 1    6   35   15 o   63.782   5.3490   86.827   12.063   99.589   24.968   82.940   13.778   65.465   9.2470   62.100   5.3794 3.365242 10.69791 
1 1 1    6   35   16 o   52.046   8.0195   69.587   16.826   77.164   21.925   58.729   26.245   57.517   9.2421   46.575   13.109 10.94176 16.03906 
1 1 1    6   35   17 o   39.250   10.298   43.161   21.545   36.500   42.123   45.522   25.073   37.668   15.876   40.832   13.122 -3.164043 20.59679 
1 1 1    6   35   18 o   28.974   8.3821   8.8279   19.879   33.338   22.723 -71.1202   41.039   35.511   12.498   22.437   11.173 13.07364 16.76429 
1 1 1    6   35   19 o   21.128   7.1194 -18.1594   16.764 -18.9087   21.707 -17.0520   26.390   19.862   9.4814   22.394   10.623 -2.532373 14.23870 
1 1 1    6   35   20 f   39.811   9.0472   45.652   17.388   53.790   23.082   34.974   26.439   44.189   12.243   35.434   13.324 8.755207 18.09447 
1 1 1    6   35   21 o   34.590   8.0410   27.291   17.016   57.872   22.910 -10.3323   25.411   46.147   11.944   23.033   10.768 23.11380 16.08194 
1 1 1    6   35   22 o   28.237   8.8610   5.3584   19.098  -5.7994   22.986   30.230   34.319   22.720   10.490   33.754   14.284 -11.03444 17.72199 
1 1 1    6   35   23 o   24.747   7.9586  -1.4932   17.505 -11.9727   22.629   14.121   27.622   21.125   9.9652   28.369   12.412 -7.244249 15.91710 
1 1 1    6   35   24 o   33.123   9.1914   31.802   18.223   27.285   24.302   37.603   27.542   31.433   12.507   34.812   13.473 -3.379387 18.38286 
1 1 1    6   35   25 o   24.359   8.3360 -18.9472   20.576 -29.9123   23.725   14.336   41.334   18.687   9.1504   30.030   13.936 -11.34241 16.67196 
1 1 1    6   35   26 o   31.416   8.9808   26.667   18.156   13.552   23.651   45.484   28.330   26.498   11.542   36.335   13.763 -9.837301 17.96167 
1 1 1    6   35   27 o   22.112   7.4138 -12.5952   17.972 -28.3031   23.782   8.3177   27.441   18.541   9.0959   25.683   11.710 -7.141407 14.82767 
1 1 1    6   35   28 o   26.666   8.4259   14.123   18.814   10.511   25.185   18.683   28.300   25.496   11.461   27.835   12.354 -2.338720 16.85172 
1 1 1    6   36    0 o   11.567   4.8906   3.0862   5.8628   3.0862   5.8628   3.0862   5.8628   11.567   6.9163   11.567   6.9163 0.000000 0.000000 
1 1 1    6   36    1 o   49.706   6.9839   64.253   9.5460   66.820   10.273   48.011   25.840   56.266   4.4266   43.145   13.248 13.12169 13.96788 
1 1 1    6   36    2 o   24.550   4.8668   13.055   4.8513   14.814   8.7175   12.265   5.8391   25.654   7.6564   23.446   6.0101 2.207960 9.733577 
1 1 1    6   36    3 o   89.956   3.6451  169.707   13.425  196.006   20.505  149.977   17.760   95.953   5.1812   83.960   5.1287 11.99272 7.290291 
1 1 1    6   36    4 o   19.281   5.2501   3.6444   5.7347   11.906   10.248  -0.1217   6.9195   23.935   8.3952   14.627   6.3067 9.308528 10.50015 
1 1 1    6   36    5 o   37.137   5.4613   30.818   7.8736   34.136   12.992   28.892   9.8984   38.411   8.4320   35.863   6.9428 2.548145 10.92252 
1 1 1    6   36    6 o   41.192   5.1288   36.898   8.1302   40.993   13.913   34.774   10.019   42.229   8.2839   40.156   6.0493 2.072575 10.25758 
1 1 1    6   36    7 f   36.529   5.7005   33.587   8.0183   21.568   14.521   38.859   9.6176   30.465   10.000   42.593   5.4747 -12.12802 11.40094 
1 1 1    6   36    8 f   13.994   4.7656 -12.3277   6.1253  -4.2519   13.126 -14.5760   6.9256   18.269   8.2373   9.7183   4.7949 8.550671 9.531233 
1 1 1    6   36    9 o   56.304   4.5593   61.860   9.6620   88.460   18.932   52.492   11.235   63.198   7.2631   49.410   5.5133 13.78824 9.118615 
1 1 1    6   36   10 o   72.105   4.6121  120.135   12.112   98.502   21.931  129.629   14.528   66.073   8.0476   78.138   4.5080 -12.06541 9.224178 
1 1 1    6   36   11 o   26.052   6.7710   14.434   8.9942   9.5830   18.235   15.993   10.339   25.687   10.606   26.417   8.4199 -0.7301521 13.54205 
1 1 1    6   36   12 o   45.246   8.1707   54.279   15.969   69.432   21.602   36.022   23.712   53.400   10.180   37.092   12.783 16.30780 16.34148 
1 1 1    6   36   13 o   78.181   4.7164  139.196   13.281  124.681   25.101  144.839   15.651   73.918   8.2335   82.445   4.6028 -8.526924 9.432719 
1 1 1    6   36   14 o   38.384   7.3879   31.369   10.383   50.477   22.460   26.175   11.710   43.662   12.069   33.107   8.5244 10.55559 14.77589 
1 1 1    6   36   15 o   50.017   6.5101   58.381   11.012   62.693   23.020   57.102   12.539   48.973   11.579   51.062   5.9539 -2.089756 13.02015 
1 1 1    6   36   16 o   97.137   5.3471  212.542   21.274  247.394   32.260  185.720   28.300  104.153   7.5098   90.122   7.6138 14.03163 10.69423 
1 1 1    6   36   17 o   43.370   8.1271   54.252   11.741   37.674   37.641   56.039   12.357   36.284   15.131   50.456   5.9380 -14.17240 16.25417 
1 1 1    6   36   18 o   31.521   9.2420   22.815   18.211   25.395   20.412   12.746   40.318   31.624   11.743   31.418   14.274 0.2061462 18.48408 
1 1 1    6   36   19 o   27.009   8.1410   11.790   15.679   11.751   20.010   11.851   25.234   26.258   10.998   27.759   12.006 -1.500776 16.28195 
1 1 1    6   36   20 f   30.520   8.1603   21.023   16.448   40.053   21.327  -6.9099   25.838   37.534   12.106   23.505   10.945 14.02864 16.32064 
1 1 1    6   36   21 o   42.556   7.5614   52.488   18.038   89.123   23.609   1.1119   27.959   59.651   9.5963   25.461   11.688 34.19006 15.12272 
1 1 1    6   36   22 o   29.194   8.7729   16.533   19.414   34.253   27.312  -1.5675   27.602   33.671   13.302   24.716   11.442 8.954744 17.54589 
1 1 1    6   36   23 o   24.812   7.9569   4.1199   17.455   4.6649   22.862   3.3581   27.028   24.341   10.932   25.283   11.564 -0.9425526 15.91370 
1 1 1    6   36   24 o   35.441   10.165   30.363   23.116   91.734   41.206   2.1798   27.924   45.980   16.750   24.901   11.520 21.07911 20.32923 
1 1 1    6   36   25 o   20.355   7.3201 -44.4027   19.418 -51.2012   21.663 -16.6055   43.804   15.156   7.6280   25.554   12.496 -10.39848 14.64023 
1 1 1    6   36   26 o   30.242   8.7368   27.375   18.710   41.017   24.291   7.4725   29.339   34.785   12.831   25.698   11.861 9.086655 17.47353 
1 1 1    6   37    0 o   40.867   3.4980   36.504   8.0135   36.504   8.0135   36.504   8.0135   40.867   4.9469   40.867   4.9469 0.000000 0.000000 
1 1 1    6   37    1 o   52.106   6.3597   61.931   10.399   61.048   11.565   65.658   23.760   53.329   5.2579   50.883   11.582 2.446880 12.71931 
1 1 1    6   37    2 o   74.467   5.2260  117.752   13.754  112.333   15.699  135.648   28.531   72.334   5.2623   76.600   9.0307 -4.266571 10.45206 
1 1 1    6   37    3 f   25.442   6.2726   14.655   6.5404   0.0000   0.0000   14.655   6.5404  ?   ?    25.442   6.2726      ?      ? 
1 1 1    6   37    4 o   38.811   4.5603   31.982   6.7106   37.865   11.979   29.292   8.1010   40.711   7.4074   36.911   5.3214 3.800224 9.120621 
1 1 1    6   37    5 o   53.887   4.3578   62.921   9.4691   65.350   15.158   61.366   12.126   54.441   6.7506   53.334   5.5128 1.107811 8.715587 
1 1 1    6   37    6 o   43.830   4.9915   42.948   8.0027   43.635   14.607   42.653   9.5662   43.100   8.5188   44.561   5.2050 -1.460129 9.983074 
1 1 1    6   37    7 o   25.690   6.1326   12.605   7.0547   21.730   13.673   9.2944   8.2355   30.145   9.6906   21.236   7.5186 8.908175 12.26526 
1 1 1    6   37    8 o   29.061   6.4452   17.825   7.7757   26.193   15.350   14.937   9.0185   32.632   10.242   25.490   7.8265 7.142601 12.89031 
1 1 1    6   37    9 o   70.294   5.4127  112.406   15.535  124.871   21.523   98.849   22.445   74.920   6.9652   65.669   8.2870 9.250946 10.82534 
1 1 1    6   37   10 o   21.203   6.1672   6.3523   7.8979   1.3900   16.544   7.8171   8.9882   21.889   9.5902   20.518   7.7567 1.370665 12.33445 
1 1 1    6   37   11 o   50.157   5.9438   57.028   11.055   64.396   20.197   53.877   13.209   51.026   9.9544   49.287   6.4980 1.739059 11.88753 
1 1 1    6   37   12 o   29.523   7.0590   19.888   8.9421   23.653   19.639   18.903   10.044   30.928   11.512   28.117   8.1727 2.811050 14.11800 
1 1 1    6   37   13 o   29.444   6.7866   22.099   9.2527   13.330   19.358   24.696   10.534   26.767   10.976   32.122   7.9854 -5.354725 13.57324 
1 1 1    6   37   14 o   38.625   7.1635   36.057   10.335   42.152   21.278   34.174   11.823   39.211   12.019   38.039   7.7980 1.172131 14.32693 
1 1 1    6   37   15 o   46.728   6.7215   48.786   10.700   63.559   23.328   44.850   12.042   48.631   11.760   44.824   6.5134 3.807541 13.44293 
1 1 1    6   37   16 o   18.197   5.4955  -1.7391   8.7267 -61.9145   22.112   9.3622   9.4976   14.919   7.5334   21.474   8.0031 -6.555358 10.99101 
1 1 1    6   37   17 o   66.170   5.3706   95.934   14.657   0.0000   0.0000   95.934   14.657  ?   ?    66.170   5.3706      ?      ? 
1 1 1    6   37   18 o   57.634   6.2212   86.862   12.915   60.093   20.982  103.191   16.387   47.164   10.990   68.104   5.8340 -20.93970 12.44241 
1 1 1    6   37   19 o   40.211   13.390   50.990   25.996   0.0000   0.0000   50.990   25.996  ?   ?    40.211   13.390      ?      ? 
1 1 1    6   37   20 o   22.535   7.2546  -5.0255   15.951   11.685   20.806 -28.8567   24.846   25.732   11.013   19.338   9.4467 6.394379 14.50919 
1 1 1    6   37   21 o   18.966   6.5576 -27.4832   16.940 -12.4911   19.758 -69.0794   32.911   19.298   9.1650   18.634   9.3816 0.6643219 13.11527 
1 1 1    6   37   22 o   34.243   8.7278   32.284   19.000  -1.6165   26.843   66.317   26.896   23.775   11.099   44.711   13.472 -20.93618 17.45551 
1 1 1    6   37   23 o   31.035   8.6997   29.520   17.662   41.716   23.547   13.832   26.705   35.440   12.696   26.629   11.898 8.810753 17.39941 
1 1 1    6   37   24 o   23.612   8.0423 -12.0692   23.474 -40.9485   41.573   1.4471   28.441   22.808   11.340   24.416   11.407 -1.607986 16.08459 
1 1 1    6   38    0 o   10.458   5.2449 -15.9595   13.440 -15.9595   13.440 -15.9595   13.440   10.458   7.4175   10.458   7.4175 0.000000 0.000000 
1 1 1    6   38    1 o   62.322   4.9125   83.512   12.627   83.512   12.627   0.0000   0.0000   62.322   4.9125  ?   ?       ?      ? 
1 1 1    6   38    2 o   28.118   6.7850   17.607   7.6466   17.721   8.2182   16.870   20.869   27.575   7.1619   28.662   11.526 -1.087543 13.57007 
1 1 1    6   38    3 o   35.151   4.0180   23.411   5.2800   39.289   10.128   17.484   6.1873   42.384   5.7937   27.918   5.5687 14.46554 8.035988 
1 1 1    6   38    4 o   60.437   4.6179   82.148   10.888  115.416   15.836   52.317   14.995   72.978   5.2611   47.896   7.5909 25.08241 9.235885 
1 1 1    6   38    5 o   61.874   3.7217   80.524   8.9191   90.530   15.920   75.947   10.768   64.121   6.0196   59.627   4.3783 4.494087 7.443446 
1 1 1    6   38    6 o   28.014   5.9511   18.304   6.9965   19.850   12.945   17.666   8.3158   28.594   9.4449   27.434   7.2427 1.159599 11.90222 
1 1 1    6   38    7 o   51.403   4.7099   59.131   9.1419   58.890   16.508   59.238   10.979   50.490   7.9275   52.316   5.0881 -1.826332 9.419876 
1 1 1    6   38    8 o   14.893   4.9469  -6.6894   6.7160  -7.7008   13.219  -6.3375   7.7973   17.004   7.8878   12.783   5.9725 4.221154 9.893831 
1 1 1    6   38    9 o   20.077   6.3734  -3.9065   11.483   5.1006   14.818 -17.4465   18.167   22.046   9.3605   18.108   8.6523 3.938578 12.74678 
1 1 1    6   38   10 o   30.533   6.6263   22.184   8.4399   24.725   16.487   21.282   9.8248   31.223   10.663   29.843   7.8696 1.380358 13.25264 
1 1 1    6   38   11 o   32.815   6.4713   29.875   9.7703   11.693   18.659   36.743   11.468   25.887   10.712   39.744   7.2637 -13.85708 12.94252 
1 1 1    6   38   12 o   15.628   5.1909  -6.8409   7.7893 -30.7297   18.138  -1.4393   8.6251   15.907   7.8312   15.349   6.8159 0.5577955 10.38189 
1 1 1    6   38   13 o   24.540   6.8521   12.069   8.9323   9.0912   20.726   12.749   9.8987   25.431   10.940   23.650   8.2533 1.781082 13.70424 
1 1 1    6   38   14 f   24.587   7.1674   7.9506   9.5049   22.537   21.899   4.5651   10.550   29.897   11.880   19.277   8.0223 10.61985 14.33479 
1 1 1    6   38   15 o   41.263   7.2792   43.028   17.441   90.324   24.315  -7.0935   25.030   59.656   9.8820   22.870   10.691 36.78658 14.55830 
1 1 1    6   38   16 o   35.392   6.3131   38.664   11.232   0.8272   22.883   50.675   12.893   23.639   10.745   47.145   6.6303 -23.50662 12.62627 
1 1 1    6   38   17 o   23.359   6.7779   10.444   9.9883  -4.2769   22.788   13.944   11.113   22.399   10.378   24.320   8.7205 -1.920643 13.55576 
1 1 1    6   38   18 o   31.993   6.8514   30.993   11.573   2.4607   23.701   39.926   13.261   23.938   10.902   40.049   8.3010 -16.11127 13.70272 
1 1 1    6   38   19 o   31.674   7.2728   27.108   10.226   29.678   19.613   26.149   11.984   31.673   11.553   31.676   8.8376 -0.3021240E-02 14.54565 
1 1 1    6   38   20 o   21.736   6.9969  -7.0831   15.686   15.138   19.861 -43.9190   25.571   25.874   10.903   17.597   8.7721 8.277254 13.99370 
1 1 1    6   38   21 o   26.000   7.9084   12.392   17.313   26.979   20.336 -26.0167   32.999   30.034   11.590   21.966   10.763 8.068142 15.81678 
1 1 1    6   39    8 o   22.890   7.4976  -3.5227   12.435  -6.6070   13.663   11.358   30.011   17.431   8.0622   28.349   12.643 -10.91804 14.99523 
1 1 1    6   39    9 o   20.427   6.8553  -7.9406   13.151  -3.5017   14.549 -27.7639   30.746   18.795   8.5531   22.059   10.716 -3.263411 13.71056 
1 1 1    6   39   10 o   29.093   8.2759   21.094   15.468   27.015   17.487  -0.1917   33.157   31.582   10.973   26.605   12.392 4.977604 16.55179 
1 1 1    6   39   11 o   31.435   9.1458   20.475   15.909   13.205   17.848   48.583   35.096   25.596   10.522   37.274   14.962 -11.67836 18.29163 
1 1 1    6   39   12 o   32.091   7.5839   26.998   14.079   45.471   18.611   2.2793   21.529   40.706   10.877   23.477   10.571 17.22860 15.16776 
1 1 1    6   39   13 o   40.066   6.7594   44.958   10.380   33.123   20.998   48.785   11.941   33.675   11.997   46.457   6.2322 -12.78131 13.51887 
1 1 1    6   39   14 o   24.371   7.1079   7.9286   9.2178   24.783   21.690   4.2134   10.183   30.034   11.858   18.708   7.8410 11.32694 14.21586 
1 1 1    6   39   15 o   26.552   7.1142   4.2369   9.2089   44.428   22.202  -4.1143   10.120   37.757   12.365   15.347   7.0402 22.41005 14.22833 
1 1 1    6   39   16 o   21.652   6.2611   7.3726   9.9787 -22.6839   21.508   15.617   11.264   18.308   8.9094   24.996   8.7992 -6.688232 12.52212 
1 1 1    6   39   17 o   44.342   6.5329   33.698   10.690  102.496   24.396   17.348   11.893   62.745   9.4272   25.939   9.0468 36.80555 13.06582 
1 1 1    6   39   18 o   24.510   6.9514   14.266   10.177   1.3903   24.243   17.020   11.213   23.316   10.768   25.705   8.7936 -2.388565 13.90277 
1 1 1    7    0    1 o  238.505   2.2109  1173.93   30.745  1173.93   30.745  1173.93   30.745  238.505   3.1267  238.505   3.1267 0.000000 0.000000 
1 1 1    7    0    2 o  401.789   3.0612  3331.70   71.722  3331.70   71.722  3331.70   71.722  401.789   4.3291  401.789   4.3291 0.000000 0.000000 
1 1 1    7    0    3 o  528.000   3.8015  5754.99  117.050  5754.99  117.050  5754.99  117.050  528.000   5.3762  528.000   5.3762 0.000000 0.000000 
1 1 1    7    0    4 o   41.207   2.2656   35.657   5.3697   35.657   5.3697   35.657   5.3697   41.207   3.2040   41.207   3.2040 0.000000 0.000000 
1 1 1    7    0    5 o  242.493   2.2366  1213.62   31.623  1213.62   31.623  1213.62   31.623  242.493   3.1630  242.493   3.1630 0.000000 0.000000 
1 1 1    7    0    6 o  387.086   2.9844  3092.67   67.365  3092.67   67.365  3092.67   67.365  387.086   4.2206  387.086   4.2206 0.000000 0.000000 
1 1 1    7    0    8 o  141.374   2.3102  412.951   19.027  412.951   19.027  412.951   19.027  141.374   3.2671  141.374   3.2671 0.000000 0.000000 
1 1 1    7    0    9 o  230.917   2.2757  1100.58   30.639  1100.58   30.639  1100.58   30.639  230.917   3.2184  230.917   3.2184 0.000000 0.000000 
1 1 1    7    0   10 o  397.849   3.0828  3266.79   71.519  3266.79   71.519  3266.79   71.519  397.849   4.3597  397.849   4.3597 0.000000 0.000000 
1 1 1    7    0   11 o  431.895   3.2766  3849.64   82.523  3849.64   82.523  3849.64   82.523  431.895   4.6338  431.895   4.6338 0.000000 0.000000 
1 1 1    7    0   12 o  298.706   2.6384  1841.25   45.953  1841.25   45.953  1841.25   45.953  298.706   3.7312  298.706   3.7312 0.000000 0.000000 
1 1 1    7    0   13 o  268.735   2.5493  1490.36   39.944  1490.36   39.944  1490.36   39.944  268.735   3.6052  268.735   3.6052 0.000000 0.000000 
1 1 1    7    0   14 o   19.773   7.7209   11.097   12.981   11.097   12.981   11.097   12.981   19.773   10.919   19.773   10.919 0.000000 0.000000 
1 1 1    7    0   15 o  292.627   3.1175  1767.55   53.184  1767.55   53.184  1767.55   53.184  292.627   4.4089  292.627   4.4089 0.000000 0.000000 
1 1 1    7    0   16 o   62.227   4.7662   82.679   16.785   82.679   16.785   82.679   16.785   62.227   6.7404   62.227   6.7404 0.000000 0.000000 
1 1 1    7    0   17 o  518.440   3.8365  5547.23  115.985  5547.23  115.985  5547.23  115.985  518.440   5.4256  518.440   5.4256 0.000000 0.000000 
1 1 1    7    0   18 o  130.617   2.6727  352.802   20.324  352.802   20.324  352.802   20.324  130.617   3.7797  130.617   3.7797 0.000000 0.000000 
1 1 1    7    0   19 o  349.861   2.9813  2526.26   60.819  2526.26   60.819  2526.26   60.819  349.861   4.2162  349.861   4.2162 0.000000 0.000000 
1 1 1    7    0   20 o  342.537   3.4473  2422.51   68.845  2422.51   68.845  2422.51   68.845  342.537   4.8752  342.537   4.8752 0.000000 0.000000 
1 1 1    7    0   21 o  132.310   2.8751  362.200   22.141  362.200   22.141  362.200   22.141  132.310   4.0660  132.310   4.0660 0.000000 0.000000 
1 1 1    7    0   22 o  107.115   3.5224  238.325   21.899  238.325   21.899  238.325   21.899  107.115   4.9815  107.115   4.9815 0.000000 0.000000 
1 1 1    7    0   23 o  495.460   3.7638  5069.37  108.743  5069.37  108.743  5069.37  108.743  495.460   5.3228  495.460   5.3228 0.000000 0.000000 
1 1 1    7    0   24 o  315.816   2.9593  2059.47   54.491  2059.47   54.491  2059.47   54.491  315.816   4.1850  315.816   4.1850 0.000000 0.000000 
1 1 1    7    0   25 o  201.389   2.7848  838.048   32.684  838.048   32.684  838.048   32.684  201.389   3.9383  201.389   3.9383 0.000000 0.000000 
1 1 1    7    0   26 f  110.208   4.7016  253.791   29.971  253.791   29.971  253.791   29.971  110.208   6.6490  110.208   6.6490 0.000000 0.000000 
1 1 1    7    0   27 o   86.898   4.3474  158.394   21.782  158.394   21.782  158.394   21.782   86.898   6.1481   86.898   6.1481 0.000000 0.000000 
1 1 1    7    0   28 o  156.596   3.3465  507.831   30.504  507.831   30.504  507.831   30.504  156.596   4.7327  156.596   4.7327 0.000000 0.000000 
1 1 1    7    0   29 o   27.383   11.533   17.276   32.359   17.276   32.359   17.276   32.359   27.383   16.310   27.383   16.310 0.000000 0.000000 
1 1 1    7    0   30 o  159.992   3.0692  529.805   28.595  529.805   28.595  529.805   28.595  159.992   4.3406  159.992   4.3406 0.000000 0.000000 
1 1 1    7    0   31 o   71.991   5.3477  110.850   21.888  110.850   21.888  110.850   21.888   71.991   7.5628   71.991   7.5628 0.000000 0.000000 
1 1 1    7    0   32 o   27.511   10.293   22.993   22.131   22.993   22.131   22.993   22.131   27.511   14.556   27.511   14.556 0.000000 0.000000 
1 1 1    7    0   33 o  159.733   3.3823  528.727   31.449  528.727   31.449  528.727   31.449  159.733   4.7832  159.733   4.7832 0.000000 0.000000 
1 1 1    7    0   34 o   15.439   7.6211 -23.8249   25.078 -23.8249   25.078 -23.8249   25.078   15.439   10.778   15.439   10.778 0.000000 0.000000 
1 1 1    7    0   35 o   93.284   4.9138  183.592   26.395  183.592   26.395  183.592   26.395   93.284   6.9491   93.284   6.9491 0.000000 0.000000 
1 1 1    7    0   36 o  137.611   4.9829  396.613   39.757  396.613   39.757  396.613   39.757  137.611   7.0469  137.611   7.0469 0.000000 0.000000 
1 1 1    7    0   37 o   65.729   8.8790  100.648   30.438  100.648   30.438  100.648   30.438   65.729   12.557   65.729   12.557 0.000000 0.000000 
1 1 1    7    0   38 f   59.986   9.6089   87.398   29.317   87.398   29.317   87.398   29.317   59.986   13.589   59.986   13.589 0.000000 0.000000 
1 1 1    7    0   39 o   22.381   10.003   6.6340   27.937   6.6340   27.937   6.6340   27.937   22.381   14.147   22.381   14.147 0.000000 0.000000 
1 1 1    7    0   40 o   21.210   9.4777   6.3211   25.062   6.3211   25.062   6.3211   25.062   21.210   13.404   21.210   13.404 0.000000 0.000000 
1 1 1    7    0   41 o   20.803   9.2393   7.0579   23.413   7.0579   23.413   7.0579   23.413   20.803   13.066   20.803   13.066 0.000000 0.000000 
1 1 1    7    0   42 o   24.407   10.546   14.495   28.518   14.495   28.518   14.495   28.518   24.407   14.914   24.407   14.914 0.000000 0.000000 
1 1 1    7    0   43 o   27.371   10.630   25.148   24.457   25.148   24.457   25.148   24.457   27.371   15.033   27.371   15.033 0.000000 0.000000 
1 1 1    7    0   44 o   57.935   8.6356   82.395   25.684   82.395   25.684   82.395   25.684   57.935   12.213   57.935   12.213 0.000000 0.000000 
1 1 1    7    0   45 o   16.124   7.8472 -13.3775   24.293 -13.3775   24.293 -13.3775   24.293   16.124   11.098   16.124   11.098 0.000000 0.000000 
1 1 1    7    0   46 o   15.718   7.6309 -11.2118   22.640 -11.2118   22.640 -11.2118   22.640   15.718   10.792   15.718   10.792 0.000000 0.000000 
1 1 1    7    0   47 o   20.902   9.2346   10.908   23.067   10.908   23.067   10.908   23.067   20.902   13.060   20.902   13.060 0.000000 0.000000 
1 1 1    7    0   48 o   13.013   6.6365 -39.3584   25.486 -39.3584   25.486 -39.3584   25.486   13.013   9.3855   13.013   9.3855 0.000000 0.000000 
1 1 1    7    0   49 o   19.653   9.2388   2.6553   28.338   2.6553   28.338   2.6553   28.338   19.653   13.066   19.653   13.066 0.000000 0.000000 
1 1 1    7    0   50 o   20.532   9.9410  -3.2653   37.845  -3.2653   37.845  -3.2653   37.845   20.532   14.059   20.532   14.059 0.000000 0.000000 
1 1 1    7    1    0 o  399.731   3.0466  3297.57   71.015  3297.57   71.015  3297.57   71.015  399.731   4.3086  399.731   4.3086 0.000000 0.000000 
1 1 1    7    1    1 o  260.129   2.3095  1395.66   24.772  1377.18   34.578  1415.15   35.506  258.361   3.2450  261.897   3.2871 -3.536041 4.618918 
1 1 1    7    1    2 o  505.452   3.6655  5274.73   76.408  5303.84  108.955  5246.55  107.182  506.820   5.2123  504.083   5.1553 2.737549 7.331095 
1 1 1    7    1    3 o  360.722   2.8310  2685.27   42.115  2668.86   59.092  2702.20   60.037  359.604   3.9842  361.840   4.0229 -2.236115 5.661936 
1 1 1    7    1    4 o  202.433   2.0638  845.220   17.227  833.030   24.077  858.008   24.660  200.938   2.9052  203.927   2.9319 -2.989380 4.127505 
1 1 1    7    1    5 o  270.621   2.3676  1511.27   26.427  1511.97   37.398  1510.56   37.348  270.685   3.3498  270.558   3.3469 0.1263428 4.735283 
1 1 1    7    1    6 f  316.187   2.5993  2063.03   33.893  2045.69   47.482  2081.06   48.394  314.833   3.6567  317.541   3.6951 -2.707764 5.198568 
1 1 1    7    1    7 o  384.502   4.2279  3034.81   66.577  2894.25   88.244  3220.53  101.438  374.271   5.7165  394.733   6.2306 -20.46234 8.455761 
1 1 1    7    1    8 o  336.920   4.4525  2343.52   61.872  2343.52   61.872   0.0000   0.0000  336.920   4.4525  ?   ?       ?      ? 
1 1 1    7    1    9 o  362.240   2.8775  2708.20   42.988  2695.78   60.417  2720.93   61.180  361.400   4.0532  363.080   4.0855 -1.679535 5.754988 
1 1 1    7    1   10 o  218.096   2.8927  986.882   25.723  1019.51   34.230  944.549   38.990  222.274   3.7338  213.919   4.4191 8.354950 5.785341 
1 1 1    7    1   11 o  268.242   2.5584  1480.33   27.290  1468.73   34.243  1500.52   45.179  266.824   3.1115  269.661   4.0621 -2.837280 5.116892 
1 1 1    7    1   12 o  432.109   3.3096  3852.82   58.983  3863.85   83.709  3841.94   83.122  432.723   4.6903  431.496   4.6706 1.227386 6.619146 
1 1 1    7    1   13 f  174.918   2.3307  631.101   16.813  628.386   23.617  633.891   23.941  174.537   3.2807  175.299   3.3113 -0.7623901 4.661317 
1 1 1    7    1   14 o  588.041   4.2291  7138.17  102.567  7113.58  144.294  7163.29  145.822  587.019   5.9598  589.063   6.0020 -2.043213 8.458292 
1 1 1    7    1   15 o  562.577   4.7227  6533.94  109.565  6499.65  153.445  6569.62  156.497  561.076   6.6308  564.078   6.7267 -3.002136 9.445420 
1 1 1    7    1   16 o  186.606   2.7693  716.820   21.283  747.903   31.135  689.557   29.160  190.393   3.9649  182.818   3.8672 7.575272 5.538568 
1 1 1    7    1   17 o  232.110   2.5192  1109.37   24.089  1069.69   33.100  1154.04   35.124  227.707   3.5244  236.512   3.6007 -8.805038 5.038459 
1 1 1    7    1   18 o  513.916   3.8177  5450.97   80.902  5500.27  115.860  5404.06  113.019  516.179   5.4421  511.653   5.3556 4.526276 7.635412 
1 1 1    7    1   19 o  238.611   2.9801  1175.08   29.327  1166.62   41.587  1183.45   41.363  237.756   4.2409  239.467   4.1879 -1.711380 5.960216 
1 1 1    7    1   20 o  195.706   2.9724  790.548   23.961  790.893   33.050  790.165   34.788  195.755   4.0935  195.656   4.3109 0.9881592E-01 5.944772 
1 1 1    7    1   21 o  419.066   3.3275  3625.88   57.508  3604.99   80.734  3647.40   81.935  417.843   4.6847  420.288   4.7267 -2.445618 6.654905 
1 1 1    7    1   22 o  169.340   2.9321  589.580   20.324  611.059   30.929  573.258   26.962  172.033   4.3590  166.646   3.9228 5.387054 5.864179 
1 1 1    7    1   23 o  281.497   2.8274  1635.97   32.826  1626.78   46.197  1645.34   46.652  280.699   3.9903  282.295   4.0069 -1.595459 5.654880 
1 1 1    7    1   24 o  209.293   2.7483  904.410   23.722  916.920   33.725  892.159   33.375  210.726   3.8804  207.861   3.8929 2.865692 5.496559 
1 1 1    7    1   25 o  214.252   2.9479  944.273   25.867  982.115   39.288  915.318   34.367  218.004   4.3694  210.499   3.9584 7.505280 5.895837 
1 1 1    7    1   26 o  100.622   4.2308  210.027   17.481  204.790   25.779  214.485   23.786   99.438   6.2857  101.806   5.6648 -2.367790 8.461626 
1 1 1    7    1   27 o  296.050   2.9207  1810.57   35.654  1786.05   49.772  1836.41   51.099  293.996   4.1047  298.104   4.1560 -4.108521 5.841307 
1 1 1    7    1   28 o   59.250   5.8721   73.054   14.349   74.175   20.324   71.940   20.260   59.706   8.2534   58.793   8.3552 0.9126320 11.74426 
1 1 1    7    1   29 o  179.081   4.0099  663.989   28.464  666.238   47.340  662.715   35.623  179.202   6.4050  178.959   4.8262 0.2426605 8.019730 
1 1 1    7    1   30 o  158.737   3.1466  520.975   20.586  515.375   28.504  527.080   29.762  157.854   4.3781  159.620   4.5207 -1.766937 6.293173 
1 1 1    7    1   31 o  207.593   3.2432  891.658   27.765  898.589   39.627  884.974   38.913  208.381   4.6107  206.804   4.5622 1.577164 6.486310 
1 1 1    7    1   32 o   68.623   5.8019   98.012   16.398   91.685   22.566  105.091   23.869   66.278   8.2552   70.968   8.1546 -4.690453 11.60372 
1 1 1    7    1   33 o  132.711   4.1682  365.727   22.181  366.102   28.252  365.125   35.812  132.903   5.1540  132.520   6.5522 0.3832855 8.336349 
1 1 1    7    1   34 o   25.452   8.1656 -16.4295   19.011 -30.7255   27.942  -4.1078   25.941   23.333   11.027   27.570   12.046 -4.237307 16.33113 
1 1 1    7    1   35 o   40.293   9.2055   22.901   19.464   64.185   31.522  -2.5376   24.744   53.368   14.107   27.217   11.830 26.15106 18.41096 
1 1 1    7    1   36 o   69.420   6.5112  102.012   18.618  101.075   25.632  103.059   27.088   69.125   8.9905   69.715   9.4209 -0.5893707 13.02237 
1 1 1    7    1   37 o   44.427   9.2746   30.647   22.227   86.935   34.230 -10.3910   29.228   61.402   13.847   27.452   12.343 33.94979 18.54918 
1 1 1    7    1   38 o   39.614   9.7082   34.140   19.896   43.306   24.723   17.297   33.516   43.438   12.878   35.789   14.531 7.649616 19.41645 
1 1 1    7    1   39 o   35.063   8.9911   24.674   16.811   21.570   24.076   27.627   23.485   33.926   12.723   36.199   12.708 -2.272488 17.98224 
1 1 1    7    1   40 o   34.662   9.5098   19.878   18.768   32.732   31.767   12.986   23.262   39.159   14.628   30.165   12.156 8.994091 19.01951 
1 1 1    7    1   41 f   80.500   5.7660  142.471   18.922  157.967   25.984  124.976   27.609   85.601   7.3598   75.399   8.8780 10.20271 11.53197 
1 1 1    7    1   42 o   39.086   9.8377   27.041   20.738   7.1493   26.124   60.931   34.099   29.274   12.429   48.897   15.253 -19.62303 19.67548 
1 1 1    7    1   43 o   25.913   7.9510  -5.8209   17.323 -31.0756   25.063   17.279   23.970   20.611   9.9297   31.216   12.421 -10.60562 15.90202 
1 1 1    7    1   44 o   39.150   9.7810   27.599   21.459   70.427   34.703   1.0838   27.306   50.761   15.305   27.539   12.183 23.22227 19.56201 
1 1 1    7    1   45 o   26.269   8.4234  -4.3559   19.746   2.6358   25.290 -15.2749   31.604   26.779   11.792   25.760   12.032 1.018965 16.84675 
1 1 1    7    1   46 o   43.593   8.8223   50.458   16.679   52.059   23.359   48.792   23.823   44.427   12.319   42.760   12.632 1.667549 17.64451 
1 1 1    7    1   47 o   36.002   7.7453   27.332   16.112  -7.7297   22.429   64.719   23.160   22.371   10.341   49.633   11.534 -27.26163 15.49061 
1 1 1    7    1   48 o   26.628   8.1284   8.4043   16.665   17.228   22.931  -1.4726   24.261   28.924   11.913   24.332   11.062 4.592052 16.25671 
1 1 1    7    1   49 o   21.657   7.3450 -26.4636   19.555   0.2079   27.389 -54.1939   27.927   25.159   11.556   18.155   9.0688 7.003702 14.68992 
1 1 1    7    1   50 o   35.965   10.411   36.544   29.291 -19.4832   42.830   85.773   40.148   25.950   12.615   45.979   16.566 -20.02940 20.82269 
1 1 1    7    2    0 o  302.083   2.5181  1883.20   44.356  1883.20   44.356  1883.20   44.356  302.083   3.5612  302.083   3.5612 0.000000 0.000000 
1 1 1    7    2    1 o  205.339   2.0660  869.609   17.494  857.165   24.448  882.665   25.042  203.834   2.9081  206.843   2.9354 -3.008972 4.132004 
1 1 1    7    2    2 f  173.729   1.9487  622.635   13.963  619.391   19.688  625.919   19.806  173.274   2.7548  174.185   2.7569 -0.9106140 3.897398 
1 1 1    7    2    3 o  221.496   2.1368  1012.17   19.520  1019.17   27.752  1005.32   27.462  222.254   3.0275  220.739   3.0164 1.514679 4.273688 
1 1 1    7    2    4 o  145.561   1.8741  437.118   11.251  436.095   15.899  438.143   15.925  145.391   2.6513  145.732   2.6494 -0.3410339 3.748183 
1 1 1    7    2    5 f   86.014   2.5182  152.723   8.9274  159.826   12.663  145.705   12.588   88.004   3.4887   84.024   3.6324 3.979935 5.036402 
1 1 1    7    2    6 o  270.091   2.9016  1506.99   30.515  1502.47   52.669  1509.27   37.438  269.742   4.7341  270.440   3.3564 -0.6981506 5.803244 
1 1 1    7    2    7 o  471.217   4.4698  4599.55   85.627  4529.87  132.273  4649.81  112.343  468.043   6.8520  474.391   5.7417 -6.347412 8.939672 
1 1 1    7    2    8 o  362.060   3.3094  2706.57   49.420  2710.79   69.863  2702.34   69.917  362.343   4.6748  361.777   4.6857 0.5661011 6.618891 
1 1 1    7    2    9 o  308.174   3.0028  1958.77   38.133  1995.45   55.300  1925.51   52.653  310.918   4.3123  305.430   4.1797 5.488312 6.005539 
1 1 1    7    2   10 f   84.879   2.2725  148.639   7.9551  148.654   11.312  148.624   11.189   84.883   3.2311   84.875   3.1964 0.8316040E-02 4.545000 
1 1 1    7    2   11 o  304.672   2.8504  1916.99   35.534  1928.42   47.437  1902.38   53.639  305.719   3.7621  303.626   4.2833 2.093628 5.700874 
1 1 1    7    2   12 o   95.548   2.5400  180.176   9.5626  162.836   11.666  215.682   16.694   88.848   3.1836  102.247   3.9586 -13.39854 5.079918 
1 1 1    7    2   13 o  182.165   2.3505  684.487   17.659  688.364   25.112  680.693   24.838  182.675   3.3330  181.654   3.3152 1.020355 4.700980 
1 1 1    7    2   14 o  391.810   3.1252  3166.99   50.494  3197.69   72.248  3137.68   70.600  393.664   4.4497  389.956   4.3896 3.707977 6.250482 
1 1 1    7    2   15 o  250.622   2.9357  1291.53   30.289  1369.29   44.525  1224.56   41.323  257.618   4.1905  243.626   4.1125 13.99220 5.871361 
1 1 1    7    2   16 o  139.235   2.8859  399.830   16.552  403.103   24.069  396.894   22.797  139.773   4.1752  138.696   3.9852 1.077301 5.771834 
1 1 1    7    2   17 o  424.507   3.3142  3718.85   58.026  3717.91   82.060  3719.78   82.064  424.454   4.6874  424.561   4.6865 -0.1068115 6.628343 
1 1 1    7    2   18 o  406.268   3.2316  3405.50   54.136  3440.68   77.601  3372.14   75.559  408.310   4.6080  404.227   4.5321 4.082855 6.463243 
1 1 1    7    2   19 o   71.187   4.5628  104.015   13.339  111.890   20.027   97.736   17.884   73.590   6.5983   68.784   6.3039 4.806007 9.125670 
1 1 1    7    2   20 o  242.973   3.0469  1218.64   30.531  1240.22   43.201  1197.10   43.153  245.124   4.2731  240.822   4.3446 4.302460 6.093860 
1 1 1    7    2   21 o  149.512   2.7483  461.252   16.945  471.005   24.200  451.871   23.735  151.062   3.8842  147.962   3.8893 3.100327 5.496662 
1 1 1    7    2   22 o  296.580   2.8478  1815.16   34.824  1840.02   50.013  1791.76   48.518  298.548   4.0616  294.612   3.9929 3.935791 5.695595 
1 1 1    7    2   23 o   48.542   6.9499   50.450   13.424   56.546   19.643   45.107   18.388   51.366   9.6256   45.718   10.027 5.648315 13.89971 
1 1 1    7    2   24 o  303.668   2.8976  1904.35   36.290  1893.47   51.039  1915.46   51.609  302.793   4.0869  304.543   4.1088 -1.750977 5.795225 
1 1 1    7    2   25 o  216.116   3.1306  965.731   27.888  983.442   39.015  947.225   39.880  218.153   4.3361  214.079   4.5166 4.073257 6.261139 
1 1 1    7    2   26 o  240.672   2.9917  1196.50   29.515  1193.82   39.591  1199.86   44.285  240.394   3.9930  240.950   4.4562 -0.5559082 5.983486 
1 1 1    7    2   27 o  176.189   2.9182  641.050   21.198  659.485   30.470  623.757   29.511  178.641   4.1355  173.736   4.1183 4.904861 5.836342 
1 1 1    7    2   28 o   86.871   4.3622  156.938   15.554  174.180   21.962  139.586   22.032   91.699   5.8069   82.043   6.5111 9.656761 8.724377 
1 1 1    7    2   29 o  202.088   3.4785  845.313   28.990  858.045   40.927  832.494   41.068  203.622   4.8732  200.554   4.9649 3.067993 6.956904 
1 1 1    7    2   30 o   26.594   8.3352 -12.4331   18.995   3.9315   25.764 -31.9185   28.114   29.830   12.485   23.359   11.046 6.471531 16.67031 
1 1 1    7    2   31 o  122.425   4.2745  310.814   20.601  311.340   34.774  310.529   25.571  122.396   6.8884  122.454   5.0631 -0.5792236E-01 8.548964 
1 1 1    7    2   32 o   95.071   4.8032  188.867   18.721  177.266   27.488  198.903   25.567   92.284   7.2219   97.859   6.3346 -5.574501 9.606383 
1 1 1    7    2   33 o   94.252   4.7133  185.941   18.175  196.446   24.651  173.428   26.903   97.247   6.1459   91.256   7.1477 5.990883 9.426656 
1 1 1    7    2   34 o   56.132   8.2202   68.905   18.400   58.694   25.160   80.643   26.976   51.495   12.059   60.769   11.175 -9.274094 16.44035 
1 1 1    7    2   35 o   33.889   8.9057   15.419   18.082  -4.7638   25.857   34.733   25.295   27.258   11.965   40.520   13.194 -13.26149 17.81133 
1 1 1    7    2   36 o   57.382   7.6438   72.003   17.607   58.942   24.725   85.442   25.080   51.335   11.908   63.430   9.5865 -12.09548 15.28768 
1 1 1    7    2   37 o  116.006   5.2119  284.978   24.758  275.237   36.911  292.945   33.382  114.020   7.8488  117.993   6.8595 -3.972656 10.42388 
1 1 1    7    2   38 o   55.452   9.5611   72.836   21.455   76.984   27.694   66.609   33.932   58.028   11.969   52.875   14.913 5.153442 19.12222 
1 1 1    7    2   39 o   70.596   6.1163  107.388   17.786  101.169   25.119  113.641   25.186   68.459   8.8963   72.734   8.3958 -4.275177 12.23252 
1 1 1    7    2   40 o   34.481   8.6503   23.886   16.097   11.493   22.614   36.615   22.919   29.370   11.932   39.591   12.527 -10.22133 17.30056 
1 1 1    7    2   41 o   28.778   8.4167   9.3845   16.376   13.579   22.742   4.8664   23.602   29.975   12.040   27.581   11.764 2.393703 16.83339 
1 1 1    7    2   42 o   18.663   6.4283 -36.5625   15.996 -44.1448   22.758 -29.1590   22.489   17.724   8.7347   19.601   9.4339 -1.877491 12.85667 
1 1 1    7    2   43 o   57.338   9.4676   93.841   22.077   50.401   41.501  110.986   26.072   44.190   16.677   70.486   8.9684 -26.29573 18.93530 
1 1 1    7    2   44 o   76.656   7.7216  138.762   24.225  126.616   35.149  149.752   33.433   72.733   11.717   80.579   10.060 -7.845901 15.44316 
1 1 1    7    2   45 o   43.848   10.521   52.858   22.358   51.939   28.375   54.363   36.308   43.884   13.945   43.812   15.757 0.7203293E-01 21.04142 
1 1 1    7    2   46 o   47.830   9.0756   62.832   18.593   71.611   24.459   50.812   28.618   53.101   11.501   42.558   14.043 10.54277 18.15116 
1 1 1    7    2   47 o   22.304   7.3526 -10.6593   16.483  -5.1550   24.459 -15.2389   22.310   23.774   10.920   20.833   9.8481 2.941498 14.70519 
1 1 1    7    2   48 o   23.620   7.6223  -6.5886   16.982 -21.7073   23.784   9.1350   24.256   20.365   9.7759   26.875   11.697 -6.509363 15.24451 
1 1 1    7    2   49 o   27.911   8.7592   11.572   20.266   18.390   28.440   4.5379   28.887   29.410   12.733   26.411   12.032 2.998756 17.51846 
1 1 1    7    2   50 o   29.952   9.8969  -1.7679   29.882   58.229   47.889 -40.0235   38.240   37.119   16.289   22.785   11.246 14.33476 19.79389 
1 1 1    7    3    0 o  222.799   2.1405  1024.48   27.806  1024.48   27.806  1024.48   27.806  222.799   3.0272  222.799   3.0272 0.000000 0.000000 
1 1 1    7    3    1 o  396.070   3.0266  3238.12   49.440  3228.64   69.665  3247.74   70.175  395.487   4.2709  396.653   4.2895 -1.166656 6.053100 
1 1 1    7    3    2 f  249.788   2.2596  1287.40   23.278  1291.90   33.040  1282.96   32.802  250.221   3.2015  249.354   3.1895 0.8671112 4.519104 
1 1 1    7    3    3 o  299.164   2.5044  1846.99   30.901  1848.19   43.727  1845.80   43.675  299.261   3.5427  299.068   3.5407 0.1933289 5.008727 
1 1 1    7    3    4 o  428.617   3.2162  3793.07   56.855  3784.22   80.148  3802.03   80.664  428.115   4.5390  429.119   4.5576 -1.004211 6.432307 
1 1 1    7    3    5 o  335.552   3.1256  2317.07   43.119  2415.06   64.074  2235.96   58.295  342.004   4.5424  329.100   4.2947 12.90451 6.251224 
1 1 1    7    3    6 o  197.739   2.5236  802.328   19.303  820.212   33.962  793.792   23.461  199.333   4.1309  196.146   2.9001 3.186966 5.047291 
1 1 1    7    3    7 o  151.585   2.1049  476.885   13.037  451.245   19.524  497.514   17.512  147.881   3.2010  155.290   2.7343 -7.408768 4.209835 
1 1 1    7    3    8 o  426.575   3.7260  3757.44   65.538  3728.95   91.547  3787.39   93.867  424.922   5.2236  428.228   5.3146 -3.305786 7.451928 
1 1 1    7    3    9 o  266.754   3.1573  1450.28   33.307  1405.79   41.277  1533.33   56.389  260.997   3.8345  272.511   5.0170 -11.51355 6.314593 
1 1 1    7    3   10 o  129.484   2.3694  346.377   12.531  349.337   16.645  342.503   19.039  130.127   3.1013  128.840   3.5829 1.287552 4.738718 
1 1 1    7    3   11 o  335.599   3.0194  2326.07   41.443  2340.50   55.241  2307.49   62.680  336.804   3.9767  334.394   4.5447 2.409760 6.038897 
1 1 1    7    3   12 o  613.839   4.7183  7778.06  118.202  7771.90  156.229  7786.30  180.770  613.604   6.1732  614.074   7.1374 -0.4697876 9.436631 
1 1 1    7    3   13 o  198.094   2.3665  808.801   19.325  831.445   27.873  787.838   26.818  200.762   3.3662  195.427   3.3272 5.334915 4.733012 
1 1 1    7    3   14 o  386.276   3.5797  3076.26   56.982  3147.67   82.650  3011.56   78.666  390.540   5.1311  382.011   4.9928 8.529114 7.159378 
1 1 1    7    3   15 o  498.830   3.7217  5134.60   76.556  5097.21  107.091  5173.67  109.482  496.976   5.2246  500.684   5.3017 -3.708099 7.443398 
1 1 1    7    3   16 o  421.290   3.5537  3661.60   61.072  3653.28   80.579  3672.83   93.620  420.753   4.6433  421.828   5.3810 -1.075500 7.107456 
1 1 1    7    3   17 o  603.061   4.6821  7512.06  115.312  7499.32  175.761  7521.69  152.792  602.553   7.0723  603.570   6.1377 -1.017212 9.364240 
1 1 1    7    3   18 o  440.466   3.6781  4010.71   66.356  4055.72   89.026  3954.45   99.532  443.278   4.8694  437.655   5.5140 5.623016 7.356292 
1 1 1    7    3   19 o  126.730   3.2441  329.644   16.909  360.358   25.035  303.880   22.929  132.127   4.5939  121.333   4.5818 10.79467 6.488181 
1 1 1    7    3   20 o  124.742   3.0533  319.994   15.597  330.928   23.675  311.610   20.732  126.612   4.5336  122.872   4.0909 3.739342 6.106525 
1 1 1    7    3   21 o  283.623   3.0093  1658.15   34.702  1645.79   45.329  1675.65   53.940  282.374   3.8921  284.873   4.5908 -2.499146 6.018641 
1 1 1    7    3   22 o  196.881   2.7113  800.099   22.015  802.432   31.329  797.822   30.942  197.164   3.8526  196.598   3.8160 0.5653839 5.422546 
1 1 1    7    3   23 o  238.216   2.7391  1171.09   26.906  1143.97   37.593  1199.58   38.527  235.390   3.8721  241.043   3.8753 -5.652908 5.478267 
1 1 1    7    3   24 o  220.897   2.7688  1007.67   25.226  1010.25   35.668  1005.10   35.681  221.180   3.9099  220.614   3.9214 0.5659790 5.537549 
1 1 1    7    3   25 o  171.190   3.8742  615.431   26.074  638.224   32.644  575.260   43.337  175.725   4.5041  166.654   6.3049 9.071075 7.748434 
1 1 1    7    3   26 o   55.721   6.4848   66.579   14.232   83.305   20.198   50.085   20.058   63.351   7.7303   48.091   10.414 15.26023 12.96958 
1 1 1    7    3   27 o   78.532   6.0360  133.350   18.694  170.085   25.744   92.372   27.189   90.547   6.8934   66.518   9.9104 24.02866 12.07204 
1 1 1    7    3   28 o   71.816   7.8940  123.850   19.507   80.212   34.836  143.783   23.544   60.391   14.221   83.240   6.8577 -22.84883 15.78796 
1 1 1    7    3   29 o  129.521   3.5135  345.158   18.701  323.795   25.169  371.488   27.943  125.082   4.8787  133.960   5.0574 -8.877892 7.027061 
1 1 1    7    3   30 o   27.364   8.4071  -3.5314   17.719   5.7111   21.939 -20.8695   30.048   28.342   11.660   26.386   12.114 1.956112 16.81420 
1 1 1    7    3   31 o  115.257   3.7313  275.115   17.721  277.192   25.660  273.220   24.504  115.662   5.3789  114.851   5.1729 0.8112259 7.462677 
1 1 1    7    3   32 o   88.691   4.6897  163.789   17.123  173.329   24.042  153.969   24.392   91.343   6.3817   86.040   6.8736 5.302406 9.379387 
1 1 1    7    3   33 o  132.722   3.7930  362.232   20.673  402.070   31.003  330.335   27.741  139.232   5.3988  126.211   5.3292 13.02099 7.585967 
1 1 1    7    3   34 f   42.815   8.8621   39.976   16.651   42.207   23.875   37.862   23.236   43.856   12.558   41.773   12.507 2.083206 17.72418 
1 1 1    7    3   35 f   70.261   6.2686  104.214   18.139  107.160   25.228  101.061   26.100   71.340   8.5741   69.182   9.1470 2.157982 12.53724 
1 1 1    7    3   36 o   44.673   7.6898   40.461   17.442  -0.0650   24.707   80.726   24.627   27.745   11.940   61.601   9.6931 -33.85617 15.37952 
1 1 1    7    3   37 o   63.897   6.8326   87.625   18.004   89.221   25.723   86.092   25.207   64.464   9.6749   63.329   9.6505 1.134277 13.66512 
1 1 1    7    3   38 o   70.768   6.6649  107.832   19.412  116.667   28.539  100.225   26.483   73.457   9.4199   68.080   9.4313 5.376198 13.32981 
1 1 1    7    3   39 o   25.114   7.8210  -5.1964   16.101 -15.5498   22.882   4.9576   22.661   22.583   10.441   27.644   11.647 -5.060806 15.64209 
1 1 1    7    3   40 o   26.736   8.1419   1.8436   16.404   7.8587   23.236  -4.1328   23.161   28.424   11.873   25.048   11.144 3.376463 16.28380 
1 1 1    7    3   41 o   35.967   9.2038   27.919   17.652   22.761   24.678   33.323   25.261   33.852   12.839   38.081   13.190 -4.228992 18.40752 
1 1 1    7    3   42 o   32.128   8.7694   18.929   16.495   23.887   24.188   14.620   22.552   34.070   12.757   30.185   12.036 3.885279 17.53883 
1 1 1    7    3   43 o   52.122   8.5092   68.253   19.015   40.224   27.885   92.616   25.997   40.368   13.865   63.876   9.8678 -23.50719 17.01838 
1 1 1    7    3   44 o   27.796   8.7279   1.2305   19.448  -0.0391   32.062   1.9695   24.462   29.062   13.007   26.529   11.642 2.532122 17.45590 
1 1 1    7    3   45 o   32.538   8.5090   17.529   18.397 -18.7538   27.976   45.173   24.420   23.548   11.100   41.528   12.900 -17.98014 17.01802 
1 1 1    7    3   46 o   33.251   8.4688   22.318   16.906  -1.6077   23.719   47.025   24.103   24.685   11.107   41.816   12.787 -17.13083 16.93757 
1 1 1    7    3   47 o   24.620   7.8551  -3.4711   17.843 -24.8899   27.742   11.641   23.303   21.795   10.487   27.445   11.698 -5.650089 15.71011 
1 1 1    7    3   48 o   57.148   8.0565   87.648   18.510  114.661   25.873   59.324   26.493   69.175   9.0682   45.121   13.319 24.05441 16.11300 
1 1 1    7    3   49 o   29.209   9.2295   15.195   22.559   19.247   28.207   8.0032   37.580   29.539   12.735   28.880   13.362 0.6590748 18.45900 
1 1 1    7    3   50 o   27.497   9.1616  -2.6463   28.188 -36.4557   42.575   23.741   37.613   24.171   11.919   30.824   13.917 -6.652512 18.32310 
1 1 1    7    4    0 o   38.188   2.3323   30.751   5.1061   30.751   5.1061   30.751   5.1061   38.188   3.2984   38.188   3.2984 0.000000 0.000000 
1 1 1    7    4    1 o  522.169   3.7653  5631.98   81.090  5621.73  114.364  5642.33  114.996  521.693   5.3150  522.645   5.3347 -0.9520264 7.530533 
1 1 1    7    4    2 o  430.134   3.2223  3819.85   57.163  3836.66   81.310  3803.44   80.378  431.068   4.5733  429.201   4.5406 1.866577 6.444565 
1 1 1    7    4    3 o  198.738   2.0459  814.899   16.769  812.030   23.656  817.797   23.776  198.386   2.8911  199.089   2.8955 -0.7031250 4.091729 
1 1 1    7    4    4 o   37.304   2.4585   28.931   3.7408   23.989   5.2906   33.873   5.2900   34.092   3.7625   40.516   3.1656 -6.423801 4.917079 
1 1 1    7    4    5 o  389.553   3.2310  3135.59   51.470  3115.41   77.921  3151.21   68.554  388.409   4.8641  390.697   4.2543 -2.288818 6.462047 
1 1 1    7    4    6 o  133.982   2.2938  372.300   11.976  364.611   20.543  376.259   14.740  132.915   3.7473  135.048   2.6463 -2.133423 4.587553 
1 1 1    7    4    7 o  311.988   2.6792  2009.92   33.444  2004.50   54.314  2013.22   42.445  311.620   4.2259  312.356   3.2946 -0.7361755 5.358462 
1 1 1    7    4    8 o  192.288   2.4515  762.365   19.418  751.685   26.712  774.333   28.276  190.864   3.3933  193.713   3.5391 -2.849014 4.903000 
1 1 1    7    4    9 o   78.053   3.1637  124.477   10.131  142.640   15.189  109.920   13.598   83.131   4.4299   72.975   4.5179 10.15616 6.327332 
1 1 1    7    4   10 o  367.392   3.1737  2788.10   47.696  2805.61   63.618  2765.63   72.075  368.728   4.1832  366.057   4.7739 2.671875 6.347364 
1 1 1    7    4   11 o  267.049   3.1845  1477.17   34.630  1509.09   45.763  1434.39   52.973  270.451   4.1026  263.647   4.8715 6.804199 6.368907 
1 1 1    7    4   12 o  302.407   2.8633  1890.81   35.515  1928.91   48.043  1844.90   52.736  305.780   3.8094  299.033   4.2758 6.747498 5.726607 
1 1 1    7    4   13 o  120.947   2.6957  301.706   13.379  300.934   18.024  302.654   19.967  120.777   3.6183  121.117   3.9970 -0.3397522 5.391467 
1 1 1    7    4   14 o  521.542   4.4366  5612.93   95.390  5690.48  137.345  5540.67  132.585  525.015   6.3427  518.069   6.2050 6.945190 8.873109 
1 1 1    7    4   15 o  224.425   2.4649  1039.01   22.815  1035.98   32.105  1042.10   32.429  224.095   3.4735  224.755   3.4983 -0.6597900 4.929848 
1 1 1    7    4   16 o  616.919   4.7613  7861.73  119.978  7873.69  159.072  7845.94  182.724  617.525   6.2456  616.313   7.1884 1.211853 9.522591 
1 1 1    7    4   17 o  411.453   3.5232  3489.59   59.025  3521.99   91.246  3466.29   77.399  413.067   5.3559  409.840   4.5788 3.226990 7.046360 
1 1 1    7    4   18 o  403.885   3.7214  3363.50   61.903  3440.72   90.374  3295.25   84.965  408.238   5.3674  399.532   5.1561 8.705688 7.442759 
1 1 1    7    4   19 o  114.876   2.9467  272.370   13.961  269.960   19.749  274.777   19.738  114.368   4.1868  115.384   4.1476 -1.016609 5.893383 
1 1 1    7    4   20 o  140.708   2.7499  408.460   15.952  391.814   22.339  425.779   22.786  137.783   3.9310  143.633   3.8464 -5.850418 5.499802 
1 1 1    7    4   21 f   52.449   7.2096   60.028   15.039   72.147   20.345   45.430   22.330   59.022   8.3576   45.876   11.750 13.14664 14.41910 
1 1 1    7    4   22 o  282.225   2.8087  1644.32   32.694  1650.42   46.282  1638.26   46.191  282.747   3.9687  281.703   3.9756 1.044067 5.617466 
1 1 1    7    4   23 o  120.023   3.6624  299.366   17.775  288.979   27.782  306.566   23.129  118.224   5.6976  121.822   4.6032 -3.598930 7.324712 
1 1 1    7    4   24 o  152.160   3.6392  481.458   22.638  454.766   33.789  503.199   30.495  148.282   5.5249  156.039   4.7384 -7.756989 7.278480 
1 1 1    7    4   25 o  148.602   3.1672  453.819   19.335  429.117   25.975  484.513   28.955  144.101   4.3704  153.103   4.5853 -9.002731 6.334474 
1 1 1    7    4   26 o   49.133   7.2501   52.636   14.199   58.888   19.569   45.685   20.634   52.409   9.3983   45.856   11.042 6.552612 14.50014 
1 1 1    7    4   27 o   86.449   4.8210  157.623   16.888  128.751   24.507  183.735   23.306   78.726   7.5474   94.172   6.0003 -15.44609 9.641949 
1 1 1    7    4   28 o   87.120   5.0577  155.934   18.055  183.078   27.017  134.026   24.271   93.914   6.9749   80.326   7.3261 13.58721 10.11532 
1 1 1    7    4   29 o   53.926   6.5627   61.713   14.266   57.609   20.118   65.866   20.235   51.659   9.8005   56.193   8.7306 -4.533913 13.12532 
1 1 1    7    4   30 o  121.519   3.7413  303.522   18.584  322.877   28.580  289.344   24.462  124.822   5.5515  118.215   5.0171 6.606743 7.482701 
1 1 1    7    4   31 o   84.750   4.6694  148.771   16.291  136.896   22.437  162.011   23.693   81.174   6.7018   88.326   6.5038 -7.151848 9.338825 
1 1 1    7    4   32 o  258.307   3.1725  1383.08   33.638  1403.28   45.594  1358.96   49.832  260.429   4.2448  256.185   4.7161 4.244415 6.345067 
1 1 1    7    4   33 o   47.444   8.9898   49.080   18.058   40.322   24.722   59.099   26.441   43.174   12.896   51.715   12.529 -8.541096 17.97954 
1 1 1    7    4   34 o  126.344   3.8093  331.306   19.843  319.800   27.689  343.456   28.452  124.086   5.4102  128.602   5.3641 -4.515335 7.618675 
1 1 1    7    4   35 o   37.710   8.8228   28.827   16.488   39.438   23.040   17.688   23.606   42.337   12.399   33.084   12.555 9.252815 17.64570 
1 1 1    7    4   36 o   42.846   10.695   37.787   22.869   31.666   40.225   40.710   27.799   42.564   16.332   43.128   13.813 -0.5639000 21.39017 
1 1 1    7    4   37 o   84.648   5.1994  151.370   18.132  151.475   25.067  151.254   26.260   84.727   7.1731   84.568   7.5286 0.1592407 10.39871 
1 1 1    7    4   38 o   51.575   8.3764   61.513   17.489   53.852   25.092   68.751   24.390   48.134   12.521   55.016   11.131 -6.882851 16.75286 
1 1 1    7    4   39 o   35.095   9.4702   18.040   18.576   7.8294   22.883   37.776   31.812   28.634   11.857   41.557   14.770 -12.92344 18.94043 
1 1 1    7    4   40 o   23.532   7.5807  -9.8913   16.205  -8.8017   22.314 -11.1071   23.573   23.437   10.637   23.626   10.804 -0.1887093 15.16147 
1 1 1    7    4   41 o   41.387   9.3057   41.110   17.937   45.481   25.362   36.735   25.371   43.288   13.091   39.487   13.229 3.800362 18.61131 
1 1 1    7    4   42 o   50.949   8.2299   62.246   16.965   69.859   23.750   54.312   24.243   54.593   10.929   47.304   12.308 7.288574 16.45980 
1 1 1    7    4   43 o   29.331   8.6206  -0.2272   19.298 -28.8263   26.745   30.834   27.872   21.834   10.450   36.827   13.713 -14.99276 17.24114 
1 1 1    7    4   44 o   39.748   8.9176   39.200   17.454   22.237   25.150   54.962   24.243   32.843   12.829   46.654   12.390 -13.81084 17.83512 
1 1 1    7    4   45 o   27.924   8.1256   5.7259   16.655   27.754   23.530 -16.3921   23.578   34.065   12.616   21.782   10.243 12.28381 16.25125 
1 1 1    7    4   46 o   23.618   7.5938  -4.6082   16.183  -6.8225   22.625  -2.2885   23.157   22.984   10.537   24.252   10.938 -1.268698 15.18760 
1 1 1    7    4   47 f   27.070   8.2739   8.2761   17.254  -1.8667   24.205   18.754   24.602   24.294   11.046   29.845   12.321 -5.550686 16.54779 
1 1 1    7    4   48 o   29.426   8.5481   17.451   17.112   6.5468   24.229   28.303   24.171   26.104   11.516   32.748   12.636 -6.643684 17.09611 
1 1 1    7    4   49 o   28.325   9.1601   9.0350   24.065   14.052   32.518   2.9614   35.780   28.993   13.029   27.658   12.879 1.334332 18.32021 
1 1 1    7    4   50 o   21.661   7.6075 -50.8378   26.587 -81.2656   39.937 -26.6187   35.630   20.117   10.154   23.206   11.331 -3.089230 15.21505 
1 1 1    7    4   51 o   31.946   14.093   36.309   36.282   0.0000   0.0000   36.309   36.282  ?   ?    31.946   14.093      ?      ? 
1 1 1    7    5    0 o  157.768   1.8986  513.857   17.460  513.857   17.460  513.857   17.460  157.768   2.6851  157.768   2.6851 0.000000 0.000000 
1 1 1    7    5    1 o   61.790   1.8994   78.777   4.8278   86.543   6.9074   71.359   6.7503   64.768   2.5857   58.811   2.7829 5.957211 3.798782 
1 1 1    7    5    2 o  365.789   2.8593  2761.29   43.127  2733.95   60.208  2790.10   61.805  363.933   4.0111  367.645   4.0759 -3.712555 5.718579 
1 1 1    7    5    3 o  288.614   2.4517  1719.00   29.184  1718.53   41.267  1719.48   41.278  288.574   3.4672  288.654   3.4671 -0.8026123E-01 4.903315 
1 1 1    7    5    4 o   56.899   2.0168   66.851   4.7197   60.556   6.6243   73.340   6.7261   54.175   2.9647   59.622   2.7352 -5.446911 4.033684 
1 1 1    7    5    5 o  251.701   2.4630  1307.43   25.316  1307.04   38.611  1307.73   33.528  251.656   3.7200  251.747   3.2291 -0.9031677E-01 4.925975 
1 1 1    7    5    6 o   78.866   2.3712  130.065   7.2615  123.150   12.433  133.645   8.9461   77.245   3.9023   80.487   2.6949 -3.241364 4.742424 
1 1 1    7    5    7 o  249.882   2.3796  1290.02   23.832  1281.62   38.494  1295.23   30.348  249.205   3.7452  250.559   2.9367 -1.353806 4.759232 
1 1 1    7    5    8 o  274.436   2.7917  1554.08   31.596  1541.14   44.318  1567.46   45.059  273.275   3.9320  275.598   3.9641 -2.322449 5.583388 
1 1 1    7    5    9 o  341.013   5.5617  2401.03   78.225  2401.03   78.225   0.0000   0.0000  341.013   5.5617  ?   ?       ?      ? 
1 1 1    7    5   10 o  218.094   2.8814  981.177   24.228  980.794   29.429  981.982   42.679  218.048   3.2724  218.141   4.7437 -0.9324646E-01 5.762889 
1 1 1    7    5   11 o  377.508   3.2550  2938.38   50.107  2926.62   66.015  2954.38   76.964  376.632   4.2497  378.384   4.9316 -1.752289 6.510044 
1 1 1    7    5   12 o  186.518   2.7878  732.201   20.723  781.701   26.651  656.497   32.958  194.664   3.3194  178.372   4.4799 16.29187 5.575634 
1 1 1    7    5   13 o  490.905   3.9500  4976.82   79.275  4994.91  105.474  4953.33  120.186  491.960   5.1982  489.850   5.9488 2.110199 7.899912 
1 1 1    7    5   14 o  315.209   3.3439  2062.65   41.121  2089.25   50.700  2011.52   70.296  318.229   3.8628  312.190   5.4594 6.038910 6.687798 
1 1 1    7    5   15 o  289.436   2.6519  1728.18   31.655  1740.26   45.106  1716.46   44.434  290.432   3.7655  288.440   3.7350 1.991943 5.303745 
1 1 1    7    5   16 o  325.653   2.8187  2187.69   37.853  2209.63   54.096  2166.65   52.987  327.251   4.0079  324.055   3.9644 3.196838 5.637394 
1 1 1    7    5   17 o  302.336   3.5869  1875.17   43.453  1839.22   55.002  1934.85   70.878  298.536   4.4670  306.137   5.6135 -7.600189 7.173889 
1 1 1    7    5   18 f  299.978   3.1746  1857.08   39.266  1866.98   56.277  1847.68   54.814  300.755   4.5369  299.201   4.4418 1.553772 6.349245 
1 1 1    7    5   19 o   25.928   7.1939   7.9269   11.106   9.2766   17.164   6.9548   14.567   27.202   10.605   24.654   9.7229 2.548344 14.38783 
1 1 1    7    5   20 o   99.105   3.5792  205.451   14.435  180.793   21.371  226.141   19.576   93.552   5.5386  104.658   4.5351 -11.10651 7.158462 
1 1 1    7    5   21 o  208.406   3.1249  898.201   26.817  937.688   37.480  856.778   38.387  213.115   4.2640  203.696   4.5692 9.419067 6.249733 
1 1 1    7    5   22 o  233.459   2.8844  1128.09   27.658  1159.91   37.757  1091.24   40.631  237.034   3.8620  229.883   4.2853 7.151138 5.768832 
1 1 1    7    5   23 o  162.020   3.0514  540.844   20.234  531.766   26.893  552.689   30.719  160.471   4.0633  163.569   4.5535 -3.097992 6.102780 
1 1 1    7    5   24 o  118.068   3.7635  289.499   18.251  308.922   25.300  268.421   26.355  122.234   5.0183  113.902   5.6101 8.331238 7.527096 
1 1 1    7    5   25 o  268.883   2.9973  1491.13   32.944  1473.73   43.646  1514.16   50.222  267.097   3.9619  270.669   4.4987 -3.572174 5.994618 
1 1 1    7    5   26 o  194.192   2.7817  778.920   22.277  797.672   31.698  760.620   31.314  196.503   3.9111  191.881   3.9567 4.621918 5.563490 
1 1 1    7    5   27 o  181.501   3.0377  680.058   22.607  672.466   30.292  689.601   33.963  180.382   4.0716  182.620   4.5091 -2.238647 6.075385 
1 1 1    7    5   28 o  184.000   2.9099  699.882   22.082  705.992   31.157  693.715   31.300  184.810   4.0875  183.190   4.1426 1.619614 5.819746 
1 1 1    7    5   29 o  162.919   3.0097  548.157   20.211  524.500   28.026  573.791   29.173  159.261   4.2666  166.578   4.2462 -7.317535 6.019479 
1 1 1    7    5   30 o   67.085   5.5609   93.739   15.385   93.209   21.846   94.260   21.672   66.892   7.9181   67.278   7.8100 -0.3853912 11.12172 
1 1 1    7    5   31 o   68.305   6.3413   94.397   17.348   85.372   21.669  110.509   28.953   63.978   8.2118   72.632   9.6650 -8.654575 12.68253 
1 1 1    7    5   32 o   78.810   5.1980  129.356   16.896  128.002   23.792  130.733   23.998   78.394   7.3583   79.227   7.3439 -0.8333588 10.39604 
1 1 1    7    5   33 o   35.666   9.1789   21.614   17.682   13.691   24.033   30.965   26.108   31.993   12.528   39.338   13.418 -7.344496 18.35783 
1 1 1    7    5   34 o  160.813   3.3867  535.838   22.451  514.440   31.193  558.837   32.338  157.483   4.8024  164.143   4.7767 -6.660004 6.773453 
1 1 1    7    5   35 o   73.318   5.7493  113.011   17.378  117.356   24.698  108.749   24.457   74.734   8.0126   71.902   8.2471 2.832199 11.49859 
1 1 1    7    5   36 o   46.775   10.729   49.677   23.532   35.554   41.369   56.432   28.611   43.815   16.622   49.736   13.570 -5.921234 21.45815 
1 1 1    7    5   37 o   46.354   8.6112   49.251   16.807   56.613   23.458   41.485   24.093   49.925   11.611   42.783   12.720 7.142120 17.22247 
1 1 1    7    5   38 o   62.037   7.0080   85.142   17.337   99.507   24.774   71.355   24.270   67.940   8.8411   56.133   10.876 11.80749 14.01605 
1 1 1    7    5   39 o  125.844   4.5670  332.868   23.034  325.949   29.182  344.302   37.513  124.479   5.6841  127.209   7.1499 -2.730240 9.134023 
1 1 1    7    5   40 o   54.474   7.8527   69.085   17.044   63.886   23.795   74.563   24.425   52.172   11.378   56.777   10.825 -4.605316 15.70532 
1 1 1    7    5   41 o   31.001   8.7147   15.759   16.686   14.148   23.809   17.314   23.391   30.526   12.299   31.476   12.350 -0.9503555 17.42947 
1 1 1    7    5   42 o   28.339   8.2391   8.2771   16.070   19.809   22.497  -3.7372   22.962   31.904   12.221   24.775   11.054 7.129725 16.47823 
1 1 1    7    5   43 o   27.999   8.7353  -8.0324   21.488 -38.8544   31.473   18.879   29.409   22.771   11.009   33.227   13.565 -10.45520 17.47054 
1 1 1    7    5   44 o   29.674   8.6734   12.357   17.569   3.8226   25.101   20.554   24.599   27.236   11.876   32.111   12.644 -4.875008 17.34673 
1 1 1    7    5   45 o   71.478   6.0724  116.828   17.761  132.984   25.234  100.967   25.003   76.874   7.9586   66.083   9.1738 10.79176 12.14488 
1 1 1    7    5   46 o   25.431   7.9729 -25.5466   17.511 -55.5496   21.612   31.792   29.878   15.413   7.7388   35.448   13.942 -20.03520 15.94584 
1 1 1    7    5   47 o   25.451   8.0439   2.9702   17.267   3.5487   23.897   2.3380   24.979   25.401   11.309   25.502   11.442 -0.1006241 16.08787 
1 1 1    7    5   48 o   28.474   8.4622   14.523   17.354   25.100   24.096   3.1238   25.015   31.492   12.478   25.455   11.434 6.036539 16.92444 
1 1 1    7    5   49 o   28.640   9.0250   14.209   21.649   8.8635   32.751   18.358   28.851   27.985   12.773   29.294   12.754 -1.308693 18.05008 
1 1 1    7    5   50 f   22.254   7.8141 -41.5816   26.161 -38.7315   43.145 -43.2389   32.899   23.890   11.820   20.619   10.223 3.270550 15.62817 
1 1 1    7    5   51 o   32.438   10.050   38.122   27.351   12.862   43.028   55.249   35.429   28.429   13.508   36.446   14.885 -8.016142 20.10100 
1 1 1    7    6    0 o   49.121   2.1177   50.325   6.0159   50.325   6.0159   50.325   6.0159   49.121   2.9949   49.121   2.9949 0.000000 0.000000 
1 1 1    7    6    1 o  233.933   2.1915  1129.14   21.144  1124.68   29.791  1133.66   30.014  233.467   3.0938  234.398   3.1046 -0.9301147 4.382899 
1 1 1    7    6    2 o  121.752   1.8226  305.796   9.1519  309.311   12.989  302.332   12.897  122.447   2.5719  121.057   2.5831 1.389488 3.645125 
1 1 1    7    6    3 o  198.869   2.0503  815.908   16.816  822.362   23.922  809.604   23.643  199.646   2.9052  198.092   2.8939 1.554306 4.100548 
1 1 1    7    6    4 f  231.831   2.3786  1103.27   22.369  1140.21   35.219  1078.30   28.960  235.054   3.6329  228.607   3.0714 6.447510 4.757236 
1 1 1    7    6    5 o  174.653   2.4200  632.652   16.518  619.315   28.165  639.645   20.393  173.225   3.9422  176.081   2.8081 -2.855713 4.840061 
1 1 1    7    6    6 f  394.225   3.5019  3198.58   56.739  3326.05   84.481  3093.83   76.582  401.342   5.1036  387.108   4.7966 14.23450 7.003851 
1 1 1    7    6    7 o  325.378   2.8771  2183.82   38.165  2192.14   58.649  2177.70   50.263  325.898   4.3633  324.859   3.7514 1.038757 5.754240 
1 1 1    7    6    8 f  325.476   3.0926  2183.76   41.473  2238.21   60.291  2134.86   57.139  329.319   4.4388  321.633   4.3073 7.686157 6.185154 
1 1 1    7    6    9 o  551.820   5.1057  6308.13  114.895  6162.92  175.095  6417.93  152.260  546.156   7.7730  557.485   6.6220 -11.32874 10.21131 
1 1 1    7    6   10 o  285.727   3.0348  1697.83   32.477  1716.93   38.673  1652.13   59.823  288.503   3.2500  282.950   5.1262 5.553040 6.069648 
1 1 1    7    6   11 o  161.552   2.8617  523.781   17.508  502.838   20.765  575.292   32.565  156.130   3.2246  166.974   4.7287 -10.84380 5.723473 
1 1 1    7    6   12 o  213.630   2.4302  946.530   20.796  963.360   26.555  919.836   33.443  216.108   2.9793  211.152   3.8401 4.956100 4.860299 
1 1 1    7    6   13 o  430.582   5.5327  3793.85   82.944  3763.30   94.465  3896.64  173.305  427.021   5.3636  434.142   9.6786 -7.121277 11.06543 
1 1 1    7    6   14 o  519.301   4.1195  5576.36   87.827  5673.50  119.225  5461.11  129.867  524.281   5.5136  514.320   6.1221 9.960754 8.238953 
1 1 1    7    6   15 o  456.227   4.0194  4281.05   75.306  4458.30  112.728  4138.20  101.200  464.708   5.8814  447.747   5.4800 16.96112 8.038802 
1 1 1    7    6   16 o  389.030   3.3798  3119.24   53.560  3149.61   82.675  3097.28   70.310  390.637   5.1314  387.422   4.4002 3.215088 6.759607 
1 1 1    7    6   17 o  200.346   2.6555  827.829   21.805  824.967   29.222  831.425   32.754  199.961   3.5432  200.731   3.9562 -0.7692719 5.310944 
1 1 1    7    6   18 o  377.307   4.3745  2940.57   68.036  2951.72   97.970  2930.19   94.555  377.987   6.2842  376.627   6.0871 1.359772 8.748933 
1 1 1    7    6   19 o  206.055   2.5477  875.573   21.643  854.680   30.106  897.921   31.137  203.513   3.5867  208.596   3.6192 -5.083405 5.095341 
1 1 1    7    6   20 o  159.669   2.7274  525.676   17.951  504.379   24.957  548.510   25.841  156.321   3.8708  163.017   3.8433 -6.696304 5.454772 
1 1 1    7    6   21 o  245.002   2.8884  1237.74   28.876  1249.23   44.276  1229.23   38.092  245.972   4.3643  244.033   3.7846 1.939041 5.776708 
1 1 1    7    6   22 o  202.579   3.0071  856.914   24.782  919.604   33.223  778.270   37.211  211.052   3.8166  194.106   4.6480 16.94669 6.014185 
1 1 1    7    6   23 o  185.190   2.9041  708.472   22.038  709.824   29.549  706.777   33.081  185.405   3.8642  184.975   4.3361 0.4298706 5.808120 
1 1 1    7    6   24 o   37.926   8.3665   29.552   14.562   24.690   19.939   35.109   21.317   35.254   11.726   40.599   11.937 -5.344200 16.73291 
1 1 1    7    6   25 f  140.576   3.0429  408.128   17.595  368.417   24.512  450.332   25.270  133.516   4.4513  147.635   4.1500 -14.11966 6.085763 
1 1 1    7    6   26 o  155.541   2.9354  499.936   18.830  498.712   26.503  501.185   26.759  155.350   4.1363  155.732   4.1661 -0.3824310 5.870743 
1 1 1    7    6   27 f  144.809   3.8303  433.434   22.833  423.773   31.199  444.578   33.506  143.087   5.2866  146.530   5.5441 -3.443481 7.660664 
1 1 1    7    6   28 o  149.588   3.3027  460.796   20.191  478.226   30.947  447.877   26.643  152.012   4.9359  147.164   4.3895 4.847870 6.605393 
1 1 1    7    6   29 f   90.611   4.1865  170.275   15.641  173.765   22.012  166.717   22.228   91.556   5.8292   89.665   6.0106 1.890770 8.372999 
1 1 1    7    6   30 o  212.338   3.1073  931.249   26.993  921.258   35.873  944.290   40.983  211.068   4.1208  213.609   4.6518 -2.541138 6.214507 
1 1 1    7    6   31 f   79.971   5.9058  130.654   19.200  117.679   24.734  150.326   30.455   75.123   7.9829   84.819   8.7056 -9.695206 11.81163 
1 1 1    7    6   32 o   57.256   7.0339   69.831   16.265   66.499   22.743   73.320   23.272   55.388   10.336   59.125   9.5435 -3.736980 14.06779 
1 1 1    7    6   33 o  162.189   3.3500  545.169   22.409  551.541   31.808  538.889   31.575  163.132   4.7274  161.247   4.7478 1.885391 6.699989 
1 1 1    7    6   34 o   38.865   8.5031   30.800   16.204   48.276   22.688   12.603   23.151   46.644   11.788   31.087   12.258 15.55677 17.00630 
1 1 1    7    6   35 o   44.836   8.6170   44.736   16.682   33.145   23.742   56.038   23.445   39.490   12.777   50.182   11.565 -10.69237 17.23396 
1 1 1    7    6   36 o   45.558   9.4221   46.962   18.852   50.778   26.934   43.298   26.396   47.206   13.277   43.909   13.372 3.297340 18.84417 
1 1 1    7    6   37 o   34.435   7.6705   15.518   15.937   51.147   22.380 -21.1332   22.699   47.377   11.556   21.493   10.089 25.88448 15.34093 
1 1 1    7    6   38 o   63.317   6.5823   86.986   17.175   89.539   24.081   84.341   24.504   64.341   9.0744   62.293   9.5374 2.047119 13.16459 
1 1 1    7    6   39 f   40.949   9.6310   38.529   20.043   51.309   26.073   20.067   31.337   46.511   13.057   35.387   14.162 11.12428 19.26209 
1 1 1    7    6   40 o   55.627   8.0091   76.773   18.389  113.820   25.275   35.102   26.806   72.196   8.4880   39.058   13.584 33.13797 16.01814 
1 1 1    7    6   41 o   31.089   8.5767   14.786   16.587   1.9030   23.403   27.789   23.511   26.631   11.540   35.547   12.691 -8.916641 17.15349 
1 1 1    7    6   42 o   25.304   7.8015  -3.4300   16.127 -19.5613   22.821   12.662   22.793   21.267   10.025   29.341   11.956 -8.073584 15.60295 
1 1 1    7    6   43 o   33.878   9.4852   21.437   20.559   4.3668   31.939   33.513   26.863   30.216   13.280   37.540   13.547 -7.324415 18.97045 
1 1 1    7    6   44 o   73.048   6.3815  119.094   19.076  139.157   29.158  104.082   25.222   78.343   9.0238   67.753   9.0258 10.59038 12.76304 
1 1 1    7    6   45 o   26.888   7.9066  -0.7631   16.561 -28.1747   22.985   28.832   23.883   19.457   9.4072   34.319   12.711 -14.86194 15.81313 
1 1 1    7    6   46 o   25.422   8.2335  -4.5775   19.262  -6.2918   25.485  -2.2934   29.418   24.265   11.146   26.580   12.121 -2.314226 16.46708 
1 1 1    7    6   47 o   24.674   7.7395  -5.7261   17.282   19.605   24.015 -32.9359   24.890   29.978   12.251   19.371   9.4612 10.60690 15.47895 
1 1 1    7    6   48 f   40.705   7.8872   43.145   17.852   84.515   24.865  -0.8626   25.646   56.722   11.026   24.687   11.281 32.03471 15.77438 
1 1 1    7    6   49 o   30.402   9.2032   14.457   22.219   47.635   32.574 -14.4090   30.384   37.296   14.591   23.508   11.220 13.78877 18.40637 
1 1 1    7    6   50 o   28.835   9.5264   7.4587   27.364   42.299   43.457 -15.4309   35.224   33.553   15.071   24.116   11.656 9.436756 19.05281 
1 1 1    7    6   51 o   35.726   10.783   56.860   28.644   47.805   44.837   63.104   37.232   33.462   15.143   37.990   15.354 -4.528275 21.56526 
1 1 1    7    7    0 o  289.826   2.4593  1733.56   41.561  1733.56   41.561  1733.56   41.561  289.826   3.4780  289.826   3.4780 0.000000 0.000000 
1 1 1    7    7    1 o  224.855   2.1561  1042.86   19.992  1028.24   27.931  1058.22   28.628  223.240   3.0335  226.471   3.0649 -3.230728 4.312284 
1 1 1    7    7    2 o  390.836   3.0006  3152.99   48.366  3140.96   68.042  3165.28   68.765  390.083   4.2291  391.589   4.2577 -1.505127 6.001116 
1 1 1    7    7    3 o  180.043   2.1530  666.447   15.777  683.031   24.514  654.722   20.612  181.942   3.2668  178.145   2.8054 3.797455 4.306037 
1 1 1    7    7    4 o   86.485   2.0255  154.521   7.1716  152.536   10.783  156.095   9.6037   85.984   3.0405   86.986   2.6769 -1.001907 4.050915 
1 1 1    7    7    5 o  116.205   2.2864  275.300   10.339  288.504   18.083  268.888   12.601  118.241   3.7080  114.168   2.6761 4.072975 4.572873 
1 1 1    7    7    6 o  130.056   2.0816  349.770   11.050  342.990   16.797  354.943   14.673  128.938   3.1585  131.173   2.7121 -2.234726 4.163120 
1 1 1    7    7    7 o  151.077   2.0710  469.786   12.555  475.344   20.307  466.346   15.974  151.793   3.2436  150.360   2.5758 1.432846 4.141932 
1 1 1    7    7    8 f  152.795   3.0523  478.858   19.123  457.009   25.472  507.079   28.948  148.828   4.1497  156.762   4.4773 -7.934372 6.104584 
1 1 1    7    7    9 o  661.769   5.7044  9045.72  146.552  9045.06  179.211  9047.05  254.626  661.915   6.5644  661.622   9.3310 0.2932129 11.40872 
1 1 1    7    7   10 o  296.247   3.4330  1795.98   40.606  1753.09   51.061  1869.78   66.974  291.496   4.2471  300.998   5.3948 -9.501984 6.866003 
1 1 1    7    7   11 o  567.227   4.7205  6643.67  110.435  6634.85  155.696  6652.60  156.665  566.850   6.6595  567.604   6.6921 -0.7540894 9.441042 
1 1 1    7    7   12 o  787.730   6.2967 12822.15  204.537 12911.09  292.525 12737.08  286.099  790.390   8.9734  785.071   8.8357 5.318604 12.59330 
1 1 1    7    7   13 o  375.090   3.6987  2898.10   53.554  2887.97   65.077  2919.35   94.263  374.128   4.2173  376.053   6.0775 -1.925079 7.397431 
1 1 1    7    7   14 o  426.256   3.5607  3750.09   61.977  3751.14   82.071  3748.71   94.543  426.349   4.6672  426.164   5.3788 0.1853943 7.121427 
1 1 1    7    7   15 o  126.594   2.5049  330.333   12.548  329.588   15.665  331.668   20.962  126.402   3.0048  126.786   4.0085 -0.3840256 5.009730 
1 1 1    7    7   16 o  255.767   2.5665  1349.41   27.070  1334.43   37.889  1365.02   38.688  254.318   3.6122  257.216   3.6468 -2.897873 5.132990 
1 1 1    7    7   17 o  324.055   3.6039  2174.72   47.686  2218.39   63.478  2118.16   72.246  327.828   4.6948  320.283   5.4691 7.544891 7.207780 
1 1 1    7    7   18 o  508.952   4.1236  5318.92   84.691  5501.42  135.531  5202.01  108.477  515.991   6.3684  501.913   5.2402 14.07809 8.247190 
1 1 1    7    7   19 o  158.633   2.6249  519.343   17.174  521.102   24.307  517.589   24.268  158.902   3.7088  158.365   3.7155 0.5368195 5.249714 
1 1 1    7    7   20 o  192.658   2.6461  765.869   21.023  752.334   29.416  779.999   30.055  190.919   3.7357  194.397   3.7485 -3.477936 5.292161 
1 1 1    7    7   21 o  322.971   3.1370  2154.79   41.410  2148.66   62.886  2159.49   55.024  322.534   4.7273  323.407   4.1251 -0.8724670 6.274080 
1 1 1    7    7   22 o  192.944   3.0130  770.383   23.630  778.146   30.981  759.588   36.536  194.133   3.8693  191.755   4.6197 2.378174 6.026011 
1 1 1    7    7   23 o  250.151   2.9621  1293.80   30.313  1301.68   40.445  1283.71   45.789  251.048   3.9061  249.254   4.4541 1.794586 5.924218 
1 1 1    7    7   24 o   61.807   5.2159   79.302   13.287   77.351   18.995   81.171   18.593   61.054   7.5432   62.561   7.2056 -1.506496 10.43176 
1 1 1    7    7   25 o   72.150   4.6872  107.883   13.937  102.444   19.608  113.437   19.815   70.304   6.7621   73.995   6.4926 -3.690674 9.374454 
1 1 1    7    7   26 o   88.934   4.0865  163.747   14.987  167.835   21.417  159.824   20.978   90.022   5.7683   87.846   5.7901 2.176193 8.173015 
1 1 1    7    7   27 f   94.895   4.6146  188.715   17.853  169.936   26.477  204.371   24.175   90.472   7.0956   99.318   5.9017 -8.846344 9.229203 
1 1 1    7    7   28 o   82.602   4.8858  141.057   16.605  154.391   24.417  129.584   22.650   86.221   6.8663   78.984   6.9527 7.236977 9.771688 
1 1 1    7    7   29 o  230.026   3.2059  1093.51   30.392  1066.30   41.992  1123.45   44.043  227.032   4.4845  233.020   4.5827 -5.988861 6.411828 
1 1 1    7    7   30 o  218.023   3.0715  979.270   27.371  954.498   36.153  1012.54   41.898  214.845   4.0799  221.201   4.5924 -6.355377 6.142927 
1 1 1    7    7   31 o  108.247   4.3404  242.907   19.259  246.648   28.979  239.947   25.775  108.955   6.4487  107.540   5.8112 1.414757 8.680770 
1 1 1    7    7   32 o  156.342   3.6439  506.002   23.472  492.981   32.307  520.559   34.158  154.226   5.0790  158.458   5.2266 -4.231720 7.287867 
1 1 1    7    7   33 o   61.633   6.6903   81.186   16.452   67.720   22.911   95.523   23.641   55.777   10.340   67.489   8.4930 -11.71177 13.38068 
1 1 1    7    7   34 o   34.314   8.8406   20.609   16.466   13.262   23.007   28.326   23.577   31.221   12.249   37.406   12.751 -6.185150 17.68129 
1 1 1    7    7   35 o   80.124   6.6361  134.640   21.676  145.829   33.788  126.814   28.258   82.798   9.8942   77.449   8.8462 5.349014 13.27214 
1 1 1    7    7   36 o   88.078   5.1774  162.673   18.741  145.410   25.494  182.968   27.643   82.991   7.4480   93.166   7.1938 -10.17540 10.35488 
1 1 1    7    7   37 o   84.768   5.6195  153.077   19.573  153.388   28.958  152.816   26.557   84.729   8.2866   84.808   7.5924 -0.7913208E-01 11.23891 
1 1 1    7    7   38 o   40.795   8.7436   37.762   16.542   49.888   23.174   25.164   23.621   46.379   12.017   35.210   12.704 11.16914 17.48717 
1 1 1    7    7   39 o   89.793   5.3227  170.988   19.543  205.719   29.387  143.451   26.167   97.984   7.2717   81.603   7.7747 16.38111 10.64534 
1 1 1    7    7   40 o   50.118   8.7967   60.619   18.073   62.653   24.493   58.188   26.777   51.367   11.808   48.870   13.042 2.497433 17.59340 
1 1 1    7    7   41 o   58.473   7.1883   77.645   16.906   69.935   23.689   85.646   24.133   54.806   10.863   62.139   9.4165 -7.332386 14.37659 
1 1 1    7    7   42 o   34.467   8.3388   22.530   16.674   47.476   23.227  -3.9929   23.950   43.854   12.328   25.080   11.232 18.77446 16.67762 
1 1 1    7    7   43 o   43.622   9.0520   48.152   17.359   46.272   24.489   50.051   24.610   42.768   12.848   44.477   12.754 -1.708511 18.10392 
1 1 1    7    7   44 o   43.634   9.5833   50.222   19.134   46.132   27.798   53.904   26.376   41.870   13.841   45.399   13.258 -3.529457 19.16666 
1 1 1    7    7   45 o   30.059   8.2094   13.895   16.040  -6.6315   22.279   35.983   23.112   22.946   10.497   37.171   12.625 -14.22424 16.41871 
1 1 1    7    7   46 o   59.970   8.5302   97.831   20.379   69.230   30.651  120.492   27.282   48.633   14.318   71.307   9.2766 -22.67371 17.06037 
1 1 1    7    7   47 o   23.827   7.7160  -6.7749   17.644   7.2294   24.340 -22.2841   25.614   26.476   11.615   21.177   10.160 5.299528 15.43192 
1 1 1    7    7   48 o   32.119   8.7430   24.909   19.096   46.584   24.669  -7.4983   30.164   39.400   13.040   24.838   11.650 14.56254 17.48607 
1 1 1    7    7   49 o   22.237   7.6438 -26.1264   22.122 -25.4625   32.754 -26.6833   29.998   22.783   11.066   21.691   10.548 1.091471 15.28767 
1 1 1    7    7   50 o   32.611   10.358   31.489   28.317   68.771   45.961   8.6786   35.950   37.857   16.289   27.364   12.798 10.49306 20.71519 
1 1 1    7    8    0 o  632.524   4.4398  8260.81  163.764  8260.81  163.764  8260.81  163.764  632.524   6.2788  632.524   6.2788 0.000000 0.000000 
1 1 1    7    8    1 o  330.246   2.6713  2250.61   36.386  2254.20   51.560  2247.05   51.355  330.508   3.7824  329.985   3.7733 0.5234985 5.342689 
1 1 1    7    8    2 o  166.655   1.9542  572.941   13.432  569.969   18.926  575.956   19.066  166.220   2.7607  167.090   2.7666 -0.8705444 3.908369 
1 1 1    7    8    3 o   90.323   1.8966  168.210   7.0619  160.781   9.8783  175.976   10.100   88.284   2.7129   92.362   2.6512 -4.078102 3.793263 
1 1 1    7    8    4 o  402.998   3.5507  3351.17   58.989  3308.72   81.932  3396.86   84.998  400.354   4.9618  405.642   5.0805 -5.287292 7.101468 
1 1 1    7    8    5 o  620.883   4.6976  7976.38  120.007  7733.96  174.286  8194.95  165.487  611.856   6.9063  629.911   6.3697 -18.05414 9.395254 
1 1 1    7    8    6 o  292.917   4.0608  1770.33   49.059   0.0000   0.0000  1770.33   49.059  ?   ?   292.917   4.0608      ?      ? 
1 1 1    7    8    7 o  790.111   8.4106 12956.58  205.514 12871.82  498.302 12973.95  225.594  787.557   15.341  792.666   6.9004 -5.109436 16.82117 
1 1 1    7    8    8 o  414.271   3.7483  3541.69   57.861  3541.64  108.246  3541.70   68.463  414.207   6.3362  414.335   4.0063 -0.1276245 7.496504 
1 1 1    7    8    9 o  375.887   3.2264  2913.36   49.386  2902.72   64.826  2928.07   76.239  375.087   4.1904  376.688   4.9072 -1.600616 6.452865 
1 1 1    7    8   10 o  180.643   2.7838  667.018   18.089  660.635   20.915  685.971   36.039  178.963   2.8335  182.322   4.7926 -3.359818 5.567563 
1 1 1    7    8   11 o  347.343   3.4604  2473.68   43.910  2455.50   51.228  2523.99   85.246  345.006   3.6001  349.680   5.9107 -4.674377 6.920801 
1 1 1    7    8   12 o  205.045   2.7499  876.941   21.221  891.186   25.390  843.923   38.654  207.856   2.9616  202.234   4.6342 5.622604 5.499717 
1 1 1    7    8   13 o  546.248   4.8545  6167.32  103.181  6177.23  126.512  6147.65  178.317  547.036   5.6073  545.459   7.9262 1.577148 9.709066 
1 1 1    7    8   14 o  453.860   3.5618  4242.90   64.243  4219.92   80.593  4282.95  106.397  452.226   4.3209  455.495   5.6634 -3.268250 7.123534 
1 1 1    7    8   15 o  409.277   3.4902  3444.62   57.973  3388.07   75.244  3527.22   90.942  405.188   4.5024  413.367   5.3341 -8.178864 6.980320 
1 1 1    7    8   16 o  404.998   3.3172  3374.13   53.290  3344.39   66.629  3426.92   88.777  402.578   4.0128  407.418   5.2832 -4.840332 6.634347 
1 1 1    7    8   17 o  109.330   3.2580  246.524   14.622  249.003   21.811  244.500   19.706  109.824   4.8152  108.836   4.3899 0.9876251 6.515996 
1 1 1    7    8   18 o  226.217   2.9729  1054.27   27.709  996.094   38.287  1118.26   40.154  219.675   4.2257  232.758   4.1827 -13.08369 5.945723 
1 1 1    7    8   19 o  372.288   3.0881  2861.29   47.412  2847.63   66.516  2875.40   67.599  371.387   4.3425  373.189   4.3919 -1.801392 6.176200 
1 1 1    7    8   20 o  323.660   2.9033  2161.87   38.746  2196.46   55.572  2129.15   54.050  326.176   4.1308  321.143   4.0807 5.032806 5.806511 
1 1 1    7    8   21 o  156.854   2.7951  507.900   18.081  514.904   25.761  501.098   25.385  157.919   3.9551  155.788   3.9508 2.131226 5.590288 
1 1 1    7    8   22 o  139.690   3.5027  401.578   20.110  384.231   27.119  422.772   29.976  136.360   4.8219  143.020   5.0817 -6.659485 7.005356 
1 1 1    7    8   23 f   97.360   4.1766  196.573   16.739  207.951   23.482  184.817   23.868  100.243   5.6795   94.476   6.1252 5.767143 8.353149 
1 1 1    7    8   24 f  180.732   2.9346  672.154   21.747  651.196   29.026  698.970   32.833  177.548   3.9637  183.915   4.3284 -6.367188 5.869126 
1 1 1    7    8   25 o  211.076   3.3051  920.756   28.765  951.805   41.101  890.947   40.272  214.566   4.6443  207.586   4.7037 6.979645 6.610162 
1 1 1    7    8   26 o  134.490   3.3063  372.017   18.256  353.848   24.456  394.883   27.436  130.813   4.5328  138.166   4.8146 -7.353027 6.612580 
1 1 1    7    8   27 o  251.597   3.3104  1310.34   32.895  1312.53   41.013  1306.40   55.079  252.005   3.9459  251.189   5.3164 0.8151550 6.620760 
1 1 1    7    8   28 o   58.394   7.2116   77.770   16.120   43.435   23.540  108.089   22.121   44.692   12.357   72.096   7.4391 -27.40430 14.42323 
1 1 1    7    8   29 o  162.384   3.0674  545.458   20.541  533.728   29.003  557.261   29.095  160.628   4.3778  164.140   4.2977 -3.512299 6.134751 
1 1 1    7    8   30 o   91.427   4.3510  173.391   16.403  177.642   23.530  169.373   22.878   92.516   6.1664   90.339   6.1402 2.176460 8.702090 
1 1 1    7    8   31 o   97.529   4.6167  201.411   18.202  172.369   27.280  224.714   24.436   90.982   7.2699  104.077   5.6926 -13.09462 9.233500 
1 1 1    7    8   32 o   54.178   9.9761   64.326   21.057   63.750   24.940   65.757   39.299   53.875   11.569   54.481   16.255 -0.6063995 19.95214 
1 1 1    7    8   33 o   87.267   4.8968  159.006   17.583  173.228   25.065  145.226   24.672   91.149   6.6673   83.386   7.1737 7.763466 9.793598 
1 1 1    7    8   34 o   36.155   8.8212   26.073   15.979   24.671   22.705   27.449   22.493   35.579   12.495   36.732   12.455 -1.153046 17.64233 
1 1 1    7    8   35 o   32.588   9.3126   10.442   20.254 -10.2998   32.425   23.712   25.936   29.223   13.080   35.953   13.259 -6.729687 18.62512 
1 1 1    7    8   36 o   41.266   8.2742   36.989   16.459   60.351   22.943   12.216   23.626   51.802   11.074   30.731   12.297 21.07125 16.54836 
1 1 1    7    8   37 o   66.680   6.6511   96.876   18.132   89.844   26.796  102.815   24.625   64.184   10.122   69.177   8.6309 -4.992790 13.30224 
1 1 1    7    8   38 o   50.133   8.1451   57.851   16.491   56.005   23.317   59.698   23.328   49.266   11.657   51.000   11.379 -1.733356 16.29023 
1 1 1    7    8   39 o   38.583   8.8943   34.504   16.303   38.044   23.127   31.007   22.985   40.168   12.566   36.999   12.590 3.169273 17.78857 
1 1 1    7    8   40 o   30.353   8.7682   10.891   18.415   23.704   22.804 -13.1330   31.224   33.756   12.435   26.951   12.365 6.804213 17.53634 
1 1 1    7    8   41 o   69.404   6.0622  105.967   17.276  117.289   24.507   94.783   24.357   73.321   8.1041   65.486   9.0180 7.834747 12.12437 
1 1 1    7    8   42 o   34.650   9.6310   24.100   19.934   22.024   31.792   25.446   25.588   34.787   14.142   34.513   13.078 0.2736740 19.26209 
1 1 1    7    8   43 o   31.528   7.8249   10.016   16.221 -25.6542   22.790   46.639   23.093   20.023   9.6003   43.033   12.359 -23.01062 15.64981 
1 1 1    7    8   44 o   71.415   7.0982  121.602   19.785   93.252   28.107  149.443   27.854   61.403   11.522   81.426   8.2939 -20.02272 14.19635 
1 1 1    7    8   45 o   64.173   6.6747   98.075   16.811  119.385   23.780   76.784   23.769   72.631   7.9383   55.716   10.733 16.91558 13.34947 
1 1 1    7    8   46 o   37.030   9.4818   35.416   19.110   57.265   29.647   19.884   24.997   43.662   14.287   30.398   12.469 13.26376 18.96350 
1 1 1    7    8   47 o   26.500   8.2574   6.3236   17.820   13.334   23.889  -2.4711   26.757   27.950   11.877   25.050   11.475 2.899740 16.51472 
1 1 1    7    8   48 o   25.218   8.3274  -6.6776   21.880 -23.5252   31.950   8.2026   30.026   22.971   11.103   27.466   12.414 -4.494600 16.65487 
1 1 1    7    8   49 o   22.601   7.7339 -23.9193   21.913  -6.7451   32.397 -38.4031   29.752   25.012   11.837   20.189   9.9569 4.822554 15.46787 
1 1 1    7    8   50 o   31.318   10.037   22.522   27.941   67.538   44.270  -7.2838   36.023   37.619   16.081   25.017   12.014 12.60192 20.07333 
1 1 1    7    9    0 o  674.560   5.4331  9397.56  213.708  9397.56  213.708  9397.56  213.708  674.560   7.6835  674.560   7.6835 0.000000 0.000000 
1 1 1    7    9    1 o  612.603   5.3215  7729.08  125.699  7828.15  221.982  7682.32  152.504  615.262   8.7477  609.943   6.0622 5.319153 10.64291 
1 1 1    7    9    2 o  294.624   3.1017  1762.87   34.668  1863.40   63.732  1720.62   41.316  300.458   5.1429  288.791   3.4687 11.66702 6.203355 
1 1 1    7    9    3 o  265.880   3.8312  1458.54   42.013   0.0000   0.0000  1458.54   42.013  ?   ?   265.880   3.8312      ?      ? 
1 1 1    7    9    4 o  558.753   4.8817  6453.24  106.346  6429.29  183.022  6465.45  130.669  557.843   7.9547  559.665   5.6608 -1.822083 9.763322 
1 1 1    7    9    5 o  780.793   6.2088 12590.65  199.797 12427.01  276.557 12769.31  288.962  775.513   8.6463  786.073   8.9127 -10.56012 12.41754 
1 1 1    7    9    6 o  579.114   4.4540  6919.61  105.169  6945.23  161.541  6900.76  138.554  580.001   6.7529  578.227   5.8097 1.774719 8.908092 
1 1 1    7    9    7 o  118.730   2.1464  293.214   10.377  273.506   15.678  308.577   13.843  115.148   3.3013  122.313   2.7440 -7.165207 4.292761 
1 1 1    7    9    8 o  441.621   3.8256  4010.62   69.385  4177.35  103.824  3876.06   93.273  449.871   5.5955  433.370   5.2183 16.50159 7.651202 
1 1 1    7    9    9 o  187.238   2.4454  727.024   18.715  755.338   25.135  691.800   28.035  191.355   3.1847  183.120   3.7119 8.234543 4.890864 
1 1 1    7    9   10 o  413.159   3.4534  3525.85   58.328  3548.36   77.635  3496.68   88.383  414.693   4.5391  411.625   5.2060 3.067169 6.906882 
1 1 1    7    9   11 o  397.570   3.8681  3253.51   59.307  3237.53   71.982  3287.28  104.651  396.113   4.4059  399.026   6.3589 -2.912506 7.736102 
1 1 1    7    9   12 o  342.602   3.3253  2442.14   43.098  2472.98   51.711  2371.98   77.991  346.221   3.6213  338.982   5.5783 7.239105 6.650683 
1 1 1    7    9   13 o   92.445   3.3016  177.732   12.473  189.332   16.899  163.849   18.487   95.790   4.2773   89.101   5.0306 6.689095 6.603169 
1 1 1    7    9   14 o  262.121   2.5954  1425.78   27.360  1456.12   35.202  1379.49   43.481  265.677   3.2126  258.565   4.0773 7.113068 5.190808 
1 1 1    7    9   15 o  259.666   2.6035  1394.43   27.001  1404.22   34.223  1378.28   43.946  260.894   3.1804  258.438   4.1229 2.456543 5.207049 
1 1 1    7    9   16 o   38.179   5.5015   36.813   8.4023   51.139   10.530   11.710   13.939   49.767   5.1302   26.591   9.7337 23.17593 11.00291 
1 1 1    7    9   17 o  319.332   3.2747  2099.03   38.897  2090.97   45.927  2119.46   73.157  318.326   3.4980  320.338   5.5371 -2.012146 6.549497 
1 1 1    7    9   18 o  244.756   2.7870  1236.71   27.887  1238.02   37.075  1234.99   42.320  244.921   3.6702  244.592   4.1951 0.3286743 5.573971 
1 1 1    7    9   19 o  105.811   3.5284  231.013   15.140  232.531   23.715  229.969   19.670  106.089   5.4199  105.533   4.5192 0.5563202 7.056799 
1 1 1    7    9   20 o  295.180   2.7909  1798.86   33.977  1800.46   48.069  1797.26   48.034  295.311   3.9465  295.048   3.9472 0.2622681 5.581721 
1 1 1    7    9   21 o  211.574   2.6467  924.088   23.093  930.167   32.955  918.223   32.369  212.256   3.7644  210.892   3.7214 1.364365 5.293340 
1 1 1    7    9   22 o  214.100   2.8815  940.750   25.124  984.418   39.115  910.084   32.780  218.278   4.3448  209.923   3.7860 8.355042 5.762915 
1 1 1    7    9   23 o  116.044   4.4263  275.538   19.836  269.533   24.014  288.434   35.194  114.162   5.1002  117.927   7.2358 -3.765381 8.852608 
1 1 1    7    9   24 o  129.488   3.1067  346.798   16.576  338.333   23.786  354.790   23.112  127.943   4.5075  131.033   4.2765 -3.089310 6.213420 
1 1 1    7    9   25 o  152.649   2.8928  481.592   18.208  494.875   25.809  468.428   25.692  154.749   4.0437  150.549   4.1377 4.199265 5.785523 
1 1 1    7    9   26 o  114.746   3.9674  274.322   18.644  255.043   27.432  290.871   25.416  110.943   5.9950  118.550   5.1981 -7.606682 7.934743 
1 1 1    7    9   27 o  184.076   3.0167  699.960   22.696  695.490   30.092  705.857   34.564  183.428   3.9777  184.724   4.5366 -1.296585 6.033439 
1 1 1    7    9   28 o   85.602   4.5088  152.123   15.892  153.055   21.891  151.085   23.109   85.896   6.1791   85.309   6.5677 0.5871353 9.017558 
1 1 1    7    9   29 o  186.639   3.3174  720.044   25.494  663.635   35.428  780.626   36.715  179.052   4.7973  194.226   4.5832 -15.17390 6.634778 
1 1 1    7    9   30 o   82.001   4.7294  139.731   15.992  135.954   22.429  143.638   22.809   80.871   6.7243   83.132   6.6522 -2.261147 9.458792 
1 1 1    7    9   31 o  167.528   3.1822  580.594   21.979  595.729   31.619  566.442   30.574  169.636   4.5192  165.420   4.4813 4.216888 6.364396 
1 1 1    7    9   32 o   90.532   5.5215  167.458   20.099  155.034   25.342  188.524   33.000   86.212   7.1270   94.853   8.4353 -8.640915 11.04300 
1 1 1    7    9   33 o   88.689   4.8555  164.793   17.696  150.731   25.256  178.355   24.802   84.903   7.2122   92.475   6.5028 -7.571960 9.710957 
1 1 1    7    9   34 o  104.100   4.3574  225.969   18.697  228.010   26.969  224.081   25.944  104.534   6.2552  103.665   6.0680 0.8688049 8.714811 
1 1 1    7    9   35 o   72.954   5.8097  112.906   17.458  116.769   24.380  108.840   25.012   74.297   7.9559   71.611   8.4684 2.686569 11.61938 
1 1 1    7    9   36 o   38.300   8.3502   30.094   15.908   50.839   22.785   10.366   22.220   47.203   11.750   29.396   11.868 17.80647 16.70035 
1 1 1    7    9   37 o   60.807   7.6779   83.833   18.559   70.017   26.987   96.230   25.564   54.982   12.218   66.632   9.3020 -11.65049 15.35588 
1 1 1    7    9   38 o   32.905   8.7628   19.760   16.316   14.387   22.900   25.300   23.252   30.761   12.172   35.050   12.609 -4.289574 17.52565 
1 1 1    7    9   39 o   59.722   7.5669   81.863   18.084   93.538   25.465   69.984   25.686   65.009   9.4974   54.434   11.783 10.57420 15.13384 
1 1 1    7    9   40 o   29.346   8.8741   1.3946   18.363  -8.7509   22.551   21.360   31.636   23.506   10.678   35.185   14.176 -11.67845 17.74813 
1 1 1    7    9   41 o   29.210   8.1031   7.8933   16.096 -15.0830   22.894   30.349   22.633   22.207   10.328   36.213   12.489 -14.00604 16.20620 
1 1 1    7    9   42 o   50.860   9.2354   68.778   21.064   35.961   32.183   93.372   27.860   39.048   14.697   62.673   11.189 -23.62529 18.47089 
1 1 1    7    9   43 o   39.694   8.9109   39.387   16.662   30.821   23.458   48.109   23.670   35.838   12.689   43.549   12.514 -7.711349 17.82185 
1 1 1    7    9   44 o   35.646   9.0494   31.306   17.685   42.576   24.105   18.166   26.027   40.204   12.861   31.088   12.735 9.115213 18.09888 
1 1 1    7    9   45 o   33.416   8.6928   27.571   15.767   25.418   22.122   29.793   22.478   32.515   12.195   34.317   12.391 -1.801807 17.38570 
1 1 1    7    9   46 o   32.873   8.2718   21.364   17.534   52.532   24.092 -13.7404   25.568   43.212   12.686   22.535   10.619 20.67738 16.54366 
1 1 1    7    9   47 o   27.063   8.6363   4.8400   20.327   11.486   24.951  -8.2751   35.050   27.566   11.931   26.560   12.490 1.005554 17.27268 
1 1 1    7    9   48 o   27.788   8.9273   8.9840   22.246   8.3014   33.065   9.5485   30.069   27.981   12.795   27.595   12.453 0.3860321 17.85459 
1 1 1    7    9   49 f   24.689   8.2561  -5.9242   22.043   0.8905   32.948 -11.4455   29.657   26.069   12.211   23.310   11.115 2.758299 16.51227 
1 1 1    7    9   50 o   25.227   8.4586  -1.3754   23.561  -9.0111   32.339   7.2632   34.398   23.843   11.433   26.611   12.469 -2.767891 16.91711 
1 1 1    7   10    0 o  107.544   2.6251  239.404   16.422  239.404   16.422  239.404   16.422  107.544   3.7124  107.544   3.7124 0.000000 0.000000 
1 1 1    7   10    1 o  301.030   3.0934  1865.19   36.101  1856.62   44.035  1882.77   63.049  300.002   3.5588  302.058   5.0608 -2.056396 6.186839 
1 1 1    7   10    2 o  336.940   2.9311  2338.23   40.213  2317.57   52.708  2367.00   62.205  335.174   3.8128  338.706   4.4529 -3.532806 5.862182 
1 1 1    7   10    3 o  282.253   3.1449  1646.15   35.991  1630.25   56.181  1657.23   46.872  281.081   4.8461  283.424   4.0097 -2.342468 6.289855 
1 1 1    7   10    4 f  233.258   2.8392  1128.67   27.165  1217.23   37.566  1031.60   39.329  242.908   3.7496  223.608   4.2644 19.29965 5.678473 
1 1 1    7   10    5 o  222.628   2.3672  1017.66   21.407  1049.22   33.532  995.957   27.813  225.522   3.6050  219.734   3.0689 5.788010 4.734325 
1 1 1    7   10    6 f  542.185   4.5315  5960.58   99.109  6576.07  160.735  5583.05  125.888  564.311   6.9060  520.060   5.8690 44.25116 9.063008 
1 1 1    7   10    7 o  149.390   2.1766  462.064   13.283  447.292   20.053  473.613   17.731  147.251   3.3018  151.528   2.8371 -4.276794 4.353296 
1 1 1    7   10    8 o  341.971   3.0104  2400.73   41.663  2474.44   66.048  2352.02   53.693  346.293   4.6244  337.649   3.8556 8.644562 6.020800 
1 1 1    7   10    9 o  460.309   3.7345  4366.00   69.911  4332.40   91.373  4413.44  108.574  458.204   4.8350  462.413   5.6929 -4.209106 7.468974 
1 1 1    7   10   10 o  430.780   3.5488  3833.94   62.518  3862.64   83.337  3797.01   94.548  432.647   4.6703  428.912   5.3446 3.734375 7.097625 
1 1 1    7   10   11 o  253.208   3.0605  1319.97   29.776  1314.77   36.028  1331.18   52.888  252.450   3.4602  253.967   5.0491 -1.516357 6.120995 
1 1 1    7   10   12 f  640.089   7.1523  8513.61  151.949  8539.16  170.385  8414.33  335.849  643.065   6.4241  637.114   12.781 5.951477 14.30455 
1 1 1    7   10   13 o  373.030   3.0984  2870.88   46.089  2869.04   58.164  2873.96   75.553  372.901   3.7818  373.158   4.9090 -0.2567139 6.196818 
1 1 1    7   10   14 o  122.738   2.5344  314.971   12.289  326.091   15.464  295.915   20.244  125.726   2.9821  119.749   4.0989 5.976906 5.068874 
1 1 1    7   10   15 o  211.886   2.4600  929.080   20.775  937.086   26.263  915.695   33.960  213.124   2.9877  210.647   3.9088 2.477173 4.919924 
1 1 1    7   10   16 o  296.086   3.2617  1798.68   37.273  1778.63   45.202  1841.28   65.884  293.578   3.7331  298.595   5.3497 -5.016113 6.523440 
1 1 1    7   10   17 o  233.761   2.6073  1124.78   24.126  1117.23   30.098  1138.35   40.353  232.692   3.1361  234.830   4.1663 -2.138000 5.214696 
1 1 1    7   10   18 o  516.865   4.1475  5519.51   87.472  5510.48  115.529  5531.64  133.903  516.450   5.4237  517.280   6.2762 -0.8301392 8.295024 
1 1 1    7   10   19 o  182.110   3.0524  684.999   22.920  672.377   32.599  697.338   32.232  180.447   4.3802  183.773   4.2524 -3.325912 6.104867 
1 1 1    7   10   20 o  191.398   2.6395  756.240   20.834  752.655   29.200  759.958   29.734  190.938   3.7079  191.859   3.7576 -0.9212799 5.279017 
1 1 1    7   10   21 f   95.280   3.5689  187.611   14.021  185.688   19.576  189.637   20.092   94.780   5.0078   95.779   5.0862 -0.9989319 7.137751 
1 1 1    7   10   22 o   64.920   5.5836   87.381   14.939   90.942   21.651   84.144   20.639   66.179   7.9321   63.661   7.8604 2.517506 11.16712 
1 1 1    7   10   23 o  127.094   3.5504  331.698   18.103  324.272   22.948  343.935   29.459  125.262   4.4418  128.927   5.5400 -3.664940 7.100749 
1 1 1    7   10   24 o   53.495   5.7899   59.355   12.759   63.468   18.513   55.635   17.608   55.259   8.1230   51.730   8.2527 3.528812 11.57978 
1 1 1    7   10   25 o  122.485   3.3912  307.148   17.005  285.793   22.454  335.871   26.041  117.556   4.6310  127.414   4.9554 -9.857903 6.782481 
1 1 1    7   10   26 o  215.571   3.2074  961.222   28.492  959.288   41.147  963.004   39.492  215.349   4.6327  215.793   4.4371 -0.4439850 6.414800 
1 1 1    7   10   27 o  110.103   3.5534  251.214   16.113  236.188   22.818  266.159   22.757  106.802   5.1801  113.403   4.8656 -6.600876 7.106825 
1 1 1    7   10   28 f  209.143   3.3375  904.711   28.719  821.075   40.015  993.558   41.243  199.157   4.8715  219.130   4.5633 -19.97316 6.675018 
1 1 1    7   10   29 f  118.455   3.8322  288.812   18.523  303.888   28.649  277.983   24.280  121.058   5.7378  115.852   5.0814 5.206276 7.664404 
1 1 1    7   10   30 f  130.280   4.0742  355.792   21.132  366.931   26.847  337.649   34.263  133.098   4.8906  127.461   6.5175 5.637405 8.148348 
1 1 1    7   10   31 o  107.797   4.7097  238.816   20.800  215.880   27.553  269.207   31.716  101.868   6.5578  113.725   6.7617 -11.85708 9.419366 
1 1 1    7   10   32 o   81.123   6.4242  136.513   21.342  121.585   28.245  156.377   32.583   76.040   9.0059   86.207   9.1639 -10.16643 12.84848 
1 1 1    7   10   33 o   59.303   7.2094   76.209   16.774  104.587   24.586   51.498   22.942   70.493   8.4561   48.114   11.679 22.37941 14.41882 
1 1 1    7   10   34 f   98.611   6.6817  215.123   25.450  178.394   42.051  236.354   31.971   91.113   11.190  106.110   7.3052 -14.99738 13.36346 
1 1 1    7   10   35 o   38.480   8.7751   31.867   16.212   22.512   23.244   40.730   22.624   34.464   12.576   42.496   12.241 -8.031666 17.55024 
1 1 1    7   10   36 o   43.680   8.3702   44.062   16.106   28.022   23.365   58.584   22.232   36.509   12.683   50.850   10.926 -14.34182 16.74048 
1 1 1    7   10   37 o   35.516   8.9728   25.943   16.668   28.678   23.050   22.946   24.133   36.561   12.603   34.472   12.775 2.089806 17.94568 
1 1 1    7   10   38 f   34.864   8.3982   23.657   15.816   5.5341   22.151   42.510   22.592   27.290   11.508   42.438   12.235 -15.14795 16.79643 
1 1 1    7   10   39 o   35.742   9.0392   26.052   17.478   40.253   25.479   13.431   24.020   41.064   13.231   30.421   12.319 10.64315 18.07845 
1 1 1    7   10   40 o   47.601   9.6374   50.655   21.134   25.201   27.368   88.255   33.262   35.357   13.494   59.846   13.763 -24.48876 19.27474 
1 1 1    7   10   41 o   46.750   8.5744   53.661   16.688   56.907   23.778   50.510   23.426   48.224   12.002   45.275   12.248 2.949390 17.14877 
1 1 1    7   10   42 o   34.465   8.9475   26.863   16.683   25.885   23.785   27.810   23.406   34.112   12.674   34.817   12.633 -0.7047424 17.89501 
1 1 1    7   10   43 o   76.743   5.6487  130.315   17.666  105.660   24.101  158.946   25.971   68.548   8.5245   84.937   7.4136 -16.38859 11.29733 
1 1 1    7   10   44 o   36.637   8.9239   34.351   16.600   42.032   23.468   26.660   23.484   39.876   12.683   33.398   12.558 6.477352 17.84781 
1 1 1    7   10   45 o   25.075   8.0841  -4.2216   18.412   3.2101   27.499 -10.2605   24.788   27.013   12.071   23.138   10.756 3.875149 16.16817 
1 1 1    7   10   46 o   41.930   9.1681   49.888   17.875   62.526   25.735   38.108   24.846   47.111   12.877   36.750   13.054 10.36078 18.33628 
1 1 1    7   10   47 o   31.082   9.4813   20.086   22.008   11.108   29.159   31.970   33.550   28.278   12.546   33.886   14.219 -5.608826 18.96255 
1 1 1    7   10   48 o   30.709   9.4938   20.557   22.839   36.805   34.537   7.9297   30.447   34.140   14.381   27.278   12.398 6.861776 18.98754 
1 1 1    7   10   49 o   24.789   8.2461  -2.0074   21.627  -6.8596   32.812   1.7198   28.758   24.620   11.726   24.958   11.597 -0.3383007 16.49216 
1 1 1    7   10   50 f   29.311   9.0091   8.1765   22.261   60.852   34.393 -29.8048   29.204   38.274   14.987   20.348   10.002 17.92647 18.01825 
1 1 1    7   11    0 o  265.476   2.7365  1454.64   42.353  1454.64   42.353  1454.64   42.353  265.476   3.8699  265.476   3.8699 0.000000 0.000000 
1 1 1    7   11    1 o  358.649   2.8329  2653.40   41.898  2631.60   58.628  2676.16   59.898  357.145   3.9801  360.154   4.0323 -3.009247 5.665793 
1 1 1    7   11    2 o  233.782   2.3901  1129.83   22.897  1105.52   34.186  1149.60   30.836  231.492   3.5806  236.071   3.1670 -4.578903 4.780178 
1 1 1    7   11    3 o  517.177   4.3773  5562.68   86.070  5416.47  154.473  5628.50  103.650  512.099   7.3136  522.255   4.8120 -10.15643 8.754653 
1 1 1    7   11    4 o  279.427   2.9596  1622.06   32.574  1573.17   54.492  1649.25   40.633  276.107   4.7851  282.748   3.4843 -6.641083 5.919284 
1 1 1    7   11    5 o  500.711   4.4908  5155.99   86.764  5232.81  153.108  5119.66  105.304  503.350   7.3750  498.073   5.1261 5.276550 8.981511 
1 1 1    7   11    6 o  210.642   2.3460  918.665   20.291  871.144   29.653  960.513   27.826  205.497   3.4986  215.788   3.1265 -10.29059 4.692039 
1 1 1    7   11    7 o  883.481   6.9745 16078.04  252.812 16710.28  380.358 15577.68  338.375  898.886   10.259  868.076   9.4509 30.80988 13.94902 
1 1 1    7   11    8 o  419.750   3.6872  3636.20   63.833  3623.52   89.867  3649.11   90.685  419.012   5.2000  420.487   5.2290 -1.475159 7.374482 
1 1 1    7   11    9 o  207.802   2.4431  893.720   20.741  913.177   27.671  868.769   31.334  210.398   3.1887  205.207   3.7022 5.190887 4.886133 
1 1 1    7   11   10 o  355.071   3.8056  2534.94   52.222  2418.16   62.927  2793.29   93.599  342.326   4.4569  367.816   6.1699 -25.49023 7.611231 
1 1 1    7   11   11 o  344.253   3.3115  2471.48   43.400  2514.18   52.393  2378.11   77.468  349.090   3.6389  339.417   5.5338 9.673401 6.623057 
1 1 1    7   11   12 o  277.391   3.1786  1568.65   33.202  1541.51   39.408  1635.07   61.637  273.344   3.4955  281.437   5.3100 -8.092896 6.357254 
1 1 1    7   11   13 o  287.471   2.6805  1704.92   30.696  1704.13   38.685  1706.27   50.441  287.402   3.2635  287.539   4.2532 -0.1367798 5.361010 
1 1 1    7   11   14 o  449.218   3.5114  4179.76   63.425  4228.20   81.368  4104.75  101.250  452.604   4.3588  445.831   5.5063 6.772949 7.022708 
1 1 1    7   11   15 o  291.045   2.7403  1746.69   31.707  1742.64   39.826  1753.70   52.398  290.614   3.3227  291.476   4.3586 -0.8626709 5.480660 
1 1 1    7   11   16 o  314.108   3.3556  2023.67   40.667  1999.26   49.293  2075.67   71.959  311.233   3.8401  316.984   5.5041 -5.751221 6.711230 
1 1 1    7   11   17 o  162.123   2.5483  543.943   16.298  547.570   20.314  537.393   27.302  162.903   3.0235  161.343   4.1028 1.559387 5.096515 
1 1 1    7   11   18 o  239.576   2.7842  1186.62   27.359  1202.14   36.935  1167.77   40.726  241.327   3.7108  237.824   4.1519 3.502747 5.568486 
1 1 1    7   11   19 o   97.447   3.3652  198.727   13.026  206.291   16.525  186.312   21.171   99.954   4.0084   94.941   5.4065 5.012367 6.730350 
1 1 1    7   11   20 o   67.591   4.7194   94.499   13.140   92.937   18.077   96.249   19.135   67.004   6.5410   68.177   6.8049 -1.173134 9.438840 
1 1 1    7   11   21 o   44.353   6.8291   42.885   12.121   38.125   17.820   46.984   16.536   41.934   10.363   46.773   8.8969 -4.838768 13.65814 
1 1 1    7   11   22 o   88.214   4.2032  161.164   15.285  157.832   21.798  164.388   21.440   87.310   6.0533   89.117   5.8331 -1.807365 8.406382 
1 1 1    7   11   23 o  100.024   4.1470  206.057   17.029  196.707   22.816  217.817   25.588   97.488   5.6745  102.560   6.0491 -5.072388 8.294080 
1 1 1    7   11   24 o   68.490   4.6707   97.462   13.170   92.845   18.881  101.837   18.380   66.893   6.8434   70.087   6.3584 -3.193863 9.341367 
1 1 1    7   11   25 o   53.455   6.8306   57.909   14.462   75.689   23.603   47.221   18.300   60.215   9.5039   46.695   9.8135 13.51951 13.66117 
1 1 1    7   11   26 o   71.714   4.9816  106.503   14.680   94.314   20.194  120.163   21.378   67.360   7.2688   76.069   6.8140 -8.708717 9.963254 
1 1 1    7   11   27 o  168.640   3.0926  583.373   21.373  547.966   28.356  629.950   32.522  162.781   4.2235  174.499   4.5188 -11.71773 6.185250 
1 1 1    7   11   28 o  235.071   3.0574  1129.63   29.181  1071.63   37.659  1216.79   46.162  227.657   4.0107  242.484   4.6157 -14.82664 6.114815 
1 1 1    7   11   29 o   57.679   7.1122   70.339   16.399   86.367   24.347   57.029   22.186   64.234   9.1900   51.125   10.857 13.10862 14.22434 
1 1 1    7   11   30 o  179.793   3.6045  673.381   26.580  624.981   38.759  716.352   36.521  173.606   5.4131  185.980   4.7611 -12.37393 7.209034 
1 1 1    7   11   31 o  114.502   4.3473  271.465   20.393  230.365   27.916  318.502   29.863  105.202   6.4336  123.800   5.8486 -18.59800 8.694674 
1 1 1    7   11   32 o   61.579   7.0933   79.277   17.425   97.546   27.231   66.610   22.674   67.930   9.7194   55.228   10.334 12.70218 14.18661 
1 1 1    7   11   33 o  131.709   4.3146  364.007   22.771  371.866   29.139  351.677   36.495  133.728   5.2831  129.689   6.8228 4.038528 8.629117 
1 1 1    7   11   34 o   88.244   5.9638  161.820   21.400  184.715   33.887  146.633   27.600   93.221   8.8137   83.267   8.0367 9.954063 11.92770 
1 1 1    7   11   35 o  105.656   4.2649  234.105   18.556  235.617   27.045  232.759   25.507  105.930   6.1902  105.381   5.8685 0.5492096 8.529819 
1 1 1    7   11   36 o   46.076   8.1492   49.991   16.301   27.847   23.767   69.659   22.399   36.385   12.783   55.767   10.111 -19.38199 16.29845 
1 1 1    7   11   37 o   68.715   6.2289  102.100   17.625  104.528   24.447   99.472   25.433   69.671   8.5076   67.758   9.1005 1.912621 12.45788 
1 1 1    7   11   38 o   67.026   6.4566   98.532   17.817  106.693   26.021   91.329   24.445   69.664   9.0564   64.387   9.2051 5.276535 12.91326 
1 1 1    7   11   39 o  124.981   3.8982  330.553   20.088  321.493   28.434  339.581   28.383  123.223   5.5948  126.738   5.4298 -3.514793 7.796447 
1 1 1    7   11   40 o   23.695   7.5797 -13.6353   17.108 -40.8056   26.550   5.6548   22.371   20.249   9.8638   27.142   11.511 -6.892578 15.15938 
1 1 1    7   11   41 o   36.457   9.3052   21.154   20.440   57.371   30.635  -7.9007   27.440   47.043   14.422   25.872   11.763 21.17097 18.61043 
1 1 1    7   11   42 o   29.644   8.5558   13.386   16.790   5.8050   23.995   20.658   23.503   27.353   11.769   31.935   12.421 -4.582121 17.11153 
1 1 1    7   11   43 o   51.826   8.2979   67.428   17.329   63.890   24.236   71.128   24.787   50.280   11.876   53.373   11.592 -3.093399 16.59574 
1 1 1    7   11   44 o   37.508   9.0168   37.019   16.671   35.119   23.219   39.041   23.951   36.689   12.649   38.327   12.853 -1.637684 18.03370 
1 1 1    7   11   45 o   28.066   8.6414   9.1374   18.873   1.0090   25.990   18.205   27.451   25.717   11.594   30.416   12.817 -4.699720 17.28289 
1 1 1    7   11   46 o   42.676   9.2323   52.763   18.057   60.316   24.870   44.343   26.259   46.392   12.650   38.960   13.451 7.432178 18.46470 
1 1 1    7   11   47 o   28.150   9.5053  -7.8901   25.982   26.487   51.245 -19.7841   30.143   33.425   15.514   22.875   10.987 10.55013 19.01058 
1 1 1    7   11   48 o   31.653   10.228   24.375   28.527   24.297   33.973   24.563   52.529   30.954   13.647   32.353   15.238 -1.398483 20.45539 
1 1 1    7   11   49 o   23.007   7.9693 -24.0415   24.975 -46.6451   44.319 -13.5238   30.232   23.208   11.566   22.806   10.967 0.4023552 15.93859 
1 1 1    7   12    0 f  105.798   1.9350  231.313   11.923  231.313   11.923  231.313   11.923  105.798   2.7365  105.798   2.7365 0.000000 0.000000 
1 1 1    7   12    1 o   67.739   2.1494   94.846   5.9831  104.609   8.4845   85.188   8.4384   71.215   2.8886   64.263   3.1837 6.951431 4.298840 
1 1 1    7   12    2 f  294.315   3.0565  1791.97   35.166  1772.29   60.090  1802.22   43.367  293.060   4.9714  295.571   3.5574 -2.511414 6.113098 
1 1 1    7   12    3 o  369.173   3.4184  2815.45   47.267  2804.93   87.587  2819.77   56.144  368.638   5.7607  369.709   3.6820 -1.071228 6.836846 
1 1 1    7   12    4 o  490.236   3.8580  4969.57   77.691  4847.52  114.364  5074.17  105.871  484.616   5.7217  495.856   5.1767 -11.23965 7.715991 
1 1 1    7   12    5 o  340.291   2.9709  2382.57   41.072  2427.15   64.137  2351.58   53.474  342.967   4.5341  337.614   3.8402 5.353027 5.941823 
1 1 1    7   12    6 f  539.264   4.0137  6000.69   86.416  6011.68  141.253  5994.13  109.246  539.593   6.3470  538.935   4.9148 0.6569824 8.027391 
1 1 1    7   12    7 o  124.947   2.7158  297.650   13.454  435.886   22.972  225.487   16.598  145.351   3.8319  104.542   3.8494 40.80900 5.431507 
1 1 1    7   12    8 o  245.562   2.6362  1236.87   26.569  1314.02   40.019  1176.06   35.528  252.367   3.8448  238.758   3.6079 13.60851 5.272480 
1 1 1    7   12    9 o   90.662   2.4201  170.391   8.9520  163.555   13.547  175.690   11.927   89.037   3.6889   92.286   3.1336 -3.249390 4.840180 
1 1 1    7   12   10 o  413.056   3.6848  3520.20   62.751  3573.19   90.257  3470.62   87.303  416.059   5.2597  410.052   5.1621 6.007813 7.369655 
1 1 1    7   12   11 o  253.134   3.8614  1322.16   40.315  1322.16   40.315   0.0000   0.0000  253.134   3.8614  ?   ?       ?      ? 
1 1 1    7   12   12 o  316.253   4.3951  2104.26   45.732  2130.26   51.250  2002.64  101.320  321.298   3.8674  311.208   7.8937 10.09015 8.790159 
1 1 1    7   12   13 o  215.993   2.7201  980.002   22.396  1009.70   27.162  916.940   39.582  221.226   2.9769  210.760   4.5535 10.46600 5.440217 
1 1 1    7   12   14 o  305.611   2.7988  1925.12   33.976  1918.40   42.616  1936.85   56.285  304.912   3.3887  306.309   4.4552 -1.397400 5.597506 
1 1 1    7   12   15 o   80.805   3.4304  138.732   11.076  156.280   14.603  114.962   16.995   87.011   4.0691   74.598   5.5237 12.41351 6.860703 
1 1 1    7   12   16 o  167.048   2.8341  579.602   18.289  586.362   22.327  565.813   31.888  168.568   3.2113  165.529   4.6708 3.039429 5.668239 
1 1 1    7   12   17 o  313.604   2.8707  2029.63   35.845  2027.41   45.135  2033.43   58.987  313.417   3.4916  313.790   4.5578 -0.3730164 5.741444 
1 1 1    7   12   18 o   80.518   3.8339  133.680   12.706  129.222   17.323  138.872   18.695   79.072   5.3116   81.964   5.5302 -2.891853 7.667886 
1 1 1    7   12   19 o  235.910   2.7949  1152.74   27.077  1193.85   37.031  1105.51   39.693  240.460   3.7339  231.359   4.1597 9.101227 5.589711 
1 1 1    7   12   20 o  167.918   2.7739  584.846   18.951  597.981   24.993  567.079   29.068  170.169   3.5610  165.666   4.2542 4.503235 5.547884 
1 1 1    7   12   21 o  121.920   3.2511  306.801   16.316  300.526   22.295  314.037   23.943  120.586   4.4827  123.253   4.7099 -2.666832 6.502140 
1 1 1    7   12   22 o  302.944   3.0381  1897.06   37.659  1891.86   56.914  1901.12   50.227  302.534   4.5612  303.353   4.0144 -0.8186646 6.076179 
1 1 1    7   12   23 o   57.132   5.7789   66.682   13.494   77.956   20.819   58.516   17.719   61.217   8.2456   53.046   8.0988 8.171009 11.55770 
1 1 1    7   12   24 o  261.107   3.4513  1393.16   34.393  1365.78   41.229  1455.80   62.365  257.091   3.8882  265.123   5.7034 -8.031708 6.902631 
1 1 1    7   12   25 o  104.761   4.0568  228.283   17.404  219.531   25.926  235.463   23.481  102.893   6.1093  106.630   5.3392 -3.737335 8.113617 
1 1 1    7   12   26 o   71.182   4.7421  105.694   13.855   98.276   20.126  112.376   19.101   68.768   7.0959   73.596   6.2927 -4.828087 9.484200 
1 1 1    7   12   27 f  123.357   3.3495  314.984   17.039  312.800   24.257  317.112   23.939  122.930   4.7842  123.783   4.6890 -0.8535767 6.698906 
1 1 1    7   12   28 o  199.909   3.0807  823.218   25.238  796.868   33.602  857.319   38.226  196.285   4.1506  203.533   4.5537 -7.248337 6.161446 
1 1 1    7   12   29 o   45.912   8.3008   46.254   15.772   46.508   21.870   45.979   22.768   46.043   11.539   45.781   11.936 0.2622147 16.60164 
1 1 1    7   12   30 o  121.766   4.0212  309.178   20.039  295.741   29.884  320.157   27.013  119.294   6.0737  124.238   5.2716 -4.944054 8.042392 
1 1 1    7   12   31 o  134.545   3.5593  375.650   19.750  371.924   27.975  379.353   27.887  133.874   5.0666  135.215   5.0004 -1.341431 7.118594 
1 1 1    7   12   32 o   45.395   8.2547   41.057   16.632   75.075   26.165   17.993   21.544   58.375   11.276   32.415   12.059 25.95953 16.50947 
1 1 1    7   12   33 f  227.586   3.4319  1073.00   31.588  1058.49   40.725  1094.93   50.048  225.829   4.3723  229.343   5.2910 -3.513779 6.863794 
1 1 1    7   12   34 o   28.475   8.3196   5.9476   16.104   13.272   22.886  -1.2367   22.666   30.825   12.177   26.126   11.339 4.699095 16.63922 
1 1 1    7   12   35 o   25.113   7.6448  -6.5020   15.420   13.029   22.154 -24.8566   21.476   30.222   11.968   20.003   9.5159 10.21851 15.28970 
1 1 1    7   12   36 o   25.131   7.7576  -4.9806   15.705   8.5088   22.614 -17.5481   21.827   28.734   11.832   21.528   10.036 7.205996 15.51514 
1 1 1    7   12   37 o   42.771   8.5253   42.979   16.077   31.465   22.908   54.154   22.567   37.404   12.570   48.138   11.520 -10.73325 17.05062 
1 1 1    7   12   38 o   26.646   8.2408  -1.9448   17.681 -14.4087   25.761   9.1570   24.312   24.095   11.118   29.196   12.166 -5.101488 16.48151 
1 1 1    7   12   39 o   77.710   5.4607  130.834   17.482  130.323   24.146  131.398   25.345   77.638   7.5406   77.782   7.9003 -0.1444931 10.92131 
1 1 1    7   12   40 o   26.742   8.2131   1.1745   17.359 -14.0468   27.285   11.525   22.499   24.640   11.395   28.845   11.831 -4.205271 16.42625 
1 1 1    7   12   41 o   26.915   8.9536 -23.5775   24.449 -33.0717   30.974  -7.8850   39.821   23.248   11.159   30.582   14.006 -7.334293 17.90727 
1 1 1    7   12   42 o   30.420   8.2278   9.4702   16.612   38.815   24.400 -15.8829   22.679   39.214   12.968   21.626   10.130 17.58830 16.45568 
1 1 1    7   12   43 f   24.505   7.7546  -2.9523   16.329   6.8291   23.502 -12.0801   22.703   26.926   11.616   22.084   10.276 4.841831 15.50911 
1 1 1    7   12   44 o   19.614   6.6583 -23.4562   15.611 -28.0738   21.756 -18.5553   22.413   18.676   9.0588   20.552   9.7607 -1.876192 13.31664 
1 1 1    7   12   45 o   25.190   8.0472  -8.9881   18.575 -31.6801   24.728   20.400   28.141   19.451   9.4848   30.929   13.003 -11.47804 16.09434 
1 1 1    7   12   46 o   36.145   9.9120   35.573   20.225   26.582   24.897   53.019   34.681   32.105   12.695   40.184   15.226 -8.078888 19.82400 
1 1 1    7   12   47 o   28.965   12.773   16.193   29.781   0.0000   0.0000   16.193   29.781  ?   ?    28.965   12.773      ?      ? 
1 1 1    7   12   48 o   39.378   10.640   49.760   26.289   12.776   34.068  104.199   41.332   28.278   12.952   50.477   16.885 -22.19866 21.28028 
1 1 1    7   12   49 o   24.675   8.2190 -12.3597   21.513   29.488   33.763 -40.9642   27.914   30.579   13.537   18.771   9.3258 11.80778 16.43807 
1 1 1    7   13    0 o  629.604   4.4245  8181.97  162.450  8181.97  162.450  8181.97  162.450  629.604   6.2572  629.604   6.2572 0.000000 0.000000 
1 1 1    7   13    1 o  473.754   4.0923  4658.88   73.298  4568.88  133.109  4698.05   87.810  470.354   6.8614  477.155   4.4619 -6.800598 8.184616 
1 1 1    7   13    2 o  425.644   3.7606  3764.81   60.710  3674.62  109.501  3804.83   72.949  421.865   6.2933  429.424   4.1188 -7.558960 7.521299 
1 1 1    7   13    3 o  134.019   2.1794  362.711   11.919  434.614   18.482  311.518   15.595  145.151   3.0872  122.888   3.0769 22.26280 4.358722 
1 1 1    7   13    4 o  173.249   2.1655  620.969   15.340  604.758   23.110  633.736   20.509  171.218   3.2725  175.280   2.8370 -4.061462 4.331054 
1 1 1    7   13    5 o  199.846   2.4001  818.871   19.697  876.814   29.573  772.667   26.408  206.160   3.4779  193.532   3.3083 12.62714 4.800110 
1 1 1    7   13    6 o  393.633   3.1235  3209.39   49.589  3138.55   78.401  3256.63   64.022  389.972   4.8744  397.293   3.9071 -7.321960 6.246999 
1 1 1    7   13    7 o  398.223   3.3006  3279.23   54.065  3165.60   78.574  3381.41   74.508  391.645   4.8643  404.800   4.4627 -13.15454 6.601271 
1 1 1    7   13    8 o  516.215   3.8721  5503.93   79.965  5489.28  129.903  5512.86  101.468  515.596   6.1086  516.833   4.7600 -1.237305 7.744235 
1 1 1    7   13    9 o  291.245   2.5469  1748.73   30.573  1785.89   44.214  1714.69   42.322  294.206   3.6437  288.285   3.5594 5.920990 5.093752 
1 1 1    7   13   10 o  616.481   4.7564  7826.89  118.764  7720.58  153.554  7985.17  187.362  611.393   6.0894  621.568   7.3085 -10.17603 9.512872 
1 1 1    7   13   11 o  167.290   2.7877  584.951   18.754  614.531   24.337  541.707   29.426  172.579   3.4191  162.002   4.4040 10.57668 5.575385 
1 1 1    7   13   12 f   84.025   3.0450  144.200   10.438  116.959   14.059  177.660   15.581   75.271   4.5285   92.779   4.0718 -17.50774 6.089921 
1 1 1    7   13   13 o  332.900   3.4791  2298.18   45.156  2318.82   55.585  2258.12   77.438  335.180   4.0208  330.621   5.6788 4.558716 6.958166 
1 1 1    7   13   14 o  442.010   3.4752  4049.80   61.846  4105.60   79.575  3964.69   98.286  445.941   4.3265  438.079   5.4397 7.861572 6.950428 
1 1 1    7   13   15 o  444.631   4.1611  4076.19   71.639  4057.90   87.291  4113.92  125.381  443.272   4.7746  445.989   6.8162 -2.716827 8.322102 
1 1 1    7   13   16 o  339.278   2.9664  2393.15   40.634  2461.93   52.774  2293.01   63.679  345.352   3.7051  333.203   4.6336 12.14841 5.932781 
1 1 1    7   13   17 o  108.936   3.5261  254.365   15.140  284.743   19.528  208.601   23.969  117.430   4.0320  100.442   5.7858 16.98795 7.052122 
1 1 1    7   13   18 o  225.133   3.6099  1048.94   26.305  1049.75   29.240  1045.52   60.247  225.521   3.1435  224.746   6.4995 0.7749176 7.219745 
1 1 1    7   13   19 o  107.925   3.4774  239.407   15.168  233.958   19.484  247.788   24.166  106.401   4.4397  109.448   5.3534 -3.047516 6.954870 
1 1 1    7   13   20 o   63.213   5.5821  102.228   11.397  147.707   14.896   38.026   17.699   84.547   4.2718   41.878   10.315 42.66937 11.16420 
1 1 1    7   13   21 f  107.875   3.2234  223.367   13.096  201.415   15.313  283.153   25.272   98.750   3.7597  117.000   5.2370 -18.24956 6.446820 
1 1 1    7   13   22 o  236.518   2.7771  1155.53   26.662  1153.98   34.744  1157.74   41.583  236.365   3.5639  236.670   4.2600 -0.3042908 5.554227 
1 1 1    7   13   23 o  183.714   2.9016  698.343   21.779  691.766   33.069  703.381   28.943  182.920   4.3832  184.507   3.8033 -1.586960 5.803232 
1 1 1    7   13   24 o  122.465   3.7189  314.122   18.139  325.279   23.080  296.102   29.334  125.410   4.4621  119.520   5.9506 5.890427 7.437753 
1 1 1    7   13   25 o  124.169   3.7232  320.103   18.941  311.714   28.259  326.946   25.524  122.655   5.5861  125.682   4.9239 -3.026924 7.446400 
1 1 1    7   13   26 o   45.278   7.3570   44.514   13.440   48.315   19.650   41.173   18.424   47.103   10.393   43.453   10.416 3.650051 14.71406 
1 1 1    7   13   27 f   39.929   7.9794   33.477   13.974   45.217   20.760   23.751   18.896   45.472   11.154   34.385   11.414 11.08714 15.95873 
1 1 1    7   13   28 o   76.659   4.9791  123.546   15.576  109.119   22.800  136.171   21.328   72.358   7.6397   80.959   6.3874 -8.601479 9.958127 
1 1 1    7   13   29 o   90.397   4.6763  170.512   17.377  181.905   24.213  158.413   24.953   93.559   6.2748   87.235   6.9353 6.323952 9.352655 
1 1 1    7   13   30 f  115.570   4.5483  279.073   21.331  272.370   33.057  283.855   27.921  114.272   7.0139  116.867   5.7926 -2.594803 9.096642 
1 1 1    7   13   31 o   74.365   5.4328  118.288   16.299   95.198   23.852  138.515   22.324   67.265   8.5975   81.464   6.6441 -14.19963 10.86558 
1 1 1    7   13   32 o   56.477   7.2430   69.271   16.434   61.774   23.454   76.502   23.034   52.831   11.116   60.123   9.2889 -7.291683 14.48592 
1 1 1    7   13   33 f   53.877   11.039   66.838   25.529   63.574   32.780   71.870   40.699   52.425   14.613   55.330   16.550 -2.905376 22.07824 
1 1 1    7   13   34 o  107.163   4.2248  240.454   18.606  269.840   26.917  213.569   25.747  113.488   5.7507  100.838   6.1907 12.64974 8.449558 
1 1 1    7   13   35 o   23.700   7.5047  -7.7953   15.289  -0.6186   21.548 -15.0709   21.696   25.430   11.047   21.970   10.161 3.460197 15.00931 
1 1 1    7   13   36 o   46.176   7.6933   48.087   16.244   17.326   22.881   79.345   23.065   31.887   12.297   60.465   9.2488 -28.57754 15.38652 
1 1 1    7   13   37 o   38.200   8.7474   33.768   15.849   28.628   22.435   38.889   22.394   35.862   12.430   40.538   12.311 -4.675480 17.49474 
1 1 1    7   13   38 o   54.452   8.6885   69.750   19.265   49.462   25.791   95.360   28.977   45.033   13.098   63.870   11.419 -18.83741 17.37709 
1 1 1    7   13   39 o   33.239   7.6165   11.779   15.998 -26.6576   22.360   52.090   22.898   19.900   9.5329   46.578   11.882 -26.67764 15.23308 
1 1 1    7   13   40 o   19.707   6.7201 -30.5309   16.230 -21.7035   23.883 -38.1055   22.123   21.446   10.153   17.968   8.8063 3.477463 13.44022 
1 1 1    7   13   41 o   33.876   9.2458   24.111   19.106   34.139   24.007   6.7898   31.552   37.349   12.863   30.403   13.284 6.945950 18.49153 
1 1 1    7   13   42 o   25.878   8.0431   1.5446   16.721  -4.7723   24.240   7.2786   23.095   24.587   11.130   27.168   11.614 -2.581293 16.08624 
1 1 1    7   13   43 o   60.617   7.1633   88.687   17.191  107.283   24.531   70.741   24.098   68.294   8.7090   52.939   11.376 15.35479 14.32670 
1 1 1    7   13   44 o   33.601   9.1635   28.449   18.092   33.513   25.491   23.308   25.683   35.380   13.126   31.821   12.790 3.559273 18.32703 
1 1 1    7   13   45 o   28.017   8.6399   1.8390   20.168   31.144   29.543 -23.7351   27.598   34.197   13.727   21.837   10.495 12.35954 17.27975 
1 1 1    7   13   46 o   25.379   8.2263   0.3120   19.264   2.3255   24.848  -2.7214   30.498   24.984   11.293   25.774   11.965 -0.7897816 16.45266 
1 1 1    7   13   47 o   34.798   9.9234   38.404   22.993   21.391   34.371   52.186   30.935   30.579   13.591   39.018   14.463 -8.438906 19.84688 
1 1 1    7   13   48 o   32.546   10.318   36.524   28.083   37.468   33.482   34.283   51.572   32.912   14.025   32.180   15.139 0.7322922 20.63661 
1 1 1    7   13   49 o   24.519   8.2043  -5.1832   21.644   16.377   33.342 -20.8837   28.453   27.907   12.793   21.130   10.275 6.776367 16.40857 
1 1 1    7   14    0 o  417.015   2.8347  3588.16   68.937  3588.16   68.937  3588.16   68.937  417.015   4.0089  417.015   4.0089 0.000000 0.000000 
1 1 1    7   14    1 o  545.244   4.5941  6169.80   94.585  6062.50  172.220  6216.14  113.182  541.683   7.7086  548.806   5.0003 -7.123108 9.188288 
1 1 1    7   14    2 o  314.667   3.0380  2068.98   36.594  1972.93   64.514  2114.54   44.433  309.178   5.0592  320.155   3.3649 -10.97733 6.076052 
1 1 1    7   14    3 o  378.761   3.1843  2958.14   49.152  2975.22   75.670  2945.67   64.648  379.687   4.8321  377.835   4.1484 1.852264 6.368564 
1 1 1    7   14    4 o  125.178   2.4244  316.367   12.044  348.104   20.390  299.358   14.927  129.892   3.8060  120.465   3.0043 9.426346 4.848898 
1 1 1    7   14    5 o   95.553   2.6386  200.783   9.7417  135.997   14.890  249.264   12.881   81.180   4.4472  109.926   2.8411 -28.74654 5.277246 
1 1 1    7   14    6 o  225.567   2.6999  1061.94   24.008  1007.65   39.849  1092.87   30.079  220.970   4.3724  230.164   3.1686 -9.193314 5.399792 
1 1 1    7   14    7 o  198.898   2.4104  800.067   19.516  916.312   30.776  721.880   25.240  210.740   3.5407  187.057   3.2715 23.68324 4.820735 
1 1 1    7   14    8 o  292.212   2.6034  1759.60   30.396  1771.26   49.654  1752.61   38.439  292.964   4.1094  291.460   3.1976 1.503906 5.206898 
1 1 1    7   14    9 o  377.760   3.7546  2956.43   58.302  3125.25   80.833  2773.37   84.171  389.062   5.0374  366.457   5.5690 22.60474 7.509217 
1 1 1    7   14   10 o  107.958   2.7232  235.577   11.393  226.631   13.787  254.839   20.231  104.805   3.1895  111.111   4.4146 -6.305916 5.446303 
1 1 1    7   14   11 o  293.985   2.9800  1782.33   36.077  1756.10   49.497  1812.06   52.695  291.686   4.1143  296.284   4.3121 -4.598114 5.960032 
1 1 1    7   14   12 o  295.893   2.7300  1811.08   32.325  1823.81   41.091  1790.43   52.358  297.290   3.3512  294.495   4.3106 2.795319 5.460034 
1 1 1    7   14   13 o   72.256   4.5574  102.282   12.261   95.496   14.295  121.166   23.847   67.995   5.0974   76.517   7.5562 -8.522217 9.114760 
1 1 1    7   14   14 o  189.626   2.5578  742.222   19.725  742.495   25.827  741.840   30.555  189.682   3.3013  189.571   3.9079 0.1105499 5.115646 
1 1 1    7   14   15 o  247.995   2.9040  1269.56   27.031  1269.13   32.142  1270.59   49.961  247.987   3.1426  248.004   4.8843 -0.1686096E-01 5.807951 
1 1 1    7   14   16 o   86.242   3.0045  149.670   10.259  140.415   12.658  167.391   17.516   82.470   3.7214   90.014   4.7180 -7.543579 6.008983 
1 1 1    7   14   17 o   68.737   3.6498  101.082   9.7131  108.850   12.112   87.086   16.259   72.598   4.0451   64.875   6.0763 7.722374 7.299616 
1 1 1    7   14   18 o  155.160   2.5694  498.423   15.778  501.648   19.745  492.727   26.243  155.887   3.0711  154.432   4.1202 1.455017 5.138813 
1 1 1    7   14   19 o   60.639   4.7802   76.379   11.905   68.028   16.777   84.849   16.896   57.277   7.1016   64.001   6.4007 -6.723522 9.560396 
1 1 1    7   14   20 o  353.877   3.2138  2593.64   46.582  2635.21   62.584  2542.00   69.749  357.114   4.2490  350.641   4.8229 6.473145 6.427688 
1 1 1    7   14   21 o   38.020   6.4431   35.141   10.772   47.775   13.161   9.5065   18.747   47.999   6.6481   28.040   11.039 19.95894 12.88629 
1 1 1    7   14   22 o  154.065   2.9919  486.376   17.216  480.689   20.345  500.716   32.306  152.569   3.2332  155.562   5.0352 -2.993179 5.983879 
1 1 1    7   14   23 o   58.081   5.6608   77.804   11.214   85.817   13.285   57.954   20.911   64.394   5.0023   51.767   10.157 12.62639 11.32165 
1 1 1    7   14   24 o  102.219   4.5159  216.774   19.033  215.581   26.560  218.033   27.289  101.937   6.3173  102.502   6.4550 -0.5646591 9.031874 
1 1 1    7   14   25 o  114.633   3.9268  269.940   18.111  261.892   23.036  282.967   29.309  112.471   4.9659  116.795   6.0842 -4.323624 7.853575 
1 1 1    7   14   26 o  112.136   3.6758  261.064   16.847  255.863   25.461  265.115   22.469  111.105   5.5563  113.168   4.8139 -2.062386 7.351595 
1 1 1    7   14   27 o  109.529   4.1132  248.244   18.499  217.303   25.500  282.616   26.877  102.317   6.0427  116.741   5.5821 -14.42332 8.226436 
1 1 1    7   14   28 o  103.062   3.9918  220.706   16.941  209.705   24.196  231.284   23.727  100.518   5.8363  105.606   5.4475 -5.088638 7.983585 
1 1 1    7   14   29 o   52.639   7.3310   60.079   15.322   66.488   22.592   54.620   20.850   55.303   10.283   49.976   10.451 5.327103 14.66203 
1 1 1    7   14   30 o   46.359   8.6489   47.443   18.819   14.803   27.497   76.201   25.810   33.723   13.340   58.995   11.012 -25.27198 17.29788 
1 1 1    7   14   31 o  112.989   3.9863  265.241   18.544  273.674   27.197  257.915   25.351  114.642   5.7519  111.335   5.5207 3.307236 7.972614 
1 1 1    7   14   32 o   72.677   5.6613  112.061   16.844  105.735   24.941  117.365   22.839   70.662   8.5580   74.691   7.4138 -4.029037 11.32268 
1 1 1    7   14   33 o   27.996   9.0313 -11.5432   20.586 -16.4626   40.046  -9.7763   24.000   31.283   14.218   24.709   11.140 6.574104 18.06262 
1 1 1    7   14   34 o   57.295   8.7780   73.930   19.497   69.209   24.283   82.493   32.704   55.298   11.034   59.292   13.655 -3.994408 17.55600 
1 1 1    7   14   35 o   54.966   7.3204   67.141   16.235   74.928   23.397   59.910   22.546   58.678   9.6677   51.254   10.995 7.423576 14.64087 
1 1 1    7   14   36 o   84.096   4.9946  151.356   17.279  164.678   24.577  138.335   24.298   87.875   6.7810   80.316   7.3350 7.559875 9.989223 
1 1 1    7   14   37 o   39.731   8.4613   36.450   15.707   22.293   21.976   51.233   22.458   33.041   12.202   46.421   11.726 -13.38059 16.92260 
1 1 1    7   14   38 o   53.688   7.9289   66.840   17.378   47.238   23.895   88.847   25.318   44.227   12.529   63.148   9.7207 -18.92100 15.85780 
1 1 1    7   14   39 o   45.360   8.8722   51.672   17.410   41.827   26.259   59.395   23.257   41.120   13.446   49.600   11.579 -8.480125 17.74439 
1 1 1    7   14   40 o   42.475   9.4020   39.347   20.484   76.987   31.254   11.004   27.121   54.747   13.835   30.203   12.735 24.54408 18.80401 
1 1 1    7   14   41 o   46.704   9.6300   54.791   20.604   33.569   27.496   81.968   31.115   37.201   13.663   56.207   13.575 -19.00682 19.25991 
1 1 1    7   14   42 o   39.699   9.4470   41.257   18.091   47.466   28.133   36.879   23.623   41.684   13.930   37.715   12.764 3.968567 18.89403 
1 1 1    7   14   43 f   30.911   8.2537   18.470   15.764   36.895   22.322   0.1422   22.264   37.403   12.405   24.419   10.890 12.98338 16.50731 
1 1 1    7   14   44 o   28.797   8.4809   13.583   17.372  -0.3014   24.377   27.910   24.762   24.697   11.172   32.898   12.762 -8.200737 16.96178 
1 1 1    7   14   45 o   23.755   7.6813  -9.1358   17.940   11.760   24.581 -32.9526   26.242   27.591   11.892   19.920   9.7260 7.671143 15.36252 
1 1 1    7   14   46 f   31.252   9.3474   15.888   25.455 -49.8312   43.015   51.306   31.578   23.627   11.711   38.877   14.572 -15.24944 18.69475 
1 1 1    7   14   47 o   26.010   8.4995  -1.7066   21.681   22.090   32.311 -21.1973   29.242   30.084   13.284   21.936   10.607 8.148022 16.99906 
1 1 1    7   14   48 o   30.294   10.041   14.993   28.023  -6.4387   33.295   67.053   51.892   24.489   11.705   36.098   16.318 -11.60855 20.08169 
1 1 1    7   15    0 o  184.408   2.4341  702.179   26.161  702.179   26.161  702.179   26.161  184.408   3.4423  184.408   3.4423 0.000000 0.000000 
1 1 1    7   15    1 o  265.115   2.8658  1468.44   30.181  1380.73   49.097  1521.72   38.265  258.648   4.6024  271.582   3.4161 -12.93436 5.731625 
1 1 1    7   15    2 o  434.893   3.3675  3909.77   58.770  3877.71   94.570  3929.94   75.013  433.393   5.2906  436.392   4.1677 -2.999359 6.735003 
1 1 1    7   15    3 o   99.832   2.0840  207.741   8.4616  190.637   12.768  221.136   11.299   96.127   3.2205  103.538   2.6459 -7.411316 4.168035 
1 1 1    7   15    4 o  302.097   3.0337  1879.42   34.141  1893.02   64.013  1874.02   40.361  302.808   5.1255  301.385   3.2469 1.422974 6.067350 
1 1 1    7   15    5 o  325.308   3.3146  2145.78   40.700  2280.16   75.580  2090.89   48.302  332.293   5.5147  318.323   3.6790 13.97086 6.629206 
1 1 1    7   15    6 o  475.585   4.1166  4701.06   74.184  4596.91  134.077  4747.02   89.059  471.615   6.8929  479.555   4.5027 -7.940460 8.233209 
1 1 1    7   15    7 o  390.167   3.5709  3151.28   52.263  3123.64   96.460  3162.76   62.181  388.852   6.0145  391.481   3.8510 -2.628510 7.141737 
1 1 1    7   15    8 o  186.286   2.3747  698.195   17.966  820.200   28.632  618.968   23.073  199.370   3.4820  173.202   3.2298 26.16823 4.749315 
1 1 1    7   15    9 o  201.311   2.4621  836.784   20.162  839.357   26.437  833.207   31.172  201.692   3.1780  200.930   3.7615 0.7619781 4.924263 
1 1 1    7   15   10 o  188.857   2.6287  739.672   18.585  744.655   22.098  727.629   34.356  189.981   2.8202  187.733   4.4370 2.248077 5.257423 
1 1 1    7   15   11 o  182.830   2.5539  690.136   19.212  693.594   26.312  686.186   28.118  183.326   3.4798  182.334   3.7389 0.9920654 5.107710 
1 1 1    7   15   12 o  304.998   3.1293  1920.63   39.361  1911.99   55.231  1929.55   56.110  304.303   4.4006  305.693   4.4503 -1.389832 6.258605 
1 1 1    7   15   13 o  219.335   2.4631  996.591   21.601  1008.17   27.459  977.790   34.989  221.036   3.0121  217.633   3.8980 3.402298 4.926132 
1 1 1    7   15   14 o  283.332   3.2813  1649.96   35.333  1637.06   42.329  1679.59   64.165  281.606   3.6445  285.058   5.4575 -3.452209 6.562533 
1 1 1    7   15   15 o   85.334   3.5297  154.057   12.123  174.986   16.253  127.810   18.201   92.046   4.2813   78.622   5.6129 13.42336 7.059370 
1 1 1    7   15   16 o  323.812   2.9031  2165.12   37.465  2162.98   47.240  2168.76   61.507  323.664   3.5388  323.960   4.6033 -0.2963562 5.806298 
1 1 1    7   15   17 o  112.954   3.0146  262.823   14.011  252.498   19.040  275.018   20.692  110.547   4.1760  115.362   4.3488 -4.815216 6.029208 
1 1 1    7   15   18 o  147.818   2.5634  452.927   15.044  457.557   18.923  444.974   24.800  148.878   3.0817  146.758   4.0972 2.119873 5.126835 
1 1 1    7   15   19 o  151.175   2.7836  470.272   17.271  454.685   23.141  489.869   25.948  148.368   3.7816  153.982   4.0857 -5.613037 5.567164 
1 1 1    7   15   20 o   97.868   3.3247  197.395   12.148  196.476   14.378  199.687   22.711   97.529   3.5744   98.207   5.6071 -0.6778641 6.649498 
1 1 1    7   15   21 o  147.153   3.4518  454.893   20.390  414.839   31.986  482.315   26.465  141.551   5.4787  152.754   4.2006 -11.20265 6.903697 
1 1 1    7   15   22 o  180.938   2.6218  683.241   18.968  705.795   24.257  647.746   30.430  184.866   3.1814  177.010   4.1682 7.856766 5.243531 
1 1 1    7   15   23 o  110.196   3.0543  246.494   13.134  237.371   16.010  265.274   22.970  107.181   3.6216  113.211   4.9193 -6.029938 6.108695 
1 1 1    7   15   24 o   55.448   6.2402   74.806   11.754   87.317   14.091   46.188   21.312   64.928   5.2620   45.968   11.317 18.96025 12.48034 
1 1 1    7   15   25 o  212.398   3.5128  932.235   28.627  929.028   34.607  939.189   50.950  211.977   3.9583  212.820   5.8045 -0.8424377 7.025697 
1 1 1    7   15   26 o   91.364   4.6702  177.104   16.813  160.331   27.525  187.087   21.236   87.727   7.6073   95.001   5.4196 -7.274689 9.340438 
1 1 1    7   15   27 o  130.913   3.7613  345.874   19.820  397.694   32.540  315.310   24.990  138.451   5.6984  123.375   4.9110 15.07610 7.522593 
1 1 1    7   15   28 o  124.729   3.7547  322.083   19.289  310.220   26.449  335.561   28.193  122.290   5.2439  127.168   5.3752 -4.877838 7.509421 
1 1 1    7   15   29 o  146.924   4.5440  468.643   24.933  498.621   30.102  403.139   44.498  155.069   4.7066  138.778   7.7742 16.29071 9.087911 
1 1 1    7   15   30 o   54.046   8.1257   64.360   17.526   59.099   23.842   70.545   25.850   51.608   11.496   56.485   11.487 -4.876556 16.25133 
1 1 1    7   15   31 o   59.401   7.6715   78.013   18.051   69.205   27.383   84.783   24.006   55.566   12.276   63.237   9.2041 -7.670414 15.34302 
1 1 1    7   15   32 o  121.403   4.9700  307.809   22.914  316.975   41.683  303.840   27.431  122.205   8.2699  120.601   5.5147 1.604393 9.939948 
1 1 1    7   15   33 o   35.339   8.7611   13.921   17.023   50.827   28.896  -5.6941   21.066   46.800   13.933   23.877   10.625 22.92355 17.52222 
1 1 1    7   15   34 o   44.447   9.1065   48.524   18.736   61.927   23.250   23.698   31.644   52.053   11.165   36.842   14.390 15.21082 18.21305 
1 1 1    7   15   35 o   37.438   8.4377   30.035   15.949   11.769   22.902   47.237   22.225   29.836   12.048   45.040   11.817 -15.20322 16.87540 
1 1 1    7   15   36 o   28.026   7.8537   1.3120   15.527   29.154   22.798 -22.7761   21.206   36.128   12.530   19.925   9.4720 16.20272 15.70731 
1 1 1    7   15   37 o   57.432   8.0555   77.701   18.618   55.373   26.187  100.524   26.476   47.619   12.978   67.246   9.5461 -19.62641 16.11109 
1 1 1    7   15   38 o   80.793   5.5174  141.608   18.234  118.785   25.066  167.256   26.572   73.649   8.2519   87.938   7.3263 -14.28876 11.03485 
1 1 1    7   15   39 o   28.897   8.3741   3.5442   17.246   29.025   25.879 -16.8090   23.129   35.882   13.243   21.912   10.253 13.97072 16.74824 
1 1 1    7   15   40 o   26.937   8.3194  -3.6014   18.706 -25.7424   26.556   18.206   26.355   22.027   10.507   31.848   12.902 -9.821348 16.63874 
1 1 1    7   15   41 o   46.488   9.1777   55.413   19.076   78.403   28.129   35.836   25.957   55.357   12.603   37.620   13.345 17.73695 18.35538 
1 1 1    7   15   42 o   32.340   8.9391   16.922   17.609   1.2354   22.132   43.984   29.069   24.748   10.957   39.932   14.127 -15.18493 17.87828 
1 1 1    7   15   43 o   29.430   8.2330   18.252   15.080   24.894   20.989   11.165   21.681   31.830   11.890   27.029   11.391 4.800764 16.46600 
1 1 1    7   15   44 o   68.398   6.5971  113.265   18.330  130.509   25.651   95.270   26.204   74.762   8.3187   62.035   10.241 12.72703 13.19427 
1 1 1    7   15   45 o   27.104   8.3531   10.757   17.591   14.664   25.006   6.9294   24.750   28.141   12.059   26.066   11.562 2.074820 16.70619 
1 1 1    7   15   46 f   28.891   9.3524   9.7621   23.431   26.751   41.053   1.5541   28.535   32.228   14.546   25.554   11.759 6.674622 18.70477 
1 1 1    7   15   47 o   23.119   7.8516 -20.4230   21.716   9.7404   32.424 -44.9574   29.243   27.150   12.509   19.087   9.4930 8.063261 15.70321 
1 1 1    7   15   48 o   21.922   7.8867 -52.4195   24.596 -10.4889   51.761 -64.6496   27.954   27.054   13.302   16.791   8.4775 10.26317 15.77349 
1 1 1    7   16    0 o  217.245   3.0941  974.901   39.171  974.901   39.171  974.901   39.171  217.245   4.3757  217.245   4.3757 0.000000 0.000000 
1 1 1    7   16    1 o  130.550   2.4996  334.686   12.283  393.241   23.412  312.448   14.428  138.034   4.1124  123.066   2.8425 14.96796 4.999112 
1 1 1    7   16    2 o  146.746   2.4648  411.001   14.179  344.761   17.103  556.571   25.354  129.266   3.2079  164.227   3.7431 -34.96153 4.929660 
1 1 1    7   16    3 o  218.760   2.6486  996.780   22.707  957.598   38.301  1018.01   28.196  215.390   4.3114  222.130   3.0776 -6.740341 5.297140 
1 1 1    7   16    4 o  177.133   2.4275  647.925   16.154  646.208   29.788  648.641   19.226  176.945   4.0817  177.321   2.6288 -0.3758850 4.854978 
1 1 1    7   16    5 o  169.527   2.4107  593.365   15.418  592.193   28.230  593.864   18.406  169.388   4.0408  169.667   2.6302 -0.2798462 4.821381 
1 1 1    7   16    6 o  308.994   3.0612  1981.33   35.644  1945.28   65.117  1996.76   42.592  306.912   5.1442  311.076   3.3197 -4.163940 6.122334 
1 1 1    7   16    7 o  336.242   3.2247  2347.28   40.906  2302.00   74.560  2366.77   48.927  333.828   5.4153  338.656   3.5029 -4.828186 6.449416 
1 1 1    7   16    8 o  137.432   3.7792  389.841   21.422   0.0000   0.0000  389.841   21.422  ?   ?   137.432   3.7792      ?      ? 
1 1 1    7   16    9 o  173.182   2.3029  619.194   16.342  621.439   21.920  616.384   24.522  173.542   3.0624  172.822   3.4403 0.7204285 4.605842 
1 1 1    7   16   10 o  159.032   2.3758  525.257   15.291  540.212   19.955  503.984   23.800  161.804   2.9901  156.261   3.6928 5.543167 4.751607 
1 1 1    7   16   11 o  390.378   3.3240  3149.11   52.986  3158.67   70.215  3136.45   80.753  391.110   4.3527  389.647   5.0248 1.463104 6.647936 
1 1 1    7   16   12 o  279.129   2.7589  1612.98   31.525  1646.98   42.339  1570.67   47.228  282.461   3.6342  275.797   4.1519 6.663025 5.517787 
1 1 1    7   16   13 o  201.333   2.4193  836.064   19.408  834.184   24.455  839.261   31.897  201.053   2.9491  201.614   3.8359 -0.5615234 4.838523 
1 1 1    7   16   14 o   44.657   7.1499   22.062   8.8037   16.155   9.2252   82.323   29.464   27.554   7.7776   61.759   12.000 -34.20475 14.29971 
1 1 1    7   16   15 o   52.781   4.5300   65.736   8.3972   82.402   10.666   38.565   13.619   63.156   4.0947   42.405   8.0818 20.75149 9.059917 
1 1 1    7   16   16 o  283.619   2.7295  1656.98   30.756  1644.66   38.551  1678.56   51.011  282.234   3.3118  285.005   4.3396 -2.771484 5.458934 
1 1 1    7   16   17 o  295.911   2.9562  1802.40   35.587  1769.20   46.435  1849.65   55.399  292.665   3.8469  299.157   4.4899 -6.492523 5.912476 
1 1 1    7   16   18 o  132.067   2.6236  361.067   13.704  363.155   17.133  357.359   22.834  132.628   3.1320  131.506   4.2099 1.122009 5.247203 
1 1 1    7   16   19 o  304.903   3.0032  1921.13   37.396  1918.04   49.517  1925.23   57.051  304.667   3.9406  305.138   4.5331 -0.4714355 6.006486 
1 1 1    7   16   20 o  127.615   3.3754  338.004   17.604  345.974   23.524  327.860   26.540  129.359   4.4091  125.871   5.1122 3.487625 6.750848 
1 1 1    7   16   21 o  322.816   3.3210  2155.90   44.216  2152.56   62.521  2159.24   62.542  322.566   4.6994  323.067   4.6937 -0.5011597 6.641912 
1 1 1    7   16   22 o  223.222   2.8574  1028.75   26.138  1018.51   34.952  1041.76   39.370  221.992   3.8174  224.452   4.2528 -2.459946 5.714801 
1 1 1    7   16   23 o  125.956   2.9404  333.996   14.601  349.911   18.396  306.906   24.001  130.139   3.4273  121.773   4.7788 8.366158 5.880772 
1 1 1    7   16   24 o   67.182   5.8009   95.615   15.592   68.636   21.873  123.487   22.232   57.290   9.2568   77.074   6.9937 -19.78391 11.60173 
1 1 1    7   16   25 o   48.184   7.5508   68.746   11.872   77.720   12.780   12.245   32.067   61.253   5.0588   35.115   14.229 26.13736 15.10156 
1 1 1    7   16   26 o   42.855   6.4042   50.321   10.607   64.192   12.413   12.792   20.418   55.641   5.4089   30.069   11.610 25.57228 12.80841 
1 1 1    7   16   27 f  118.385   3.7234  289.743   18.137  263.268   24.934  319.492   26.431  112.648   5.3666  124.123   5.1629 -11.47492 7.446847 
1 1 1    7   16   28 o  184.612   3.1645  704.682   24.007  688.781   32.433  723.952   35.704  182.346   4.3125  186.879   4.6323 -4.533173 6.328940 
1 1 1    7   16   29 o   47.295   8.3835   49.848   16.257   48.542   24.459   50.882   21.760   46.678   12.468   47.913   11.210 -1.234829 16.76703 
1 1 1    7   16   30 o   95.654   4.6008  191.320   18.115  176.537   25.484  206.418   25.755   91.874   6.7253   99.434   6.2800 -7.560539 9.201571 
1 1 1    7   16   31 o   45.425   8.3707   49.195   16.712   25.618   26.493   64.780   21.539   36.678   13.420   54.171   10.009 -17.49298 16.74148 
1 1 1    7   16   32 o   75.890   6.4432  123.360   19.608  124.333   31.655  122.755   24.977   75.788   10.127   75.993   7.9689 -0.2052689 12.88633 
1 1 1    7   16   33 o   48.122   8.4868   59.211   18.258   21.734   31.955   77.375   22.247   36.385   14.384   59.859   9.0111 -23.47443 16.97364 
1 1 1    7   16   34 o   41.295   9.4625   30.284   22.399   70.492   31.475 -10.9688   31.881   54.361   13.964   28.230   12.773 26.13106 18.92495 
1 1 1    7   16   35 o   58.239   7.5713   78.005   17.507   76.044   24.269   80.132   25.278   57.505   10.624   58.972   10.790 -1.467598 15.14263 
1 1 1    7   16   36 o   44.049   10.242   43.476   19.385   38.473   22.374   58.538   38.821   40.231   12.323   47.868   16.362 -7.637062 20.48365 
1 1 1    7   16   37 o   61.113   8.2383   86.370   20.097  128.144   30.102   52.776   26.994   75.878   9.6186   46.347   13.378 29.53120 16.47652 
1 1 1    7   16   38 o   24.988   7.8847  -4.1730   16.562 -10.3050   22.549   3.0105   24.406   22.918   10.512   27.057   11.755 -4.139027 15.76942 
1 1 1    7   16   39 o   28.134   9.2126 -10.4003   22.950  -9.2409   42.949 -10.8636   27.151   31.263   14.401   25.005   11.493 6.257463 18.42517 
1 1 1    7   16   40 o   30.251   8.1344   8.9138   17.279 -27.2249   25.689   38.771   23.350   21.295   10.205   39.208   12.670 -17.91338 16.26877 
1 1 1    7   16   41 o   32.558   8.9770   23.308   17.160   27.705   26.819   20.261   22.328   34.248   13.283   30.867   12.079 3.381281 17.95406 
1 1 1    7   16   42 o   71.610   6.4526  114.008   18.581   91.224   23.434  152.586   30.493   62.480   9.0938   80.740   9.1568 -18.26024 12.90524 
1 1 1    7   16   43 o   27.674   8.3198   11.489   16.874   2.8365   23.844   20.169   23.884   25.216   11.256   30.132   12.254 -4.915258 16.63960 
1 1 1    7   16   44 o   23.669   7.6364  -4.6533   16.932   7.2525   23.658 -17.1544   24.242   26.095   11.450   21.244   10.107 4.851091 15.27275 
1 1 1    7   16   45 f   25.052   8.2698  -4.7014   21.280 -14.8343   31.270   4.0384   29.041   23.819   11.373   26.286   12.009 -2.466417 16.53963 
1 1 1    7   16   46 o   24.446   8.2586 -15.3701   23.932   5.7216   33.163 -38.2910   34.571   27.078   12.537   21.815   10.754 5.262444 16.51724 
1 1 1    7   16   47 o   24.765   8.2153  -6.4759   21.010   23.961   32.756 -27.7487   27.384   29.514   13.183   20.016   9.8072 9.497852 16.43053 
1 1 1    7   17    0 o  349.114   3.2663  2516.31   66.486  2516.31   66.486  2516.31   66.486  349.114   4.6193  349.114   4.6193 0.000000 0.000000 
1 1 1    7   17    1 o  162.824   2.2398  548.809   14.902  533.430   22.496  560.834   19.893  160.778   3.3924  164.870   2.9254 -4.092117 4.479567 
1 1 1    7   17    2 o  649.409   4.5629  8715.37  122.163  8627.40  169.962  8809.39  175.711  646.038   6.3786  652.780   6.5263 -6.742065 9.125765 
1 1 1    7   17    3 o  135.872   2.4040  386.830   12.608  364.036   21.802  398.283   15.454  132.801   3.9804  138.942   2.6968 -6.141418 4.807939 
1 1 1    7   17    4 o  521.820   5.0498  5407.82   99.172  6182.19  188.011  5109.31  116.732  546.374   8.3431  497.265   5.6916 49.10938 10.09961 
1 1 1    7   17    5 o  500.472   4.3506  5159.50   80.506  5217.70  152.936  5137.19   94.687  502.162   7.3842  498.783   4.6027 3.378937 8.701189 
1 1 1    7   17    6 o   62.416   3.0073   85.802   6.6619   69.709   12.699   91.913   7.8251   58.089   5.3005   66.744   2.8426 -8.654354 6.014585 
1 1 1    7   17    7 o  121.381   2.4156  311.916   11.079  284.085   19.740  324.715   13.386  117.307   4.0800  125.455   2.5871 -8.148590 4.831126 
1 1 1    7   17    8 o  303.980   3.0658  1901.11   34.603  1923.81   65.304  1892.25   40.802  305.154   5.1887  302.806   3.2670 2.347839 6.131538 
1 1 1    7   17    9 o  216.534   2.6053  965.147   23.204  1002.91   34.347  933.439   31.471  220.414   3.7782  212.653   3.5882 7.760483 5.210549 
1 1 1    7   17   10 o  331.865   2.9877  2274.31   40.376  2273.94   53.044  2274.83   62.255  331.869   3.8753  331.861   4.5484 0.7812500E-02 5.975413 
1 1 1    7   17   11 o   48.034   6.6213   56.252   10.852   63.338   12.539   35.105   21.660   55.351   5.4924   40.718   12.050 14.63353 13.24261 
1 1 1    7   17   12 o  133.265   2.7681  366.696   15.206  350.031   21.352  383.846   21.661  130.190   3.9765  136.339   3.8520 -6.149506 5.536294 
1 1 1    7   17   13 o   52.126   3.6952   55.462   7.8822   50.605   10.382   62.070   12.110   49.471   5.0884   54.781   5.3598 -5.310238 7.390486 
1 1 1    7   17   14 o   82.088   4.5427  139.278   15.380  139.278   15.380   0.0000   0.0000   82.088   4.5427  ?   ?       ?      ? 
1 1 1    7   17   15 o  248.571   3.0463  1276.96   27.535  1277.18   32.102  1276.37   53.560  248.729   3.1292  248.413   5.2276 0.3155365 6.092621 
1 1 1    7   17   16 o   71.111   3.2150  105.075   9.0656  106.585   11.397  102.473   14.958   71.833   3.8469   70.389   5.1522 1.444679 6.429973 
1 1 1    7   17   17 f   59.011   3.7289   72.040   8.5506   72.011   10.466   72.099   14.829   59.026   4.2989   58.996   6.0942 0.3056335E-01 7.457890 
1 1 1    7   17   18 o  210.563   2.5472  913.020   21.297  905.381   26.669  926.466   35.382  209.399   3.0880  211.727   4.0517 -2.328186 5.094304 
1 1 1    7   17   19 o  134.091   2.6302  365.833   13.930  352.655   17.217  390.812   23.703  130.680   3.1944  137.501   4.1796 -6.821381 5.260499 
1 1 1    7   17   20 o  139.995   3.0396  405.551   17.538  393.856   25.024  416.843   24.588  138.001   4.3964  141.989   4.1985 -3.987839 6.079178 
1 1 1    7   17   21 o   59.956   4.8540   74.801   11.972   68.713   16.956   80.854   16.905   57.501   7.1494   62.412   6.5674 -4.910931 9.707994 
1 1 1    7   17   22 o  158.704   2.7823  515.449   17.890  494.220   23.014  547.868   28.439  154.647   3.6081  162.761   4.2364 -8.113556 5.564630 
1 1 1    7   17   23 o  151.325   2.8850  472.763   17.675  469.573   22.871  477.494   27.852  150.731   3.6789  151.919   4.4450 -1.188538 5.769954 
1 1 1    7   17   24 o  167.813   3.2653  582.995   22.582  581.289   32.574  584.573   31.333  167.563   4.7133  168.062   4.5203 -0.4990082 6.530548 
1 1 1    7   17   25 o  118.258   3.1790  293.418   14.786  303.296   18.504  275.969   24.594  121.119   3.7042  115.396   5.1674 5.723679 6.357935 
1 1 1    7   17   26 o   55.778   6.8097   50.681   11.289   44.270   12.104   93.537   31.296   46.139   6.3607   65.418   12.043 -19.27885 13.61939 
1 1 1    7   17   27 o   51.122   6.0909   58.575   10.878   61.831   12.787   50.046   20.697   54.545   5.6839   47.699   10.775 6.846161 12.18184 
1 1 1    7   17   28 o   58.444   5.7059   79.368   11.590   88.966   13.950   57.982   20.824   65.438   5.1688   51.449   10.174 13.98853 11.41171 
1 1 1    7   17   29 f  149.481   3.6582  463.748   22.530  482.434   32.793  447.042   31.007  152.317   5.2199  146.645   5.1265 5.672150 7.316308 
1 1 1    7   17   30 o   77.554   7.7423  161.317   19.589  222.376   24.905   62.244   31.724  103.140   5.8545   51.967   14.335 51.17220 15.48451 
1 1 1    7   17   31 o   88.933   4.7579  167.662   17.329  150.806   25.092  183.032   23.961   84.498   7.1998   93.369   6.2220 -8.871552 9.515807 
1 1 1    7   17   32 o   27.839   8.2549   5.5267   15.970   5.9464   22.908   5.1299   22.277   28.120   11.772   27.558   11.576 0.5621872 16.50990 
1 1 1    7   17   33 o  126.431   4.7705  323.879   23.160  300.468   27.635  379.113   42.448  119.603   5.6022  133.259   7.7231 -13.65623 9.540977 
1 1 1    7   17   34 o   89.292   5.8126  173.902   20.082  168.993   34.649  176.385   24.644   87.557   9.5947   91.026   6.5641 -3.469521 11.62523 
1 1 1    7   17   35 o   94.046   5.8047  191.663   22.316  185.948   29.490  199.322   34.138   92.704   7.7127   95.387   8.6772 -2.683594 11.60949 
1 1 1    7   17   36 o   33.033   8.9171   19.600   17.074   11.068   22.887   30.307   25.639   29.162   11.943   36.904   13.245 -7.742451 17.83421 
1 1 1    7   17   37 o   36.073   8.7872   30.120   15.853   32.898   22.872   27.551   21.993   37.285   12.560   34.862   12.293 2.422836 17.57439 
1 1 1    7   17   38 o   25.715   7.8257   1.2270   15.552 -10.9089   22.395   12.531   21.614   22.675   10.428   28.755   11.671 -6.080141 15.65141 
1 1 1    7   17   39 o   52.580   9.4489   72.504   20.887   57.343   30.452   85.973   28.703   46.334   14.408   58.826   12.229 -12.49214 18.89786 
1 1 1    7   17   40 o   26.500   8.5168  -1.9692   19.154 -18.2064   37.025   3.9642   22.381   27.196   12.804   25.804   11.234 1.392067 17.03356 
1 1 1    7   17   41 o   29.608   8.7701   14.800   17.717   11.872   29.081   16.528   22.342   29.853   12.900   29.363   11.884 0.4898872 17.54024 
1 1 1    7   17   42 o   38.126   9.9617   37.900   19.397   29.152   23.227   58.063   35.261   33.514   12.510   42.738   15.506 -9.223358 19.92337 
1 1 1    7   17   43 o   39.085   8.4428   40.904   16.879   15.972   23.950   65.505   23.791   28.792   12.043   49.377   11.836 -20.58498 16.88568 
1 1 1    7   17   44 o   41.989   9.3257   53.231   18.007   51.736   25.733   54.665   25.206   41.247   13.298   42.731   13.078 -1.484772 18.65131 
1 1 1    7   17   45 o   25.722   8.4084  -6.7353   21.464   22.659   32.102 -30.4983   28.864   30.610   13.386   20.835   10.179 9.774910 16.81681 
1 1 1    7   17   46 o   35.045   9.8349   36.491   24.364  -2.5665   33.847   78.491   35.099   25.432   12.054   44.658   15.544 -19.22577 19.66976 
1 1 1    7   17   47 o   27.726   8.8138   16.430   21.737   1.0031   33.489   27.662   28.574   25.443   12.039   30.010   12.876 -4.567596 17.62763 
1 1 1    7   18    0 o  140.365   2.3916  407.165   19.555  407.165   19.555  407.165   19.555  140.365   3.3823  140.365   3.3823 0.000000 0.000000 
1 1 1    7   18    1 o  438.880   3.3081  3974.88   59.833  4048.13   86.679  3908.21   82.695  442.730   4.7469  435.030   4.6089 7.700073 6.616243 
1 1 1    7   18    2 o  235.808   2.2777  1147.47   22.152  1156.73   31.393  1138.29   31.264  236.756   3.2149  234.860   3.2276 1.895859 4.555478 
1 1 1    7   18    3 o  295.419   2.9267  1796.07   35.554  1873.00   52.750  1732.03   48.128  301.188   4.2464  289.650   4.0287 11.53802 5.853377 
1 1 1    7   18    4 o  122.442   2.5610  321.238   12.412  256.520   19.246  367.323   16.240  111.463   4.1863  133.421   2.9512 -21.95888 5.122041 
1 1 1    7   18    5 o   67.500   2.6864   89.509   6.7420  104.593   13.111   84.087   7.8611   71.166   4.4667   63.835   2.9858 7.331280 5.372758 
1 1 1    7   18    6 o  277.849   2.5263  1602.32   28.457  1543.88   44.103  1644.01   37.248  273.457   3.9103  282.240   3.1997 -8.782349 5.052611 
1 1 1    7   18    7 o  314.152   2.7252  2028.91   34.016  2069.88   56.510  2005.62   42.597  316.581   4.3279  311.724   3.3132 4.857727 5.450496 
1 1 1    7   18    8 o  102.560   2.4134  211.153   9.2871  231.446   17.547  203.256   10.946  105.870   4.0186   99.249   2.6740 6.620369 4.826895 
1 1 1    7   18    9 o  235.675   2.9725  1149.54   28.502  1132.34   43.911  1162.06   37.467  234.118   4.5475  237.232   3.8292 -3.113922 5.944961 
1 1 1    7   18   10 o   90.632   2.7672  169.944   10.324  176.521   14.354  162.894   14.860   92.457   3.7642   88.807   4.0571 3.650154 5.534365 
1 1 1    7   18   11 o  147.077   3.6372  446.083   22.003  495.485   31.977  401.660   30.322  154.800   5.0084  139.355   5.2756 15.44522 7.274326 
1 1 1    7   18   12 o  150.254   2.4286  461.246   14.780  441.508   18.997  491.518   23.527  146.240   3.1496  154.268   3.6977 -8.028320 4.857283 
1 1 1    7   18   13 o  204.487   5.0372  864.710   42.483   0.0000   0.0000  864.710   42.483  ?   ?   204.487   5.0372      ?      ? 
1 1 1    7   18   14 o  341.156   3.3481  2409.90   42.832  2415.32   50.934  2396.81   79.153  341.987   3.6111  340.325   5.6390 1.662262 6.696162 
1 1 1    7   18   15 o  145.570   3.1365  441.659   15.829  444.812   18.064  431.230   32.852  146.790   2.9837  144.350   5.5179 2.439316 6.272945 
1 1 1    7   18   16 o  226.841   2.5386  1060.66   22.818  1054.80   28.514  1071.08   38.051  226.025   3.0587  227.658   4.0525 -1.633698 5.077213 
1 1 1    7   18   17 o   59.281   3.6081   74.245   8.4256   78.380   10.632   67.266   13.814   61.579   4.1863   56.983   5.8777 4.596497 7.216152 
1 1 1    7   18   18 o  218.471   2.6901  988.905   24.142  1020.28   33.015  952.852   35.391  222.228   3.6020  214.714   3.9964 7.513458 5.380145 
1 1 1    7   18   19 o   39.472   5.5477   30.496   8.2075   25.147   9.7899   43.149   15.057   34.157   7.1772   44.786   8.4613 -10.62870 11.09530 
1 1 1    7   18   20 o   92.174   3.7006  176.671   13.977  168.699   20.713  183.337   18.938   90.232   5.5656   94.116   4.8788 -3.884766 7.401210 
1 1 1    7   18   21 o   81.066   3.9705  136.618   13.232  125.767   18.893  147.067   18.539   77.876   5.8820   84.255   5.3350 -6.378433 7.941030 
1 1 1    7   18   22 o   70.323   3.9490  103.597   10.989  106.562   13.836   98.529   18.087   71.755   4.6751   68.891   6.3656 2.863647 7.897943 
1 1 1    7   18   23 o   83.239   3.9413  141.075   12.884  135.501   15.807  152.106   22.237   80.898   4.7376   85.580   6.3000 -4.682632 7.882601 
1 1 1    7   18   24 o   93.146   4.0156  180.248   15.345  157.177   21.469  204.343   21.940   87.013   5.9823   99.278   5.3583 -12.26526 8.031149 
1 1 1    7   18   25 o  215.680   3.1799  963.756   28.269  951.155   40.546  975.675   39.434  214.289   4.5876  217.071   4.4046 -2.781799 6.359739 
1 1 1    7   18   26 o   57.731   7.7824   89.108   12.589   96.550   13.693   48.448   32.007   68.230   4.8658   47.232   14.785 20.99835 15.56476 
1 1 1    7   18   27 o   68.601   4.5586  101.006   11.831  105.821   14.348   90.775   20.914   71.398   4.8724   65.804   7.7059 5.593994 9.117105 
1 1 1    7   18   28 o  108.196   3.7769  246.660   15.183  250.975   18.021  236.105   28.185  110.055   3.9702  106.336   6.4264 3.719177 7.553849 
1 1 1    7   18   29 o   41.091   6.2974   47.588   11.250   65.187   13.231   1.6720   21.371   55.863   5.7425   26.318   11.210 29.54523 12.59484 
1 1 1    7   18   30 o   44.408   9.8227   45.131   19.272   48.378   22.866   37.169   35.811   46.107   11.932   42.709   15.606 3.398010 19.64531 
1 1 1    7   18   31 o   31.880   8.7090   13.695   18.457 -36.7687   36.617   30.883   21.370   26.357   12.505   37.403   12.124 -11.04647 17.41796 
1 1 1    7   18   32 o   81.334   5.9500  143.529   18.660  137.920   32.340  146.329   22.847   79.520   9.8605   83.149   6.6620 -3.629219 11.90009 
1 1 1    7   18   33 o   41.330   7.6436   35.170   16.084   0.7424   22.228   73.012   23.304   25.976   11.252   56.685   10.349 -30.70958 15.28725 
1 1 1    7   18   34 o   26.235   8.0990   0.2609   16.227   2.0713   25.757  -0.9307   20.895   27.845   12.087   24.625   10.784 3.219942 16.19800 
1 1 1    7   18   35 o   51.604   8.9146   65.066   18.312   67.165   22.754   61.207   30.850   53.798   10.632   49.409   14.312 4.389172 17.82920 
1 1 1    7   18   36 o   49.202   8.4560   58.214   16.970   61.953   24.824   54.934   23.253   50.655   12.056   47.749   11.860 2.906158 16.91199 
1 1 1    7   18   37 o   55.371   7.5903   73.995   16.758   46.818   23.881  100.360   23.522   43.437   12.596   67.304   8.4735 -23.86694 15.18052 
1 1 1    7   18   38 o   29.482   8.4776   13.787   16.145   17.707   23.803   10.448   21.971   30.996   12.363   27.969   11.603 3.027235 16.95517 
1 1 1    7   18   39 o   35.126   9.0619   29.241   17.152   24.014   23.827   34.864   24.712   32.957   12.588   37.296   13.039 -4.339138 18.12387 
1 1 1    7   18   40 o   54.593   8.0260   80.360   17.597   48.853   27.450  102.341   22.928   42.122   13.746   67.065   8.2891 -24.94351 16.05204 
1 1 1    7   18   41 o   50.527   7.5912   64.246   15.711   82.024   22.459   47.207   21.987   58.975   9.2332   42.078   12.052 16.89687 15.18246 
1 1 1    7   18   42 o   35.466   9.0475   34.187   16.929   41.017   25.309   28.657   22.774   37.861   13.198   33.071   12.379 4.789242 18.09507 
1 1 1    7   18   43 o   23.643   7.5611  -4.5027   16.378   12.202   23.457 -20.3940   22.879   27.273   11.683   20.012   9.6013 7.261578 15.12220 
1 1 1    7   18   44 o   25.055   7.8997   5.5231   16.584   10.873   24.054   0.6772   22.894   26.475   11.583   23.635   10.745 2.840122 15.79940 
1 1 1    7   18   45 o   35.639   9.8634   43.855   21.468   35.615   32.320   50.361   28.720   33.097   13.925   38.181   13.972 -5.084171 19.72672 
1 1 1    7   18   46 o   24.139   8.0738  -5.5627   22.000 -29.5181   35.352   9.5775   28.105   22.324   10.979   25.954   11.840 -3.630014 16.14758 
1 1 1    7   19    0 o   40.430   4.0445   35.716   8.9874   35.716   8.9874   35.716   8.9874   40.430   5.7197   40.430   5.7197 0.000000 0.000000 
1 1 1    7   19    1 o  126.307   2.3745  329.680   12.321  333.912   16.761  324.702   18.175  127.195   3.1949  125.418   3.5136 1.777138 4.749010 
1 1 1    7   19    2 o   61.108   2.5455   77.290   6.3986   81.173   8.8867   73.110   9.2204   62.709   3.4359   59.508   3.7567 3.201195 5.091048 
1 1 1    7   19    3 o   94.182   2.4567  184.513   9.4680  167.097   13.839  199.839   12.982   89.964   3.7296   98.399   3.1988 -8.434929 4.913455 
1 1 1    7   19    4 o  119.843   2.2262  295.106   10.887  305.267   16.784  287.725   14.304  121.610   3.3462  118.077   2.9372 3.533150 4.452449 
1 1 1    7   19    5 o  114.661   2.0408  270.675   9.4099  274.192   15.136  268.460   12.014  115.258   3.1840  114.064   2.5537 1.193443 4.081568 
1 1 1    7   19    6 o  230.158   2.3153  1087.73   21.245  1115.71   35.050  1071.48   26.710  232.457   3.6558  227.858   2.8421 4.598938 4.630646 
1 1 1    7   19    7 o  175.199   2.1370  628.518   14.964  653.698   24.611  613.748   18.849  177.943   3.3534  172.456   2.6499 5.487289 4.274026 
1 1 1    7   19    8 f   44.929   3.9136   51.514   5.6762   19.651   8.8829   73.503   7.3793   30.185   7.2302   59.673   2.9983 -29.48774 7.827213 
1 1 1    7   19    9 o  163.103   2.1455  553.833   14.157  523.593   21.962  575.331   18.517  159.244   3.3438  166.962   2.6890 -7.718536 4.290900 
1 1 1    7   19   10 o  222.874   2.5606  1023.37   23.236  1010.70   30.425  1041.10   35.993  221.247   3.3341  224.501   3.8871 -3.253983 5.121154 
1 1 1    7   19   11 o  264.101   2.7159  1441.42   29.273  1445.71   38.728  1435.70   44.709  264.591   3.5488  263.611   4.1121 0.9797363 5.431705 
1 1 1    7   19   12 o   88.936   2.9209  162.963   10.694  150.047   14.730  177.362   15.552   85.217   4.1909   92.654   4.0697 -7.437401 5.841725 
1 1 1    7   19   13 o  180.946   2.8326  680.259   20.876  702.762   27.700  650.672   31.762  184.459   3.6410  177.434   4.3402 7.025650 5.665156 
1 1 1    7   19   14 o  173.794   2.4296  623.778   16.758  623.661   21.014  623.983   27.776  173.807   2.9314  173.780   3.8753 0.2667236E-01 4.859137 
1 1 1    7   19   15 o  192.967   2.4588  768.010   18.878  764.920   23.728  773.339   31.158  192.479   2.9890  193.455   3.9051 -0.9758759 4.917664 
1 1 1    7   19   16 o   80.191   4.2741  130.443   10.774  128.937   11.841  137.691   25.971   79.001   3.6339   81.382   7.7374 -2.381119 8.548239 
1 1 1    7   19   17 o  176.904   2.6443  645.269   19.154  635.199   25.499  658.306   29.015  175.344   3.5259  178.464   3.9419 -3.120010 5.288685 
1 1 1    7   19   18 o   92.876   2.8965  177.012   10.745  173.167   13.526  183.588   17.689   91.547   3.5824   94.205   4.5525 -2.658058 5.793023 
1 1 1    7   19   19 o  173.097   2.9386  617.277   19.628  613.113   23.827  626.069   34.621  172.274   3.3535  173.920   4.8265 -1.646500 5.877111 
1 1 1    7   19   20 o  117.398   2.7820  286.934   12.961  292.495   16.334  277.481   21.297  118.987   3.3283  115.810   4.4587 3.177139 5.563950 
1 1 1    7   19   21 o   52.658   5.4923   57.208   11.858   62.851   18.009   52.890   15.755   54.915   7.9511   50.400   7.5789 4.514942 10.98452 
1 1 1    7   19   22 o  144.029   3.4255  436.811   20.007  367.117   29.396  496.960   27.309  133.079   5.3556  154.980   4.2723 -21.90123 6.850917 
1 1 1    7   19   23 o  171.947   4.7132  612.269   33.425  612.269   33.425   0.0000   0.0000  171.947   4.7132  ?   ?       ?      ? 
1 1 1    7   19   24 o  199.006   2.9735  818.704   24.319  807.074   32.923  832.670   36.079  197.482   4.0421  200.531   4.3622 -3.049164 5.947052 
1 1 1    7   19   25 o  161.216   3.3830  540.626   22.411  515.127   32.644  563.358   30.822  157.564   5.0232  164.869   4.5326 -7.305038 6.765911 
1 1 1    7   19   26 o  148.075   3.2925  455.224   20.089  463.018   27.952  446.896   28.892  149.410   4.5359  146.740   4.7737 2.669632 6.585084 
1 1 1    7   19   27 o  141.808   4.5542  415.614   26.323  393.402   34.312  447.391   41.039  137.352   6.0567  146.263   6.8029 -8.910645 9.108455 
1 1 1    7   19   28 o   79.181   4.4691  120.036   13.500  103.910   15.881  162.049   25.634   70.574   5.4560   87.788   7.0797 -17.21411 8.938131 
1 1 1    7   19   29 o   86.009   5.0732  155.168   17.737  161.681   27.756  150.673   23.059   87.376   7.7019   84.643   6.6053 2.732780 10.14639 
1 1 1    7   19   30 o   52.788   6.4566   71.304   11.335   82.418   13.310   41.977   21.622   62.771   5.1412   42.805   11.846 19.96592 12.91315 
1 1 1    7   19   31 o   66.715   6.8590   94.798   18.618  110.312   29.436   84.453   24.037   71.036   10.047   62.395   9.3406 8.641048 13.71807 
1 1 1    7   19   32 o   25.962   6.9788   11.796   9.9082   14.911   11.455   2.5383   19.746   26.691   8.8880   25.233   10.762 1.457434 13.95759 
1 1 1    7   19   33 o   83.306   5.0009  149.262   16.951  119.999   23.548  180.735   24.421   74.527   7.6608   92.084   6.4301 -17.55681 10.00170 
1 1 1    7   19   34 o   30.721   8.3850   9.2835   16.238   34.874   25.278  -8.6952   21.188   38.696   13.203   22.746   10.340 15.95005 16.76997 
1 1 1    7   19   35 o   48.341   8.9081   60.335   18.331   71.629   22.846   39.922   30.715   55.698   10.326   40.985   14.519 14.71246 17.81624 
1 1 1    7   19   36 o   26.863   7.9134   4.5591   15.666 -14.1717   23.712   19.068   20.870   22.740   10.554   30.985   11.794 -8.244766 15.82683 
1 1 1    7   19   37 o   43.443   8.1483   44.620   16.167   72.611   23.920   21.079   21.937   55.058   10.919   31.828   12.097 23.22958 16.29651 
1 1 1    7   19   38 o   39.861   9.5355   41.178   19.011   31.485   29.826   47.812   24.673   36.614   14.060   43.108   12.884 -6.493992 19.07090 
1 1 1    7   19   39 o  101.339   4.6923  223.125   19.501  195.157   26.198  257.874   29.202   94.190   6.7437  108.487   6.5263 -14.29734 9.384624 
1 1 1    7   19   40 o   42.119   8.5912   45.270   16.136   64.111   24.646   31.136   21.347   49.384   12.177   34.853   12.122 14.53172 17.18236 
1 1 1    7   19   41 o   42.130   8.3152   48.583   15.384   37.662   22.301   58.499   21.251   36.916   12.403   47.344   11.079 -10.42834 16.63039 
1 1 1    7   19   42 o   31.326   8.8926   20.680   17.642   38.310   27.734   8.6977   22.865   36.364   13.652   26.288   11.399 10.07663 17.78510 
1 1 1    7   19   43 o   25.312   7.8218  -3.4421   18.413   27.015   23.812 -48.7313   29.037   31.511   12.430   19.113   9.4984 12.39790 15.64354 
1 1 1    7   19   44 o   21.306   7.3221 -25.8025   20.384 -35.2678   31.183 -18.7393   26.937   21.080   10.356   21.532   10.353 -0.4516106 14.64411 
1 1 1    7   19   45 o   21.639   7.4421 -21.9837   21.106 -24.5601   31.215 -19.8138   28.647   21.769   10.624   21.510   10.424 0.2588749 14.88427 
1 1 1    7   20    0 o  148.101   2.4278  453.333   20.947  453.333   20.947  453.333   20.947  148.101   3.4335  148.101   3.4335 0.000000 0.000000 
1 1 1    7   20    1 f  175.753   2.2860  637.978   16.341  639.388   21.413  636.011   25.284  176.002   2.9499  175.504   3.4929 0.4974213 4.571908 
1 1 1    7   20    2 o   89.418   2.2261  165.264   8.1872  168.020   11.223  162.127   11.970   90.220   3.0160   88.616   3.2751 1.604027 4.452270 
1 1 1    7   20    3 o   75.941   2.4953  117.724   7.6914  126.511   12.176  111.890   9.9215   78.265   3.7720   73.617   3.2676 4.647598 4.990528 
1 1 1    7   20    4 f  227.439   2.2553  1067.85   21.150  1064.35   29.540  1071.54   30.296  227.058   3.1543  227.819   3.2242 -0.7606812 4.510556 
1 1 1    7   20    5 o  101.243   2.1841  208.064   9.0230  188.634   11.759  235.888   14.071   95.594   2.9824  106.891   3.1917 -11.29720 4.368271 
1 1 1    7   20    6 o  104.905   2.0524  226.215   8.6655  231.427   13.938  222.931   11.064  105.876   3.1917  103.934   2.5810 1.941383 4.104700 
1 1 1    7   20    7 o  288.287   2.5783  1718.30   29.810  1708.18   48.073  1724.63   37.998  287.548   4.0534  289.027   3.1875 -1.479553 5.156613 
1 1 1    7   20    8 o  174.872   2.2261  630.745   15.900  635.387   24.279  627.260   21.038  175.422   3.3557  174.322   2.9261 1.099915 4.452298 
1 1 1    7   20    9 o  211.628   3.0535  880.873   24.326  822.366   28.578  1034.78   46.351  199.562   3.4721  223.694   5.0238 -24.13226 6.106920 
1 1 1    7   20   10 o  134.920   2.2927  374.426   12.291  370.621   15.397  381.108   20.405  134.000   2.7860  135.840   3.6420 -1.840179 4.585423 
1 1 1    7   20   11 o  279.386   2.7679  1610.34   31.474  1598.16   41.219  1627.37   48.743  278.162   3.5928  280.610   4.2115 -2.447754 5.535822 
1 1 1    7   20   12 f  168.125   2.6534  583.723   18.395  595.677   26.374  572.401   25.669  169.799   3.7659  166.451   3.7390 3.348312 5.306816 
1 1 1    7   20   13 o  164.388   2.9353  554.365   19.644  533.869   25.587  583.791   30.659  160.740   3.8594  168.036   4.4237 -7.295898 5.870620 
1 1 1    7   20   14 o  165.489   2.9732  556.748   19.949  518.669   25.595  615.677   31.840  158.426   3.9171  172.552   4.4739 -14.12604 5.946375 
1 1 1    7   20   15 o  320.244   3.0455  2112.77   39.625  2076.06   51.554  2165.78   61.943  316.927   3.9440  323.561   4.6416 -6.634460 6.090956 
1 1 1    7   20   16 o  166.433   2.6652  570.755   18.141  559.815   24.033  585.244   27.657  164.605   3.5400  168.260   3.9853 -3.654465 5.330467 
1 1 1    7   20   17 o   87.427   4.3269  162.807   12.026  165.358   13.351  151.833   27.688   89.455   3.6186   85.399   7.8609 4.056168 8.653752 
1 1 1    7   20   18 o  255.877   3.2052  1326.33   31.601  1278.05   38.052  1433.62   56.724  248.670   3.7102  263.084   5.2276 -14.41348 6.410416 
1 1 1    7   20   19 f  224.840   2.9441  1045.34   27.300  1033.61   38.313  1057.44   38.909  223.560   4.1551  226.120   4.1720 -2.559921 5.888217 
1 1 1    7   20   20 o  156.636   2.7150  503.693   17.143  490.974   21.898  523.828   27.552  154.139   3.4444  159.133   4.1978 -4.993973 5.430067 
1 1 1    7   20   21 o  109.475   3.3340  247.659   15.037  263.120   21.808  233.645   20.763  112.728   4.6905  106.222   4.7392 6.506042 6.667902 
1 1 1    7   20   22 o   54.046   5.7239   60.622   12.759   60.622   12.759   0.0000   0.0000   54.046   5.7239  ?   ?       ?      ? 
1 1 1    7   20   23 o   61.695   4.9084   86.172   11.296  100.581   14.116   60.517   18.836   69.650   4.9140   53.739   8.4983 15.91056 9.816750 
1 1 1    7   20   24 o   37.136   7.2298   35.720   11.071   42.102   11.856  -7.7220   30.933   44.953   6.3945   29.318   12.969 15.63519 14.45951 
1 1 1    7   20   25 o   65.283   4.4458   85.005   11.507   75.865   14.135  102.965   19.813   60.375   5.6763   70.191   6.8439 -9.816330 8.891517 
1 1 1    7   20   26 o   62.803   6.0584   83.657   15.229   81.184   24.487   85.217   19.447   61.863   9.5969   63.743   7.3970 -1.879219 12.11676 
1 1 1    7   20   27 o   30.085   8.2856   16.310   11.194   20.256   11.532 -48.0399   46.577   30.494   8.7270   29.676   14.087 0.8181648 16.57125 
1 1 1    7   20   28 o   56.628   5.2586   69.984   11.214   73.669   13.587   62.109   19.861   59.352   5.5502   53.904   8.9335 5.447704 10.51726 
1 1 1    7   20   29 f  113.070   3.3361  269.428   14.698  275.054   18.152  258.713   25.050  115.033   3.8258  111.108   5.4664 3.925079 6.672221 
1 1 1    7   20   30 o  116.663   4.3586  291.246   20.446  265.365   31.850  309.385   26.665  111.861   6.9035  121.465   5.3226 -9.603523 8.717158 
1 1 1    7   20   31 o   71.920   5.3421  110.907   15.814  104.213   22.531  117.407   22.201   69.676   7.8404   74.164   7.2581 -4.487946 10.68421 
1 1 1    7   20   32 o   59.662   4.9249   69.169   10.869   61.216   12.537   93.225   21.805   53.793   5.6508   65.531   8.0677 -11.73832 9.849867 
1 1 1    7   20   33 o   49.255   6.3002   57.693   10.830   61.847   12.730   46.805   20.610   54.017   5.7137   44.492   11.230 9.525208 12.60034 
1 1 1    7   20   34 o   30.860   6.4086   24.035   9.9458   32.795   11.344  -5.0834   20.681   38.395   7.4320   23.325   10.443 15.06987 12.81718 
1 1 1    7   20   35 o   48.033   7.0060   64.190   12.014   75.286   13.905   31.508   23.864   59.441   5.6717   36.626   12.813 22.81469 14.01197 
1 1 1    7   20   36 o   53.091   9.5129   71.643   19.705   71.473   23.465   72.050   36.292   54.811   10.764   51.371   15.688 3.439808 19.02571 
1 1 1    7   20   37 o   22.314   7.2258 -14.8382   15.675   4.3278   22.510 -32.8806   21.841   26.262   11.349   18.366   8.9465 7.895990 14.45150 
1 1 1    7   20   38 o   46.873   8.2080   56.490   16.746   32.767   23.573   80.656   23.792   36.012   12.724   57.735   10.373 -21.72224 16.41597 
1 1 1    7   20   39 o   22.116   6.8810 -15.2069   14.537 -52.1350   21.421   16.324   19.794   15.646   7.8342   28.586   11.314 -12.93938 13.76200 
1 1 1    7   20   40 o   50.042   7.7535   64.467   16.117   44.542   22.373   85.965   23.239   40.226   12.323   59.857   9.4130 -19.63102 15.50695 
1 1 1    7   20   41 o   25.197   7.8341   5.2688   15.634   3.5617   24.075   6.5138   20.559   25.447   11.338   24.947   10.813 0.4999218 15.66814 
1 1 1    7   20   42 o   23.159   7.4360  -6.5510   16.362 -26.8018   23.290   13.183   22.991   19.136   9.3027   27.182   11.603 -8.046209 14.87196 
1 1 1    7   20   43 o   25.970   8.3553   4.1286   18.830  -1.0970   23.594   13.297   31.252   23.448   10.754   28.492   12.791 -5.044312 16.71060 
1 1 1    7   20   44 o   31.854   9.4670   32.113   21.181   28.363   31.502   35.206   28.615   30.917   13.394   32.790   13.383 -1.872374 18.93400 
1 1 1    7   20   45 f   26.044   8.3536   3.0593   21.325 -31.3732   31.652   31.682   28.858   20.998   10.339   31.089   13.124 -10.09073 16.70727 
1 1 1    7   21    0 o  142.718   2.3985  421.018   19.941  421.018   19.941  421.018   19.941  142.718   3.3920  142.718   3.3920 0.000000 0.000000 
1 1 1    7   21    1 o   98.910   2.3280  202.860   9.3206  206.692   12.134  197.345   14.556  100.067   2.9401   97.754   3.6104 2.312309 4.656060 
1 1 1    7   21    2 o  136.424   2.3385  384.746   13.123  377.199   19.166  391.408   18.006  135.156   3.4381  137.692   3.1706 -2.535492 4.676923 
1 1 1    7   21    3 o  189.764   2.3254  745.740   18.088  721.489   26.877  765.817   24.455  186.921   3.4862  192.606   3.0784 -5.684845 4.650800 
1 1 1    7   21    4 o  169.520   2.0724  593.296   14.487  600.280   20.348  586.117   20.630  170.534   2.8929  168.506   2.9683 2.027939 4.144867 
1 1 1    7   21    5 o  163.551   2.0702  549.875   13.925  523.850   18.842  581.192   20.669  159.308   2.8677  167.794   2.9866 -8.486252 4.140440 
1 1 1    7   21    6 o  220.203   2.2367  997.812   20.253  961.572   27.406  1041.42   30.062  215.819   3.0788  224.587   3.2454 -8.768387 4.473442 
1 1 1    7   21    7 o  313.921   2.7299  2022.46   33.973  2083.90   56.864  1988.36   42.366  317.531   4.3420  310.311   3.3102 7.219757 5.459841 
1 1 1    7   21    8 o  255.161   2.5448  1327.38   26.122  1421.97   42.482  1269.87   33.125  262.336   3.9263  247.986   3.2386 14.35004 5.089634 
1 1 1    7   21    9 o  166.213   2.4697  568.112   16.833  548.572   22.463  593.135   25.420  162.979   3.3418  169.447   3.6373 -6.467728 4.939409 
1 1 1    7   21   10 o   71.130   2.6415  101.970   7.6205   91.341   9.7553  118.608   12.206   66.497   3.5569   75.762   3.9062 -9.265121 5.282951 
1 1 1    7   21   11 o   78.009   4.8667  162.840   10.561  184.013   11.822   79.178   23.500   94.404   3.0363   61.614   9.2477 32.79037 9.733381 
1 1 1    7   21   12 f  299.450   3.0933  1852.36   38.174  1812.06   52.738  1896.71   55.327  296.042   4.3192  302.858   4.4293 -6.816132 6.186615 
1 1 1    7   21   13 o  159.493   2.6719  523.412   16.850  517.753   20.974  533.713   28.299  158.330   3.2118  160.657   4.2708 -2.327637 5.343718 
1 1 1    7   21   14 f  245.324   2.6730  1245.56   26.726  1255.50   35.266  1232.16   40.962  246.517   3.4685  244.132   4.0681 2.384781 5.346005 
1 1 1    7   21   15 o  137.966   3.5764  390.153   19.471  380.928   24.105  407.475   33.029  135.717   4.3063  140.215   5.7113 -4.497971 7.152844 
1 1 1    7   21   16 o  170.887   2.4605  603.705   16.732  604.602   21.066  602.172   27.540  171.103   2.9850  170.671   3.9123 0.4316559 4.921046 
1 1 1    7   21   17 o   33.267   6.8106   26.543   8.9970   30.465   9.5894  -2.2901   26.001   38.320   6.0674   28.214   12.195 10.10561 13.62123 
1 1 1    7   21   18 f  185.378   2.8152  711.251   19.683  712.234   23.499  708.939   36.034  185.693   3.0682  185.062   4.7210 0.6318359 5.630400 
1 1 1    7   21   19 f   46.716   4.6035   45.655   8.6370   46.754   11.099   43.966   13.752   47.477   5.6681   45.955   7.2556 1.522171 9.207093 
1 1 1    7   21   20 o  140.554   3.5784  414.000   16.918  417.470   19.088  401.292   36.529  142.139   3.2560  138.969   6.3732 3.170273 7.156713 
1 1 1    7   21   21 o   93.462   4.2154  188.401   15.483  154.640   24.666  210.354   19.890   86.166   6.9405  100.758   4.7862 -14.59208 8.430782 
1 1 1    7   21   22 o  172.077   3.4796  611.420   24.639  573.047   33.512  656.571   36.351  166.233   4.8879  177.922   4.9536 -11.68915 6.959128 
1 1 1    7   21   23 o  106.108   3.1531  234.036   13.461  236.356   17.285  230.460   21.460  106.841   3.9225  105.376   4.9378 1.465141 6.306153 
1 1 1    7   21   24 o  171.116   2.9012  602.896   20.097  587.122   25.888  626.821   31.882  168.390   3.7275  173.842   4.4466 -5.451263 5.802307 
1 1 1    7   21   25 o   93.181   3.3498  172.727   12.384  154.541   15.229  208.223   21.276   86.311   4.2780  100.052   5.1558 -13.74115 6.699552 
1 1 1    7   21   26 o   75.340   4.0667  116.430   12.132  111.051   15.019  126.530   20.581   73.008   4.9877   77.671   6.4245 -4.662491 8.133400 
1 1 1    7   21   27 o   86.206   4.1599  163.027   13.345  174.559   16.115  137.861   23.806   91.613   4.2649   80.800   7.1435 10.81298 8.319791 
1 1 1    7   21   28 o   68.932   4.6243  108.837   11.627  122.713   14.143   79.906   20.421   76.717   4.4697   61.148   8.0969 15.56879 9.248694 
1 1 1    7   21   29 o   77.524   4.0055  127.434   12.043  129.773   14.798  122.848   20.722   78.844   4.5506   76.204   6.5930 2.639862 8.010994 
1 1 1    7   21   30 o   78.421   6.2823  139.478   19.248  107.759   30.071  161.493   25.052   69.765   10.451   87.077   6.9754 -17.31185 12.56466 
1 1 1    7   21   31 o   69.066   5.4833  103.315   15.586   99.976   22.533  106.378   21.583   67.870   8.0498   70.262   7.4476 -2.391846 10.96659 
1 1 1    7   21   32 o   68.659   4.5259   97.689   11.832   93.221   14.096  108.342   21.765   66.490   5.1402   70.827   7.4508 -4.337120 9.051796 
1 1 1    7   21   33 o   56.115   5.7470   71.196   11.388   73.592   13.472   65.198   21.314   58.963   5.5398   53.267   10.071 5.696640 11.49390 
1 1 1    7   21   34 o   47.111   6.1484   44.615   10.291   39.058   11.772   62.627   21.194   42.547   6.7086   51.675   10.306 -9.127560 12.29686 
1 1 1    7   21   35 o   43.160   6.7567   46.267   10.707   50.215   12.450   35.046   20.986   48.336   6.2447   37.984   11.984 10.35228 13.51349 
1 1 1    7   21   36 o   23.914   7.4227   5.5768   10.124   8.3949   10.578 -25.1801   34.945   21.989   8.3901   25.839   12.247 -3.849562 14.84545 
1 1 1    7   21   37 o   23.715   6.8011   8.3655   10.350   14.036   11.569 -14.3624   23.161   25.479   8.9207   21.952   10.269 3.526882 13.60227 
1 1 1    7   21   38 o   33.647   7.0832   29.757   10.425   33.598   11.813   16.232   22.168   38.069   7.7863   29.225   11.835 8.843615 14.16639 
1 1 1    7   21   39 o   46.181   7.0338   55.630   11.444   58.714   13.106   45.728   23.485   51.657   6.1512   40.704   12.652 10.95235 14.06769 
1 1 1    7   21   40 o   29.522   8.2791   19.300   15.173   13.498   21.371   25.197   21.546   27.397   11.411   31.647   11.998 -4.249905 16.55811 
1 1 1    7   21   41 o   49.914   9.1424   71.449   18.995   80.185   27.833   63.834   25.987   53.018   12.860   46.810   12.998 6.207397 18.28486 
1 1 1    7   21   42 o   28.524   8.5130   18.053   17.240   21.444   23.828   14.327   24.973   29.465   12.141   27.582   11.937 1.883316 17.02595 
1 1 1    7   21   43 o   26.790   9.0864  -4.8439   20.063   39.084   49.688 -13.4006   21.930   33.457   15.440   20.123   9.5850 13.33387 18.17285 
1 1 1    7   21   44 o   26.092   8.3326  -6.6058   20.923   41.834   31.238 -46.0147   28.176   33.768   13.906   18.416   9.1849 15.35144 16.66522 
1 1 1    7   22    0 f  167.139   2.4307  577.249   23.674  577.249   23.674  577.249   23.674  167.139   3.4375  167.139   3.4375 0.000000 0.000000 
1 1 1    7   22    1 o  222.845   2.4237  1027.39   22.036  1038.02   29.182  1013.28   33.611  224.214   3.1557  221.475   3.6795 2.738373 4.847346 
1 1 1    7   22    2 o   86.972   2.4866  157.186   8.8371  148.261   13.212  164.412   11.888   84.713   3.7813   89.230   3.2302 -4.516853 4.973197 
1 1 1    7   22    3 o  201.254   2.3501  831.916   19.234  862.968   30.047  810.357   25.036  204.397   3.5642  198.111   3.0640 6.286194 4.700205 
1 1 1    7   22    4 o  184.294   2.1128  700.365   16.041  683.987   22.069  718.712   23.358  182.016   2.9397  186.573   3.0354 -4.556274 4.225548 
1 1 1    7   22    5 o  157.587   2.0581  512.727   13.371  533.774   18.994  492.052   18.825  160.796   2.8640  154.379   2.9565 6.417572 4.116230 
1 1 1    7   22    6 f  161.188   2.4035  548.469   15.579  668.716   21.636  418.994   22.451  179.974   2.9148  142.403   3.8226 37.57133 4.807096 
1 1 1    7   22    7 o   81.936   2.3616  133.344   7.8083  102.932   10.049  179.679   12.404   70.594   3.4515   93.279   3.2242 -22.68513 4.723122 
1 1 1    7   22    8 o   73.997   2.1171  113.575   6.3528  110.112   9.8541  116.037   8.3102   73.019   3.2720   74.975   2.6874 -1.956451 4.234160 
1 1 1    7   22    9 o  200.837   2.4234  830.546   19.632  820.763   25.185  845.698   31.342  199.367   3.0629  202.306   3.7563 -2.938461 4.846740 
1 1 1    7   22   10 o  142.133   2.2896  419.464   12.932  425.728   16.309  408.852   21.226  143.600   2.7536  140.665   3.6587 2.935074 4.579100 
1 1 1    7   22   11 o  147.673   2.4311  449.439   14.578  444.482   18.966  456.596   22.788  146.703   3.1345  148.644   3.7170 -1.941147 4.862236 
1 1 1    7   22   12 o  265.168   2.7668  1440.72   29.629  1393.72   37.923  1514.36   47.469  259.721   3.5402  270.614   4.2530 -10.89319 5.533594 
1 1 1    7   22   13 o  158.583   3.2241  493.544   18.564  466.411   21.363  577.223   37.516  150.250   3.4473  166.916   5.4494 -16.66655 6.448223 
1 1 1    7   22   14 o  183.557   2.7120  695.595   20.514  676.595   28.296  716.645   29.783  180.923   3.7920  186.190   3.8784 -5.267761 5.424074 
1 1 1    7   22   15 o  274.009   2.9651  1551.91   33.439  1539.42   45.744  1566.24   49.004  272.850   4.0649  275.169   4.3178 -2.319000 5.930155 
1 1 1    7   22   16 f  205.582   3.1225  852.562   22.241  834.786   25.205  915.105   47.278  201.039   3.0397  210.124   5.4553 -9.085403 6.244979 
1 1 1    7   22   17 o   90.728   2.9116  167.023   10.572  157.637   13.260  183.402   17.516   87.324   3.6817   94.133   4.5117 -6.809128 5.823257 
1 1 1    7   22   18 o  113.432   4.1311  253.851   16.280  243.359   18.390  291.849   34.998  108.462   4.1110  118.401   7.1668 -9.939156 8.262202 
1 1 1    7   22   19 o  167.570   3.0195  581.379   20.848  549.216   29.381  613.997   29.588  162.885   4.3734  172.254   4.1646 -9.369019 6.039080 
1 1 1    7   22   20 o  109.052   2.9017  241.476   12.621  228.763   15.758  264.230   21.081  105.168   3.6328  112.936   4.5258 -7.767250 5.803437 
1 1 1    7   22   21 f  128.251   2.9346  343.163   15.382  364.226   20.819  317.842   22.826  132.660   3.8049  123.842   4.4689 8.818542 5.869243 
1 1 1    7   22   22 o  109.970   3.6958  249.130   16.676  217.693   22.520  287.297   24.813  102.338   5.3353  117.603   5.1157 -15.26483 7.391618 
1 1 1    7   22   23 o  159.113   3.0284  525.091   19.862  529.435   27.677  520.478   28.520  159.809   4.1991  158.418   4.3650 1.390854 6.056839 
1 1 1    7   22   24 o  106.164   3.7093  234.644   16.216  236.037   23.632  233.405   22.293  106.434   5.3834  105.894   5.1042 0.5401535 7.418530 
1 1 1    7   22   25 o   23.900   6.2706   9.5700   8.5439   14.661   10.191  -2.4701   15.672   26.409   8.3533   21.391   9.3542 5.017365 12.54114 
1 1 1    7   22   26 o   74.730   4.0537  110.213   11.711   98.884   13.990  136.743   21.408   68.840   4.9272   80.619   6.4383 -11.77946 8.107343 
1 1 1    7   22   27 o  105.730   3.3358  230.211   14.122  220.510   17.777  246.806   23.252  102.893   4.1890  108.567   5.1927 -5.674179 6.671681 
1 1 1    7   22   28 o  112.225   4.7425  256.310   20.194  241.355   23.924  293.375   37.664  107.261   5.4079  117.190   7.7923 -9.929413 9.485037 
1 1 1    7   22   29 o   46.739   5.9801   48.167   10.102   48.293   11.932   47.849   18.978   47.782   6.0548   45.696   10.314 2.085373 11.96012 
1 1 1    7   22   30 o   98.026   4.5375  199.791   18.093  162.297   23.705  252.119   28.005   87.189   6.5920  108.864   6.2371 -21.67522 9.075018 
1 1 1    7   22   31 o   77.918   4.0647  121.485   12.172  110.012   14.484  149.067   22.458   72.315   4.8562   83.520   6.5196 -11.20494 8.129498 
1 1 1    7   22   32 f   25.195   7.6520   2.1991   14.297   5.6047   20.925  -0.7829   19.580   26.515   11.183   23.876   10.448 2.639162 15.30404 
1 1 1    7   22   33 o   22.274   6.6417   4.6610   9.3260   6.5937   10.564  -2.1668   19.855   21.127   8.2963   23.422   10.374 -2.295324 13.28335 
1 1 1    7   22   34 o   57.506   6.0160   74.734   12.052   75.356   14.068   73.020   23.364   59.405   5.7416   55.607   10.574 3.797680 12.03194 
1 1 1    7   22   35 o   57.841   5.2067   68.761   11.187   63.068   13.015   84.871   21.891   54.213   5.8205   61.468   8.6349 -7.255035 10.41342 
1 1 1    7   22   36 o   37.069   6.4452   39.482   10.799   50.092   12.361   5.2840   22.193   48.018   6.2415   26.120   11.279 21.89788 12.89037 
1 1 1    7   22   37 o   27.435   6.9669   17.461   10.610   23.594   11.645 -12.5014   25.741   31.498   8.6838   23.371   10.897 8.127523 13.93372 
1 1 1    7   22   38 f   18.266   5.9516  -4.3220   9.3059   0.3119   10.368 -23.5286   21.108   17.618   7.6578   18.915   9.1128 -1.297569 11.90314 
1 1 1    7   22   39 o   40.995   7.1486   36.979   10.832   29.993   12.492   58.147   21.745   35.078   8.6812   46.911   11.360 -11.83344 14.29711 
1 1 1    7   22   40 o   27.757   8.0402   14.881   15.110   23.472   20.817   5.3146   21.966   30.589   11.746   24.925   10.982 5.663504 16.08047 
1 1 1    7   22   41 o   26.299   7.2975   15.899   10.867   18.026   12.236   7.9510   23.649   26.954   9.1860   25.643   11.342 1.311230 14.59499 
1 1 1    7   22   42 o   24.431   7.3933   5.8127   10.456   1.3903   11.558   25.757   24.544   18.366   8.0320   30.497   12.415 -12.13056 14.78662 
1 1 1    7   22   43 o   23.260   7.5053   3.8851   12.302   2.0531   13.480   13.020   30.100   19.436   8.5811   27.083   12.316 -7.647404 15.01066 
1 1 1    7   23    0 o   16.180   5.6344   7.9732   6.3536   7.9732   6.3536   7.9732   6.3536   16.180   7.9682   16.180   7.9682 0.000000 0.000000 
1 1 1    7   23    1 o  199.536   2.7598  788.518   20.243  750.361   23.490  898.598   39.898  190.635   2.9876  208.437   4.6410 -17.80252 5.519502 
1 1 1    7   23    2 o  169.535   2.3825  590.692   16.597  626.972   24.796  561.243   22.340  174.221   3.4508  164.848   3.2858 9.372467 4.764903 
1 1 1    7   23    3 o  203.368   2.1738  853.716   18.225  844.537   25.319  863.584   26.253  202.238   3.0355  204.499   3.1126 -2.261154 4.347689 
1 1 1    7   23    4 o  140.716   2.0555  408.380   11.918  399.343   16.421  418.439   17.323  139.076   2.8628  142.357   2.9504 -3.281189 4.111012 
1 1 1    7   23    5 o  325.632   2.7077  2187.67   36.290  2137.62   49.507  2245.79   53.351  321.630   3.7320  329.633   3.9242 -8.002350 5.415463 
1 1 1    7   23    6 o  222.995   3.0474  1048.10   27.315  1136.15   35.820  925.761   42.224  234.481   3.7039  211.508   4.8402 22.97255 6.094774 
1 1 1    7   23    7 o  261.178   3.1122  1322.81   30.848  1201.60   36.313  1637.04   58.469  241.144   3.6511  281.211   5.0411 -40.06755 6.224389 
1 1 1    7   23    8 o  169.157   2.2683  589.505   15.754  606.196   23.562  576.010   21.185  171.307   3.3348  167.008   3.0756 4.298737 4.536533 
1 1 1    7   23    9 o   71.916   4.2470  104.395   8.5735  103.379   9.1918  111.195   23.777   70.749   3.1501   73.084   7.8882 -2.334946 8.493904 
1 1 1    7   23   10 o  192.992   2.1379  766.823   16.884  751.041   22.406  787.555   25.681  190.717   2.8485  195.267   3.1888 -4.549805 4.275775 
1 1 1    7   23   11 o   97.249   2.6536  189.311   10.464  161.932   13.396  232.175   16.761   88.518   3.6692  105.981   3.8345 -17.46344 5.307241 
1 1 1    7   23   12 o   56.627   7.4900   75.935   9.4461   77.489   9.8823   59.492   32.147   61.222   3.9137   52.032   14.460 9.190224 14.98005 
1 1 1    7   23   13 o   77.482   2.8126  126.407   8.7486  135.881   11.411  112.900   13.626   81.095   3.4118   73.869   4.4723 7.226036 5.625115 
1 1 1    7   23   14 o  115.869   3.9142  296.847   16.508  322.541   19.748  237.258   30.075  124.904   3.8335  106.834   6.8255 18.07014 7.828304 
1 1 1    7   23   15 o  133.522   6.1964  370.209   34.124   0.0000   0.0000  370.209   34.124  ?   ?   133.522   6.1964      ?      ? 
1 1 1    7   23   16 o   42.562   4.2074   37.463   7.3574   36.098   9.9076   39.141   10.986   41.710   5.7592   43.415   6.1351 -1.704231 8.414708 
1 1 1    7   23   17 o  155.626   2.7663  504.547   16.483  510.776   19.970  491.232   29.198  157.233   3.0795  154.019   4.5963 3.213501 5.532537 
1 1 1    7   23   18 o  186.441   2.6354  717.981   19.865  713.821   25.636  724.232   31.428  185.821   3.3450  187.060   4.0735 -1.239532 5.270890 
1 1 1    7   23   19 o   31.816   6.3347   26.527   9.5242   33.807   10.043 -38.5643   30.029   40.312   6.0401   23.319   11.137 16.99400 12.66946 
1 1 1    7   23   20 o   70.330   3.4296  100.500   9.7270   93.122   12.332  112.648   15.824   67.020   4.4613   73.641   5.2101 -6.620888 6.859126 
1 1 1    7   23   21 o   70.719   3.7629  102.125   10.731   95.681   13.624  112.656   17.417   67.881   4.8662   73.558   5.7409 -5.677071 7.525823 
1 1 1    7   23   22 o  134.923   3.5587  381.549   19.460  360.252   29.988  397.040   25.577  131.533   5.5277  138.313   4.4835 -6.780823 7.117354 
1 1 1    7   23   23 o  103.818   3.5373  224.029   15.113  230.900   22.252  218.145   20.590  105.268   5.1253  102.369   4.8766 2.898872 7.074580 
1 1 1    7   23   24 o  142.668   3.1925  421.519   18.730  380.258   25.581  469.201   27.499  135.158   4.5888  150.179   4.4396 -15.02161 6.384922 
1 1 1    7   23   25 o   98.142   3.2578  198.663   12.909  190.806   16.494  211.080   20.736   95.760   4.1763  100.524   5.0013 -4.764732 6.515695 
1 1 1    7   23   26 o   38.503   6.1206   27.527   8.8776   19.172   10.382   50.261   17.124   29.465   8.2275   47.542   9.0640 -18.07679 12.24121 
1 1 1    7   23   27 o  109.100   4.1897  256.301   18.366  217.112   27.902  286.264   24.397  101.269   6.6802  116.931   5.0587 -15.66207 8.379446 
1 1 1    7   23   28 o   30.772   5.5630   23.515   9.2144   36.870   10.821 -11.7206   17.576   41.675   6.2953   19.868   9.1736 21.80649 11.12591 
1 1 1    7   23   29 o   62.234   8.1513  114.452   13.998  125.411   15.253   55.942   35.244   77.263   4.7864   47.206   15.584 30.05715 16.30260 
1 1 1    7   23   30 o   42.133   6.4363   38.495   9.9774   36.796   11.644   43.187   19.354   41.426   6.8149   42.839   10.921 -1.412678 12.87267 
1 1 1    7   23   31 o   27.967   6.7819   17.223   9.5856   21.845   10.998   2.6184   19.550   31.067   8.3876   24.867   10.659 6.199760 13.56376 
1 1 1    7   23   32 f   36.283   8.3079   30.435   14.556   40.986   21.139   20.922   20.073   41.012   11.838   31.555   11.659 9.456493 16.61583 
1 1 1    7   23   33 o   41.065   5.8999   50.880   10.951   72.601   13.021  -1.6225   20.244   58.419   5.4041   23.710   10.489 34.70975 11.79972 
1 1 1    7   23   34 o   32.593   7.4352   18.688   10.151   12.068   11.543   41.278   21.323   24.500   8.8745   40.685   11.932 -16.18515 14.87043 
1 1 1    7   23   35 o   46.475   6.4180   46.975   10.905   42.742   12.740   58.576   21.090   44.071   7.0090   48.878   10.753 -4.807049 12.83596 
1 1 1    7   23   36 o   41.744   6.9308   34.169   11.032   21.997   12.823   68.840   21.641   30.360   9.3343   53.128   10.248 -22.76813 13.86167 
1 1 1    7   23   37 o   37.596   8.3612   31.557   10.789   29.670   11.471   46.014   31.751   35.455   8.0308   39.737   14.668 -4.282558 16.72234 
1 1 1    7   23   38 o   47.050   6.8004   60.033   11.324   66.244   13.184   42.561   22.112   54.927   5.8199   39.174   12.293 15.75256 13.60077 
1 1 1    7   23   39 o   24.394   7.0649   8.8491   9.7647   6.4762   11.108   16.915   20.481   20.651   8.3725   28.137   11.382 -7.486145 14.12978 
1 1 1    7   23   40 o   26.655   8.0248   13.124   15.498   15.471   20.694   10.125   23.388   27.125   11.257   26.186   11.440 0.9395065 16.04965 
1 1 1    7   23   41 o   31.904   6.7825   30.799   11.461   39.599   12.913  -1.8637   24.878   40.201   8.0685   23.606   10.905 16.59479 13.56506 
1 1 1    7   23   42 o   30.279   7.9851   25.212   12.282   23.709   14.125   29.874   24.870   29.466   9.8706   31.092   12.555 -1.625694 15.97019 
1 1 1    7   23   43 f   26.213   7.3047   17.857   12.772   25.192   14.084 -16.0916   30.301   30.112   9.8473   22.314   10.792 7.797510 14.60932 
1 1 1    7   24    0 o  221.299   2.2283  1011.31   28.749  1011.31   28.749  1011.31   28.749  221.299   3.1512  221.299   3.1512 0.000000 0.000000 
1 1 1    7   24    1 o  169.125   2.2732  589.709   15.596  584.887   20.258  596.724   24.436  168.301   2.9183  169.949   3.4862 -1.647644 4.546468 
1 1 1    7   24    2 o   86.722   2.5728  157.615   9.0717  135.710   13.346  176.427   12.368   81.024   3.9937   92.420   3.2447 -11.39674 5.145678 
1 1 1    7   24    3 o  175.964   2.2358  632.596   15.972  602.680   20.623  677.443   25.250  170.841   2.9268  181.088   3.3807 -10.24728 4.471560 
1 1 1    7   24    4 o  114.860   2.0818  270.389   9.8245  247.642   13.226  298.394   14.675  109.511   2.9282  120.208   2.9599 -10.69727 4.163529 
1 1 1    7   24    5 o   90.906   2.1335  170.888   7.9760  187.073   11.333  155.002   11.228   95.182   2.8868   86.630   3.1423 8.552277 4.267036 
1 1 1    7   24    6 o  134.650   2.2206  373.671   12.277  382.746   18.342  366.303   16.525  136.120   3.2670  133.181   3.0085 2.938766 4.441194 
1 1 1    7   24    7 f  187.686   2.6545  702.351   19.749  641.780   24.311  819.871   33.863  176.253   3.3443  199.119   4.1234 -22.86644 5.309087 
1 1 1    7   24    8 o  263.427   2.6647  1432.58   28.323  1425.84   36.415  1442.91   45.061  262.705   3.3608  264.148   4.1360 -1.442871 5.329366 
1 1 1    7   24    9 o  177.743   2.4307  653.661   17.375  656.825   22.258  648.724   27.800  178.333   3.0261  177.153   3.8048 1.180252 4.861489 
1 1 1    7   24   10 f   98.393   2.8996  199.699   11.693  195.860   15.615  204.600   17.644   97.333   3.8897   99.453   4.3014 -2.120384 5.799278 
1 1 1    7   24   11 o  208.272   3.0606  878.190   25.308  967.012   42.804  830.451   31.381  216.119   4.8020  200.426   3.7961 15.69281 6.121272 
1 1 1    7   24   12 o  129.335   2.5716  345.045   12.777  343.771   15.461  347.791   22.695  129.015   2.9055  129.656   4.2439 -0.6413269 5.143209 
1 1 1    7   24   13 o  103.603   2.5181  222.316   10.466  223.833   13.360  219.905   16.841  104.090   3.1118  103.116   3.9599 0.9741516 5.036268 
1 1 1    7   24   14 o  229.779   2.5448  1086.60   23.097  1074.75   28.711  1108.33   38.885  228.090   3.0519  231.468   4.0731 -3.377914 5.089653 
1 1 1    7   24   15 o   67.419   3.0650   92.438   8.4401   82.401   11.040  106.556   13.093   63.097   4.2422   71.741   4.4250 -8.643345 6.129974 
1 1 1    7   24   16 o   84.994   5.8946  184.870   15.640  214.959   18.153   98.197   30.810  101.886   4.3200   68.102   10.969 33.78381 11.78918 
1 1 1    7   24   17 o   68.416   3.2627   94.487   8.9918   86.092   11.354  108.612   14.727   64.471   4.2698   72.361   4.9346 -7.889877 6.525482 
1 1 1    7   24   18 o  116.421   4.3776  309.115   15.887  325.792   17.744  241.724   35.669  125.495   3.4281  107.347   8.0562 18.14864 8.755258 
1 1 1    7   24   19 o  263.996   2.9166  1440.95   31.414  1421.86   41.365  1466.97   48.285  262.024   3.8276  265.967   4.4017 -3.943024 5.833127 
1 1 1    7   24   20 o   94.160   4.8552  185.726   14.441  185.873   15.949  185.055   34.019   94.697   4.0836   93.623   8.8100 1.073540 9.710398 
1 1 1    7   24   21 o  148.975   3.1482  452.448   18.975  419.943   24.222  504.083   30.529  142.254   4.1284  155.697   4.7541 -13.44240 6.296484 
1 1 1    7   24   22 o  150.755   2.9498  468.574   18.268  431.018   24.547  515.197   27.350  144.046   4.1317  157.464   4.2113 -13.41722 5.899672 
1 1 1    7   24   23 o   72.386   4.2882  110.462   12.684  105.905   19.051  114.091   16.999   70.943   6.5108   73.829   5.5825 -2.886208 8.576376 
1 1 1    7   24   24 o   47.646   4.8283   45.128   8.9493   33.871   11.114   65.887   15.092   39.427   7.0956   55.865   6.5500 -16.43876 9.656598 
1 1 1    7   24   25 o   50.158   4.5446   51.028   9.0340   45.995   11.105   60.873   15.533   46.768   5.7574   53.548   7.0331 -6.780170 9.089120 
1 1 1    7   24   26 o   22.555   6.2612   7.0918   8.0273   7.1574   9.6447   6.9439   14.482   21.163   8.0267   23.948   9.6117 -2.784697 12.52248 
1 1 1    7   24   27 o   28.677   6.5765   15.425   8.4534   10.825   10.130   25.974   15.340   23.547   8.3386   33.806   10.172 -10.25911 13.15292 
1 1 1    7   24   28 o   48.855   5.4644   53.734   9.8799   56.407   12.089   48.360   17.144   51.615   5.6788   46.095   9.3376 5.520706 10.92889 
1 1 1    7   24   29 o   59.475   8.9768   59.741   11.665   55.776   12.034  121.465   47.480   51.301   5.6876   67.649   17.029 -16.34869 17.95358 
1 1 1    7   24   30 o   22.549   6.5172   5.9324   8.6111   6.1946   9.9192   5.1302   17.349   20.603   8.0540   24.495   10.248 -3.892040 13.03432 
1 1 1    7   24   31 o   59.604   4.7308   70.225   10.872   59.803   12.898   95.798   20.203   52.901   5.9115   66.307   7.3875 -13.40597 9.461588 
1 1 1    7   24   32 o   77.045   4.2012  130.153   12.274  135.513   14.911  118.891   21.615   80.173   4.5094   73.917   7.0899 6.256187 8.402487 
1 1 1    7   24   33 o   49.511   7.6198   59.363   15.114   55.449   21.837   62.963   20.940   47.547   11.302   51.475   10.223 -3.928093 15.23961 
1 1 1    7   24   34 o   43.930   6.5285   44.610   10.737   43.790   12.779   46.576   19.797   44.623   6.9437   43.238   11.058 1.384949 13.05697 
1 1 1    7   24   35 o   19.823   6.1058   0.2894   9.4838   7.1902   10.702 -24.9437   20.465   21.161   8.3375   18.485   8.9226 2.675533 12.21169 
1 1 1    7   24   36 o   40.542   7.8007   42.320   12.205   42.767   13.885   40.801   25.597   42.663   8.1889   38.421   13.279 4.241508 15.60133 
1 1 1    7   24   37 o   17.449   5.7759  -6.6658   9.2928  -1.7964   10.383 -26.2774   20.837   16.712   7.4464   18.186   8.8315 -1.474081 11.55183 
1 1 1    7   24   38 o   27.350   5.8342   17.783   10.222   32.850   11.696 -30.9536   21.035   37.132   7.8807   17.568   8.6052 19.56448 11.66850 
1 1 1    7   24   39 o   48.825   6.5308   58.332   11.369   57.092   13.289   61.717   21.961   50.276   6.4085   47.375   11.381 2.900730 13.06162 
1 1 1    7   24   40 o   26.794   7.1478   18.004   10.686   21.541   11.948   3.8578   23.895   29.038   9.0237   24.550   11.088 4.487860 14.29553 
1 1 1    7   24   41 o   35.660   7.5024   37.790   11.677   40.091   13.429   30.660   23.642   39.785   8.4453   31.535   12.402 8.250122 15.00479 
1 1 1    7   24   42 o   25.943   7.9013   8.3431   12.240   1.6932   13.595   36.808   28.127   19.302   8.5649   32.584   13.280 -13.28219 15.80265 
1 1 1    7   25    0 o   77.702   2.2519  125.239   10.167  125.239   10.167  125.239   10.167   77.702   3.1847   77.702   3.1847 0.000000 0.000000 
1 1 1    7   25    1 o  227.721   2.4642  1073.15   22.881  1082.55   30.237  1060.56   34.998  228.925   3.2024  226.517   3.7461 2.407303 4.928390 
1 1 1    7   25    2 o  104.549   2.1883  223.499   9.3722  207.380   12.405  244.934   14.306  100.206   3.0015  108.892   3.1852 -8.685829 4.376636 
1 1 1    7   25    3 o  220.492   2.2363  1003.30   20.317  984.671   28.009  1023.99   29.516  218.340   3.1102  222.644   3.2143 -4.304291 4.472696 
1 1 1    7   25    4 o   88.825   2.4304  162.150   8.7873  168.294   13.684  157.838   11.463   90.237   3.6767   87.413   3.1795 2.823410 4.860823 
1 1 1    7   25    5 o  149.630   2.5476  470.448   15.079  434.036   24.630  492.279   19.071  144.872   4.1220  154.388   2.9949 -9.516708 5.095132 
1 1 1    7   25    6 o  149.685   2.7600  447.241   16.724  354.873   21.584  586.010   26.455  131.004   3.9946  168.366   3.8097 -37.36171 5.520049 
1 1 1    7   25    7 o  125.582   2.4216  325.419   11.866  324.449   14.574  327.326   20.437  125.345   2.8190  125.818   3.9383 -0.4726791 4.843235 
1 1 1    7   25    8 o   92.929   3.5393  160.182   9.8372  152.607   10.598  207.324   26.438   85.956   2.9894   99.902   6.4165 -13.94623 7.078671 
1 1 1    7   25    9 o  180.299   3.0866  671.150   21.001  668.863   25.054  676.556   38.515  179.908   3.3764  180.689   5.1681 -0.7809296 6.173280 
1 1 1    7   25   10 o   54.837   3.5085   53.540   7.2744   32.723   8.7175  101.274   13.201   39.731   5.3198   69.943   4.5760 -30.21186 7.017093 
1 1 1    7   25   11 o  274.892   2.5959  1552.38   27.136  1536.94   32.509  1587.86   49.281  272.784   2.8895  276.999   4.3136 -4.214630 5.191890 
1 1 1    7   25   12 o   97.652   2.4838  188.222   9.1128  176.656   10.700  218.757   17.386   92.482   2.8053  102.823   4.0996 -10.34101 4.967503 
1 1 1    7   25   13 o  154.546   2.4228  490.915   14.756  484.200   18.279  503.478   25.002  153.093   2.8949  155.998   3.8859 -2.905609 4.845666 
1 1 1    7   25   14 o  125.688   2.4896  324.326   12.448  317.889   15.586  335.662   20.685  124.024   3.0470  127.352   3.9380 -3.328461 4.979154 
1 1 1    7   25   15 o  106.522   2.6103  230.984   11.134  219.758   13.997  250.332   18.375  103.091   3.2919  109.953   4.0518 -6.862061 5.220506 
1 1 1    7   25   16 f  117.257   2.7491  279.038   12.558  268.124   15.275  301.803   22.060  113.862   3.2526  120.653   4.4330 -6.791626 5.498241 
1 1 1    7   25   17 o   57.337   3.6783   68.334   8.6962   68.140   12.434   68.519   12.167   57.252   5.2655   57.422   5.1375 -0.1703606 7.356623 
1 1 1    7   25   18 o   31.163   5.2985   20.796   6.7527   16.496   9.0657   26.155   10.121   27.625   7.6794   34.701   7.3024 -7.076605 10.59708 
1 1 1    7   25   19 o   40.395   4.3957   34.115   7.2663   34.073   9.6905   34.168   10.983   40.402   5.8154   40.388   6.5931 0.1354980E-01 8.791309 
1 1 1    7   25   20 o   97.799   3.0256  198.624   12.060  197.849   15.871  199.684   18.552   97.630   3.9414   97.968   4.5914 -0.3380203 6.051102 
1 1 1    7   25   21 o  151.413   5.0221  449.319   22.394  435.349   24.141  535.457   59.945  144.749   4.0437  158.078   9.1942 -13.32878 10.04419 
1 1 1    7   25   22 o   80.001   4.0034  135.872   13.040  117.358   19.067  152.138   17.872   74.688   6.1897   85.314   5.0792 -10.62606 8.006867 
1 1 1    7   25   23 o   33.628   5.5351   27.070   7.9875   36.591   10.193   11.917   12.858   41.695   5.9269   25.561   9.3498 16.13459 11.07012 
1 1 1    7   25   24 o   56.901   5.5045   73.062   11.942   53.612   18.032   88.258   15.938   49.062   9.2505   64.741   5.9690 -15.67923 11.00906 
1 1 1    7   25   25 o   46.266   4.9562   44.595   9.0887   41.951   11.245   49.574   15.434   44.519   6.1243   48.013   7.7941 -3.494522 9.912319 
1 1 1    7   25   26 o   28.083   6.4439   16.743   8.2336   15.970   10.151   18.232   14.077   26.977   8.3068   29.188   9.8534 -2.211750 12.88770 
1 1 1    7   25   27 o   35.208   6.1209   29.421   8.7345   33.241   10.521   20.949   15.668   39.459   6.4647   30.957   10.396 8.501526 12.24179 
1 1 1    7   25   28 o   29.998   6.5711   20.472   8.8441   22.639   10.769   15.981   15.500   31.657   8.1869   28.339   10.281 3.317858 13.14228 
1 1 1    7   25   29 o   73.435   4.2051  114.235   11.729  113.107   14.063  116.811   21.260   73.308   4.6512   73.562   7.0070 -0.2543106 8.410241 
1 1 1    7   25   30 o   37.230   8.1275   31.024   10.136   31.216   10.662   29.222   32.699   37.379   7.1764   37.081   14.585 0.2979889 16.25509 
1 1 1    7   25   31 f   40.340   6.3878   39.424   9.6400   42.326   11.322   31.777   18.380   44.352   6.1895   36.328   11.176 8.024155 12.77559 
1 1 1    7   25   32 f   21.229   6.3475   3.5764   8.4425   3.3433   9.7034   4.3024   17.127   18.767   7.7418   23.691   10.061 -4.924143 12.69508 
1 1 1    7   25   33 o   31.307   8.2116   19.729   14.945   34.615   21.628   6.1287   20.674   36.929   12.209   25.686   10.985 11.24360 16.42324 
1 1 1    7   25   34 o   38.423   6.4671   41.475   10.497   51.085   12.292   15.583   20.176   48.382   6.1598   28.465   11.373 19.91617 12.93428 
1 1 1    7   25   35 o   34.458   7.3142   26.393   10.064   22.169   11.596   39.285   20.257   30.350   8.7700   38.566   11.708 -8.215942 14.62842 
1 1 1    7   25   36 o   20.940   6.5008   2.9644   9.7048   6.8531   10.672 -15.6181   23.329   20.692   8.2702   21.188   10.032 -0.4954185 13.00157 
1 1 1    7   25   37 o   43.158   6.7776   41.320   10.952   32.670   12.915   63.465   20.663   36.515   8.6992   49.801   10.396 -13.28603 13.55518 
1 1 1    7   25   38 o   23.422   7.4019   5.6009   10.374   5.8886   11.010   3.3265   30.960   20.116   8.2664   26.729   12.281 -6.612656 14.80370 
1 1 1    7   25   39 o   23.991   7.1609   7.5186   10.142   4.3483   11.412   19.432   22.122   19.536   8.2500   28.447   11.707 -8.910934 14.32172 
1 1 1    7   25   40 o   43.585   7.2318   53.625   11.995   55.906   13.977   47.248   23.371   48.867   6.9346   38.302   12.693 10.56461 14.46356 
1 1 1    7   25   41 o   18.109   6.2641 -25.0571   15.564 -22.9514   22.616 -26.9514   21.451   18.639   9.0850   17.579   8.6267 1.060863 12.52825 
1 1 1    7   26    0 o  296.759   2.9495  1820.05   51.031  1820.05   51.031  1820.05   51.031  296.759   4.1712  296.759   4.1712 0.000000 0.000000 
1 1 1    7   26    1 o  237.002   4.1305  1155.56   37.190  1140.21   44.493  1191.16   67.752  234.690   4.5965  239.314   6.8641 -4.624619 8.261017 
1 1 1    7   26    2 o  251.302   2.9225  1299.17   28.234  1286.64   34.134  1326.32   50.237  249.532   3.3167  253.071   4.8130 -3.539474 5.845079 
1 1 1    7   26    3 o   55.940   2.9793   64.388   6.6323   63.417   8.3176   66.084   10.990   55.387   3.6410   56.493   4.7167 -1.106384 5.958571 
1 1 1    7   26    4 o  140.933   2.0763  408.497   12.028  390.330   16.223  430.669   17.922  137.474   2.8612  144.392   3.0095 -6.917496 4.152506 
1 1 1    7   26    5 o  248.934   2.3549  1280.22   24.156  1273.11   33.412  1288.01   34.965  248.220   3.2636  249.648   3.3958 -1.428024 4.709846 
1 1 1    7   26    6 o  185.273   2.4922  690.696   17.775  659.357   21.346  761.569   32.101  178.671   2.8967  191.876   4.0564 -13.20580 4.984471 
1 1 1    7   26    7 o  307.057   3.3633  1962.10   42.264  1867.44   62.939  2039.85   57.037  300.186   5.0835  313.929   4.4051 -13.74280 6.726583 
1 1 1    7   26    8 o  110.498   3.8821  252.130   17.037  249.035   21.326  257.589   28.326  109.651   4.7155  111.345   6.1681 -1.694405 7.764134 
1 1 1    7   26    9 f   56.229   4.3301   62.580   9.7903   85.768   15.863   48.315   12.443   64.251   5.9862   48.207   6.2580 16.04402 8.660105 
1 1 1    7   26   10 o   90.626   4.5974  170.899   14.615  171.047   29.971  170.853   16.741   90.431   8.0356   90.821   4.4690 -0.3903732 9.194753 
1 1 1    7   26   11 o  119.838   3.1915  298.379   15.579  292.207   23.858  302.966   20.569  118.708   4.8729  120.968   4.1227 -2.260262 6.382941 
1 1 1    7   26   12 f   92.134   4.5495  187.404   13.071  193.599   14.510  160.721   30.112   96.734   3.6367   87.535   8.3406 9.198936 9.098950 
1 1 1    7   26   13 o   99.945   4.0205  193.475   13.066  185.234   14.407  231.677   31.018   94.604   3.6923  105.285   7.1431 -10.68026 8.040917 
1 1 1    7   26   14 o   78.812   2.7459  129.217   8.7458  131.642   11.350  125.673   13.722   79.762   3.4501   77.863   4.2728 1.899162 5.491807 
1 1 1    7   26   15 o   60.089   3.0936   76.323   7.5064   90.810   10.384   60.469   10.863   66.218   3.8022   53.961   4.8810 12.25721 6.187145 
1 1 1    7   26   16 o  114.888   2.7228  280.783   12.200  298.361   15.258  249.629   20.313  120.103   3.0803  109.673   4.4906 10.42965 5.445542 
1 1 1    7   26   17 o   51.386   3.5351   54.706   7.4618   48.204   10.212   62.154   10.930   48.111   5.1461   54.661   4.8483 -6.549862 7.070236 
1 1 1    7   26   18 o   70.428   3.3638  103.227   9.7636   97.756   13.669  108.926   13.951   68.512   4.8374   72.344   4.6755 -3.832001 6.727644 
1 1 1    7   26   19 o   39.598   4.2816   32.754   6.9791   30.403   9.5440   35.456   10.232   38.075   6.0776   41.122   6.0326 -3.047119 8.563225 
1 1 1    7   26   20 o   81.533   3.7465  140.425   12.469  121.616   18.029  157.671   17.264   76.147   5.7407   86.919   4.8157 -10.77225 7.493097 
1 1 1    7   26   21 o   52.761   3.7835   57.208   8.0994   52.392   10.394   64.653   12.924   50.039   5.0361   55.483   5.6477 -5.444248 7.566954 
1 1 1    7   26   22 o   39.717   7.6935   34.909   9.2997   35.481   9.7768   29.474   30.137   41.076   5.7709   38.358   14.264 2.718170 15.38703 
1 1 1    7   26   23 o   28.881   5.4180   15.253   7.2319   4.4339   9.2102   32.648   11.679   19.299   7.6929   38.462   7.6314 -19.16275 10.83601 
1 1 1    7   26   24 o   57.091   4.9902   70.844   11.425   64.954   17.934   74.867   14.821   54.779   7.9379   59.403   6.0495 -4.623272 9.980302 
1 1 1    7   26   25 o  111.830   3.1966  262.095   13.993  261.775   17.267  262.706   23.884  112.024   3.7371  111.637   5.1872 0.3875427 6.393145 
1 1 1    7   26   26 o   43.319   5.2318   41.574   8.6038   42.631   10.661   39.600   14.570   44.833   5.7654   41.805   8.7320 3.028561 10.46365 
1 1 1    7   26   27 o  105.431   3.1500  229.575   13.405  216.724   17.072  250.238   21.648  101.791   4.0663  109.072   4.8121 -7.280960 6.300070 
1 1 1    7   26   28 o   65.691   6.8711  109.498   15.940   62.119   25.293  140.717   20.531   50.307   12.294   81.075   6.1398 -30.76873 13.74220 
1 1 1    7   26   29 o   74.887   3.8261  118.908   11.496  117.979   14.639  120.402   18.567   74.762   4.7477   75.012   6.0013 -0.2500687 7.652171 
1 1 1    7   26   30 o   18.122   5.6973  -1.2679   7.8253   0.8755   9.0661  -7.5301   15.496   17.107   7.2939   19.137   8.7541 -2.030252 11.39458 
1 1 1    7   26   31 o   56.573   4.6390   67.852   10.152   64.802   12.274   74.460   18.065   55.069   5.4040   58.077   7.5417 -3.007816 9.277990 
1 1 1    7   26   32 o   37.861   6.4399   36.423   9.4657   40.160   11.030   25.977   18.441   42.947   6.2269   32.774   11.275 10.17245 12.87978 
1 1 1    7   26   33 o   46.896   6.3916   59.004   11.065   71.940   13.574   33.380   19.104   57.621   5.7116   36.172   11.436 21.44912 12.78311 
1 1 1    7   26   34 o   27.978   7.1926   17.062   9.9353   15.609   11.699   20.822   18.818   26.096   8.9799   29.859   11.238 -3.763100 14.38522 
1 1 1    7   26   35 o   21.230   6.3562   4.8044   9.5133   10.011   10.711 -14.6487   20.703   22.410   8.4686   20.051   9.4810 2.358498 12.71246 
1 1 1    7   26   36 o   57.356   5.1838   70.654   11.463   62.915   13.676   88.940   21.021   53.178   6.2353   61.533   8.2829 -8.354156 10.36751 
1 1 1    7   26   37 o   39.286   7.1467   38.943   10.884   36.228   12.917   45.588   20.211   38.353   8.3987   40.220   11.566 -1.867123 14.29335 
1 1 1    7   26   38 o   30.135   7.2671   23.648   10.162   23.609   11.764   23.761   20.170   30.438   8.8442   29.831   11.534 0.6067600 14.53429 
1 1 1    7   26   39 o   23.332   6.9017   10.406   10.459   12.318   11.987   4.3095   21.407   23.279   8.9199   23.385   10.534 -0.1059818 13.80333 
1 1 1    7   26   40 o   30.552   7.6925   21.589   11.046   13.919   12.767   44.427   22.030   24.052   9.2079   37.052   12.325 -12.99985 15.38509 
1 1 1    7   27    0 o  169.939   2.1078  596.659   20.879  596.659   20.879  596.659   20.879  169.939   2.9809  169.939   2.9809 0.000000 0.000000 
1 1 1    7   27    1 o  168.228   3.2191  586.275   22.323  589.766   31.095  582.562   32.065  168.759   4.4675  167.698   4.6359 1.060669 6.438186 
1 1 1    7   27    2 o  165.511   2.2145  566.586   14.984  569.859   19.945  562.345   22.704  166.084   2.9116  164.939   3.3374 1.144745 4.428983 
1 1 1    7   27    3 o  176.850   2.2727  640.233   16.381  685.180   25.529  608.775   21.357  182.053   3.4000  171.647   3.0168 10.40517 4.545413 
1 1 1    7   27    4 o  142.760   2.2159  421.649   13.032  408.788   18.703  433.786   18.169  140.633   3.2245  144.887   3.0404 -4.254471 4.431826 
1 1 1    7   27    5 o  180.168   2.4135  668.705   17.901  722.532   26.215  621.677   24.504  186.938   3.4001  173.398   3.4263 13.54044 4.827030 
1 1 1    7   27    6 o  144.736   2.8033  433.310   16.652  436.238   24.855  430.926   22.429  145.154   4.1517  144.318   3.7681 0.8360291 5.606692 
1 1 1    7   27    7 o  240.922   4.9780  1202.89   48.887  1159.74   63.923  1263.69   75.879  235.934   6.5690  245.909   7.4813 -9.975113 9.956010 
1 1 1    7   27    8 o  109.634   6.5315  250.486   29.534   0.0000   0.0000  250.486   29.534  ?   ?   109.634   6.5315      ?      ? 
1 1 1    7   27    9 o   82.133   3.7394  143.844   12.324  117.458   18.539  164.732   16.496   75.122   5.9836   89.144   4.4866 -14.02180 7.478831 
1 1 1    7   27   10 o  187.245   3.8409  730.737   26.238  724.857   50.624  732.896   30.681  186.376   6.5858  188.115   3.9543 -1.739594 7.681737 
1 1 1    7   27   11 o   45.120   6.0223   45.093   10.569   37.723   16.846   49.877   13.573   41.378   9.9855   48.862   6.7350 -7.483334 12.04453 
1 1 1    7   27   12 o  154.587   2.8717  495.258   18.307  490.739   26.012  499.693   25.771  153.881   4.0985  155.292   4.0235 -1.411362 5.743353 
1 1 1    7   27   13 o   45.532   8.2350   41.381   14.207   34.963   16.575   59.159   27.585   39.797   10.085   51.266   13.021 -11.46885 16.46996 
1 1 1    7   27   14 o  154.598   3.6816  503.533   22.079  515.847   27.167  479.575   37.893  157.675   4.1774  151.520   6.0635 6.155289 7.363214 
1 1 1    7   27   15 o   18.168   6.2458  -7.9951   7.8685  -5.6703   8.1928 -35.6312   28.247   13.835   6.3422   22.501   10.762 -8.666343 12.49169 
1 1 1    7   27   16 o   17.266   4.5785   4.1965   4.1215   6.7604   7.5175   3.0946   4.9281   19.674   7.1563   14.857   5.7129 4.817838 9.156920 
1 1 1    7   27   17 f   58.391   3.2017   70.662   7.6823   62.710   10.510   79.787   11.258   54.865   4.6445   61.917   4.4083 -7.052006 6.403474 
1 1 1    7   27   18 o   48.768   3.6116   49.479   7.2468   45.803   9.8608   53.796   10.686   46.808   5.1078   50.728   5.1074 -3.920250 7.223197 
1 1 1    7   27   19 o   81.634   3.3537  139.504   11.199  136.892   16.863  141.566   14.981   80.877   5.0552   82.391   4.4084 -1.513252 6.707381 
1 1 1    7   27   20 o   57.823   3.6732   71.309   8.5836   78.853   11.479   61.742   12.927   61.463   4.5283   54.182   5.7847 7.281250 7.346331 
1 1 1    7   27   21 o   41.770   4.5157   38.393   7.3480   43.406   9.7566   31.824   11.169   45.495   5.1996   38.045   7.3844 7.449585 9.031391 
1 1 1    7   27   22 o  108.969   2.7860  245.115   12.160  237.014   15.343  258.799   19.941  106.712   3.4861  111.225   4.3468 -4.513153 5.572035 
1 1 1    7   27   23 o   58.254   7.6101   85.317   10.889   87.595   11.557   67.291   32.511   64.681   4.3320   51.827   14.591 12.85373 15.22020 
1 1 1    7   27   24 o   47.179   4.4207   46.754   8.2550   45.095   10.243   49.828   13.943   46.200   5.3757   48.159   7.0196 -1.959042 8.841490 
1 1 1    7   27   25 o  127.974   3.5915  346.337   18.529  339.259   29.303  351.052   23.917  126.577   5.6129  129.371   4.4824 -2.794159 7.183066 
1 1 1    7   27   26 o   24.706   5.9665   10.696   7.2637   5.7600   9.0219   19.791   12.247   19.753   7.6923   29.659   9.1227 -9.906048 11.93295 
1 1 1    7   27   27 o   88.095   3.3580  163.948   11.946  164.621   15.433  162.942   18.870   88.530   4.2265   87.660   5.2192 0.8698959 6.715908 
1 1 1    7   27   28 o   72.081   3.9420  105.956   11.247   94.812   13.793  128.061   19.427   66.903   4.9987   77.258   6.0967 -10.35474 7.883914 
1 1 1    7   27   29 o   21.759   6.0989   2.8866   7.8012  -2.5446   9.2488   16.279   14.523   15.791   7.0325   27.727   9.9665 -11.93593 12.19784 
1 1 1    7   27   30 o   85.647   3.7040  158.766   12.444  164.091   15.556  149.304   20.737   88.159   4.2782   83.134   6.0477 5.024910 7.407966 
1 1 1    7   27   31 o   39.918   7.7017   41.668   10.526   43.244   11.171   29.191   31.432   44.593   6.0739   35.244   14.155 9.349468 15.40340 
1 1 1    7   27   32 o   46.321   5.6545   45.059   9.7208   38.950   11.432   61.008   18.471   42.037   6.5937   50.606   9.1878 -8.568970 11.30895 
1 1 1    7   27   33 o   31.259   6.8423   23.726   9.1605   23.460   10.792   24.413   17.329   31.268   8.2488   31.250   10.919 0.1792717E-01 13.68463 
1 1 1    7   27   34 o   24.281   7.3287   6.1156   13.253  -1.5306   19.139   13.159   18.369   22.138   9.9674   26.424   10.747 -4.286522 14.65747 
1 1 1    7   27   35 o   23.997   7.0038   9.0694   9.4473   8.2794   10.539   12.300   21.312   21.268   8.3053   26.726   11.280 -5.458067 14.00751 
1 1 1    7   27   36 f   19.900   6.0503   2.9110   9.2116   8.9085   10.638 -15.0657   18.417   21.439   8.3517   18.362   8.7563 3.077398 12.10058 
1 1 1    7   27   37 o   21.583   6.5643   5.2539   9.3847   4.2789   10.848   8.1536   18.708   19.175   8.0678   23.990   10.357 -4.815283 13.12851 
1 1 1    7   27   38 o   22.793   6.5313   10.300   9.9910   15.803   11.463  -7.1029   20.383   25.140   8.8734   20.446   9.5860 4.693464 13.06255 
1 1 1    7   27   39 o   25.721   6.7722   17.371   11.899   26.667   12.454 -80.0176   40.310   31.568   9.0791   19.873   10.051 11.69546 13.54445 
1 1 1    7   28    0 f  319.465   3.1134  2111.21   57.991  2111.21   57.991  2111.21   57.991  319.465   4.4031  319.465   4.4031 0.000000 0.000000 
1 1 1    7   28    1 o  255.492   2.5822  1349.43   26.806  1342.59   34.985  1359.17   41.717  254.783   3.3292  256.201   3.9479 -1.417526 5.164302 
1 1 1    7   28    2 o   70.299   2.4108  101.880   6.9672   98.185   9.4136  106.355   10.361   68.901   3.3126   71.698   3.5036 -2.797096 4.821632 
1 1 1    7   28    3 o  125.792   2.0415  326.819   10.545  370.030   15.200  286.721   14.642  133.816   2.7540  117.769   3.0145 16.04678 4.083071 
1 1 1    7   28    4 o  128.527   2.0293  342.070   10.722  350.336   14.688  332.639   15.689  130.205   2.7350  126.848   2.9987 3.357498 4.058640 
1 1 1    7   28    5 o  102.012   2.6830  207.816   10.873  243.557   18.553  189.123   13.418  108.414   4.1493   95.609   3.4027 12.80490 5.366052 
1 1 1    7   28    6 o   69.712   4.1760  108.918   9.3920   88.856   20.423  114.299   10.577   65.102   7.6059   74.321   3.4505 -9.218689 8.351974 
1 1 1    7   28    7 o  116.672   3.6122  282.289   15.859  284.246   29.201  281.470   18.888  116.777   6.0628  116.566   3.9287 0.2118301 7.224418 
1 1 1    7   28    8 o  111.631   3.8416  257.707   16.343  255.265   19.622  263.240   29.531  110.955   4.2878  112.307   6.3754 -1.351921 7.683138 
1 1 1    7   28    9 o   59.472   3.7237   74.583   9.0045   84.259   12.342   63.570   13.167   63.705   4.6972   55.239   5.7791 8.466503 7.447306 
1 1 1    7   28   10 o   82.119   3.5499  138.604   11.945  119.624   16.008  162.448   17.942   75.835   5.1179   88.402   4.9208 -12.56639 7.099822 
1 1 1    7   28   11 o   21.563   5.8173   5.5205   7.6192   12.306   10.734  -1.3709   10.817   25.084   8.6033   18.043   7.8323 7.040546 11.63453 
1 1 1    7   28   12 o   75.767   3.3443  115.586   10.173  103.784   12.749  136.266   16.877   70.666   4.3742   80.867   5.0600 -10.20096 6.688570 
1 1 1    7   28   13 o  112.237   4.0939  258.962   14.378  256.533   15.799  270.676   34.691  111.249   3.4432  113.225   7.4286 -1.976738 8.187815 
1 1 1    7   28   14 o   73.592   7.1726   94.524   15.638   86.055   16.722  153.575   44.155   64.008   6.3340   83.176   12.871 -19.16711 14.34520 
1 1 1    7   28   15 o  133.277   4.3126  369.736   23.706  369.736   23.706   0.0000   0.0000  133.277   4.3126  ?   ?       ?      ? 
1 1 1    7   28   16 o   57.973   7.6987   93.213   11.823  100.028   12.740   50.929   31.734   69.266   4.4596   46.679   14.738 22.58672 15.39746 
1 1 1    7   28   17 o   83.829   5.0656  154.084   13.071  156.728   14.413  141.839   31.017   86.763   4.0277   80.896   9.2963 5.867714 10.13129 
1 1 1    7   28   18 o   12.582   3.9654  -2.6082   3.6584   0.8244   7.1886  -3.8080   4.2499   15.596   6.5651   9.5668   4.4495 6.029528 7.930853 
1 1 1    7   28   19 o   78.739   2.9213  127.603   9.4145  116.493   12.411  142.661   14.449   74.775   4.0242   82.703   4.2358 -7.928017 5.842616 
1 1 1    7   28   20 o   76.006   3.1702  116.578   9.7562   95.946   12.489  148.884   15.627   67.693   4.4732   84.319   4.4936 -16.62594 6.340488 
1 1 1    7   28   21 o   83.979   3.0608  146.086   10.514  136.165   13.842  159.620   16.167   80.692   4.1590   87.266   4.4917 -6.573357 6.121521 
1 1 1    7   28   22 o   46.702   3.9092   44.856   7.4166   36.316   9.6593   57.122   11.577   41.410   5.6556   51.995   5.3982 -10.58546 7.818349 
1 1 1    7   28   23 o  130.049   3.0106  350.602   16.066  312.692   21.529  398.248   24.135  122.189   4.2719  137.909   4.2432 -15.72076 6.021114 
1 1 1    7   28   24 o   57.768   8.8284   82.982   11.643   83.749   12.115   73.690   42.161   63.123   4.6532   52.412   17.033 10.71121 17.65689 
1 1 1    7   28   25 o  106.630   3.0831  239.299   13.281  240.397   17.169  237.665   20.957  107.144   3.8851  106.116   4.7883 1.028511 6.166193 
1 1 1    7   28   26 o   49.192   5.8368   55.442   11.104   48.259   17.542   60.245   14.343   45.518   9.6438   52.867   6.5779 -7.349247 11.67355 
1 1 1    7   28   27 f   49.697   4.8833   56.098   9.3042   62.983   12.091   46.104   14.568   54.357   5.3933   45.037   8.1425 9.319195 9.766674 
1 1 1    7   28   28 o   18.024   5.5373  -0.1895   7.1431  -1.1603   8.6200   1.9383   12.761   15.777   6.9173   20.270   8.6485 -4.493275 11.07454 
1 1 1    7   28   29 o   22.910   6.2777   8.1193   7.9448   5.6905   9.5547   13.561   14.302   19.786   7.8517   26.034   9.7974 -6.248343 12.55540 
1 1 1    7   28   30 o   20.671   5.8014  -2.4830   7.6788 -11.4319   9.1503   18.825   14.120   12.764   6.1103   28.578   9.8636 -15.81399 11.60284 
1 1 1    7   28   31 o   34.383   6.2701   27.056   8.4020   24.668   10.039   32.639   15.350   32.502   7.6213   36.265   9.9586 -3.763336 12.54021 
1 1 1    7   28   32 o   38.612   8.2758   32.406   10.315   29.823   10.926   53.584   31.287   35.562   7.6744   41.662   14.665 -6.099705 16.55163 
1 1 1    7   28   33 o   22.886   5.9204   9.8845   8.6683   18.573   10.158 -13.4013   16.629   27.829   8.2555   17.944   8.4884 9.884758 11.84089 
1 1 1    7   28   34 o   60.473   5.0010   85.455   11.760   91.237   14.801   75.557   19.366   64.423   5.5705   56.523   8.3073 7.899364 10.00204 
1 1 1    7   28   35 o   48.486   7.0186   61.981   13.780   43.535   19.778   79.384   19.211   39.232   11.488   57.739   8.0670 -18.50636 14.03716 
1 1 1    7   28   36 o   18.826   6.0637  -5.5734   8.8289 -10.3686   10.160   9.2145   17.842   13.661   6.5118   23.991   10.231 -10.32997 12.12747 
1 1 1    7   28   37 o   25.753   7.8269   9.6962   10.506   6.5896   11.242   31.134   29.531   20.168   8.3275   31.338   13.255 -11.17036 15.65371 
1 1 1    7   28   38 o   37.935   10.859   63.838   26.965   69.872   35.361   55.454   41.683   40.642   15.380   35.228   15.334 5.413910 21.71788 
1 1 1    7   29    0 o   88.584   3.8586  164.403   19.764  164.403   19.764  164.403   19.764   88.584   5.4568   88.584   5.4568 0.000000 0.000000 
1 1 1    7   29    1 o  108.327   2.2604  241.328   9.9778  251.842   15.491  233.873   13.044  110.308   3.4049  106.345   2.9739 3.962341 4.520790 
1 1 1    7   29    2 o  155.282   2.0693  496.435   13.210  472.999   17.839  524.891   19.657  151.251   2.8596  159.312   2.9916 -8.061356 4.138512 
1 1 1    7   29    3 o   43.798   2.7393   39.535   4.9315   35.405   6.7228   44.347   7.2562   41.331   3.9438   46.265   3.8027 -4.934063 5.478513 
1 1 1    7   29    4 o  137.119   2.5534  393.297   13.775  376.219   23.005  402.842   17.199  134.682   4.1415  139.557   2.9880 -4.875229 5.106875 
1 1 1    7   29    5 o   87.466   3.2637  149.436   9.7895  176.479   21.559  142.412   10.987   91.983   5.6827   82.949   3.2116 9.033661 6.527464 
1 1 1    7   29    6 o  118.945   3.4378  305.529   14.678  271.179   28.176  318.323   17.195  113.910   5.9972  123.980   3.3628 -10.06955 6.875637 
1 1 1    7   29    7 o   38.390   4.8580   31.519   7.4922   27.405   10.494   35.797   10.700   35.438   7.4177   41.342   6.2752 -5.904198 9.715988 
1 1 1    7   29    8 o  194.708   3.1527  782.602   23.565  772.873   28.444  803.894   42.077  193.079   3.5718  196.337   5.1961 -3.257889 6.305366 
1 1 1    7   29    9 o   86.385   4.4613  157.324   14.150  158.311   16.631  154.737   26.928   87.216   4.6234   85.554   7.6313 1.661728 8.922525 
1 1 1    7   29   10 o   64.427   3.3967   86.228   8.9312   84.728   11.761   88.272   13.726   63.812   4.4688   65.043   5.1167 -1.230938 6.793438 
1 1 1    7   29   11 o   39.283   4.9867   31.096   7.6909   13.679   9.8158   58.790   12.377   25.579   8.2094   52.987   5.6636 -27.40814 9.973477 
1 1 1    7   29   12 o   95.464   4.1534  189.454   12.912  188.310   14.369  194.256   29.436   95.231   3.6582   95.697   7.4579 -0.4657745 8.306808 
1 1 1    7   29   13 o   90.851   2.9220  167.128   10.731  149.773   13.631  195.415   17.403   84.866   3.8944   96.837   4.3573 -11.97101 5.843987 
1 1 1    7   29   14 o   55.594   6.8882   73.844   10.091   75.863   10.844   60.801   27.565   60.317   4.3591   50.871   13.069 9.445629 13.77635 
1 1 1    7   29   15 o   71.581   6.7338   94.459   11.112   91.246   11.553  134.136   40.601   66.167   4.2334   76.996   12.785 -10.82931 13.46765 
1 1 1    7   29   16 o   98.465   4.6424  199.424   17.394  190.768   20.715  220.117   32.027   95.388   5.2654  101.543   7.6473 -6.154961 9.284720 
1 1 1    7   29   17 o  118.117   4.2791  296.867   18.927  299.647   22.558  290.258   34.784  119.682   4.5699  116.551   7.2360 3.131325 8.558231 
1 1 1    7   29   18 o   75.044   5.6969  125.552   12.918  127.420   14.188  116.500   31.233   78.007   4.4099   72.080   10.506 5.927010 11.39373 
1 1 1    7   29   19 o   37.396   4.4524   30.952   6.3664   27.665   10.444   32.896   8.0310   35.241   7.4199   39.550   4.9233 -4.308464 8.904700 
1 1 1    7   29   20 o   37.145   4.3259   30.198   6.3344   23.181   8.9727   37.170   8.9436   32.306   6.9410   41.984   5.1649 -9.678303 8.651789 
1 1 1    7   29   21 o   49.183   3.8162   51.258   7.7183   47.495   11.020   54.881   10.813   47.350   5.6429   51.015   5.1392 -3.664497 7.632403 
1 1 1    7   29   22 o   63.943   3.3112   83.196   8.5801   71.447   10.961  101.790   13.789   58.332   4.5558   69.555   4.8065 -11.22282 6.622495 
1 1 1    7   29   23 o   79.864   3.0766  132.869   9.8808  128.910   12.561  139.295   16.003   78.470   3.8812   81.258   4.7749 -2.788170 6.153290 
1 1 1    7   29   24 o   62.123   3.7457   83.952   9.3333   95.530   12.472   69.215   14.071   67.362   4.4890   56.883   5.9975 10.47869 7.491395 
1 1 1    7   29   25 o   40.838   8.8738   38.562   9.7307   39.057   9.9234   26.178   49.618   42.767   5.6258   38.909   16.832 3.858303 17.74751 
1 1 1    7   29   26 o   29.985   5.9768   20.694   7.5109   20.910   9.3270   20.296   12.669   30.272   7.5071   29.698   9.3023 0.5732994 11.95363 
1 1 1    7   29   27 o   64.307   4.9102   92.681   12.658   72.475   18.504  110.453   17.353   57.024   7.8675   71.589   5.8772 -14.56497 9.820304 
1 1 1    7   29   28 f   39.518   5.7001   34.161   8.5009   30.122   10.253   43.042   15.204   36.387   7.0869   42.648   8.9297 -6.260921 11.40020 
1 1 1    7   29   29 o   47.989   4.9290   48.548   9.1133   44.253   10.893   58.567   16.637   45.131   5.8520   50.848   7.9331 -5.716991 9.858019 
1 1 1    7   29   30 o   32.403   5.8292   27.238   8.9706   37.966   11.197   8.0167   14.988   41.383   6.5604   23.424   9.6375 17.95973 11.65843 
1 1 1    7   29   31 f   47.577   5.7162   52.969   10.299   52.904   12.695   53.096   17.616   48.827   6.3039   46.326   9.5374 2.500900 11.43242 
1 1 1    7   29   32 o   25.886   6.6224   12.776   8.5527   8.1638   10.196   23.724   15.709   21.118   8.1905   30.653   10.409 -9.534657 13.24477 
1 1 1    7   29   33 f   22.875   7.4870  -7.4767   9.0390 -11.0577   9.4676   29.404   30.383   12.972   6.2111   32.779   13.625 -19.80674 14.97398 
1 1 1    7   29   34 o   23.148   7.9011  -0.2179   9.9453  -0.4782   10.199   4.8143   44.850   16.838   7.4475   29.458   13.937 -12.62070 15.80211 
1 1 1    7   29   35 o   24.178   7.5772   0.3393   17.171   20.770   21.073 -40.0240   29.619   28.484   11.537   19.873   9.8257 8.611507 15.15438 
1 1 1    7   29   36 o   25.198   8.2310   4.7811   20.002   3.4403   27.385   6.3145   29.286   24.715   11.425   25.680   11.852 -0.9649410 16.46198 
1 1 1    7   29   37 o   27.480   8.9621   14.061   23.254   16.082   28.962   10.396   39.011   27.322   12.285   27.637   13.052 -0.3149490 17.92424 
1 1 1    7   30    0 o   42.467   7.2553   43.745   15.580   43.745   15.580   43.745   15.580   42.467   10.261   42.467   10.261 0.000000 0.000000 
1 1 1    7   30    1 o   74.896   2.2227  116.073   6.8609  110.031   9.5558  122.502   9.8567   72.882   3.1789   76.909   3.1073 -4.026878 4.445322 
1 1 1    7   30    2 o   57.450   2.4020   68.293   5.6845   66.096   7.8069   70.773   8.2933   56.472   3.3518   58.428   3.4414 -1.955910 4.803936 
1 1 1    7   30    3 o   86.302   2.6930  152.179   8.9985  161.596   15.934  147.769   10.904   88.141   4.3831   84.463   3.1300 3.677422 5.385949 
1 1 1    7   30    4 o   45.891   4.1444   49.622   6.4186   34.731   11.867   55.780   7.6312   39.924   7.4817   51.857   3.5680 -11.93279 8.288882 
1 1 1    7   30    5 o  143.964   3.2774  427.086   16.700  440.904   34.059  422.712   19.162  145.114   5.6906  142.814   3.2531 2.299545 6.554819 
1 1 1    7   30    6 o  150.901   2.7981  474.158   17.352  460.235   25.429  486.289   23.737  148.769   4.1443  153.034   3.7607 -4.265106 5.596263 
1 1 1    7   30    7 o   94.396   2.8400  188.388   10.854  221.469   15.019  152.222   15.704  103.306   3.5249   85.487   4.4539 17.81920 5.679999 
1 1 1    7   30    8 o   89.913   3.7943  155.711   11.868  145.171   13.352  195.392   25.906   83.569   3.8737   96.256   6.5254 -12.68668 7.588543 
1 1 1    7   30    9 o   61.470   3.7782   79.802   9.4537   65.188   13.362   94.448   13.377   55.700   5.8165   67.240   4.8235 -11.54017 7.556336 
1 1 1    7   30   10 o   24.350   5.5931   11.479   6.5666   7.0225   8.6886   17.415   10.028   20.514   7.6528   28.185   8.1588 -7.670624 11.18626 
1 1 1    7   30   11 o   89.438   2.9920  158.352   10.458  142.452   12.634  192.960   18.639   82.776   3.7006   96.101   4.7025 -13.32489 5.983928 
1 1 1    7   30   12 o   84.386   2.9159  150.536   9.8230  158.078   12.602  138.859   15.681   87.237   3.5025   81.536   4.6629 5.700935 5.831841 
1 1 1    7   30   13 o   82.454   2.9465  139.205   9.7063  132.212   12.156  151.504   16.122   79.739   3.6963   85.169   4.5896 -5.429787 5.892917 
1 1 1    7   30   14 o   26.789   5.4278   14.991   6.2980   11.204   8.1309   20.671   9.9575   23.120   7.4771   30.459   7.8700 -7.338581 10.85561 
1 1 1    7   30   15 o   56.495   7.9456   65.589   9.6234   64.282   9.9686   83.483   36.886   55.426   4.3607   57.564   15.281 -2.138542 15.89115 
1 1 1    7   30   16 o   42.154   6.8730   52.081   9.5884   57.727   10.298   15.300   26.284   52.429   4.7624   31.879   12.895 20.54939 13.74601 
1 1 1    7   30   17 f   68.069   6.3072  108.900   11.166  111.279   12.028   94.077   30.028   72.976   3.9963   63.162   11.965 9.814060 12.61441 
1 1 1    7   30   18 o   88.851   5.2378  162.980   18.368  146.358   22.458  196.566   31.924   82.728   6.5820   94.975   8.1497 -12.24686 10.47564 
1 1 1    7   30   19 o   68.014   8.3218  103.064   11.492  102.299   11.914  113.302   43.563   69.926   4.1308   66.102   16.123 3.823715 16.64354 
1 1 1    7   30   20 o   25.422   7.5370   5.6290   8.0941   4.7385   8.4651   15.124   27.641   18.790   7.4113   32.054   13.126 -13.26386 15.07405 
1 1 1    7   30   21 f   32.262   4.5506   23.493   5.7236   19.955   9.2955   25.654   7.2638   29.702   7.5667   34.822   5.0576 -5.120146 9.101289 
1 1 1    7   30   22 o   64.951   3.0200   87.660   7.9961   82.588   10.421   94.923   12.469   62.759   4.0258   67.144   4.5027 -4.384480 6.040034 
1 1 1    7   30   23 o   56.112   3.5364   66.748   8.1462   66.951   11.018   66.503   12.098   56.281   4.7465   55.943   5.2435 0.3384323 7.072735 
1 1 1    7   30   24 o   58.741   3.6387   73.317   8.7892   72.309   11.941   74.509   12.984   58.365   4.9606   59.118   5.3249 -0.7534523 7.277489 
1 1 1    7   30   25 o   14.203   4.5876  -4.8919   5.8493  -6.3687   7.5319  -2.6480   9.2845   12.648   5.8963   15.757   7.0297 -3.109311 9.175160 
1 1 1    7   30   26 o   53.328   7.7422   73.692   10.849   75.060   11.537   63.239   31.887   59.395   4.7095   47.261   14.751 12.13337 15.48433 
1 1 1    7   30   27 o   57.509   3.8367   67.052   8.7764   56.089   10.801   88.354   15.056   51.137   5.1212   63.880   5.7146 -12.74294 7.673495 
1 1 1    7   30   28 o   32.283   6.0573   25.876   9.8356   3.6770   15.213   41.820   12.893   21.998   9.4155   42.568   7.6232 -20.57080 12.11468 
1 1 1    7   30   29 o   40.793   5.2327   36.772   8.2430   33.150   10.124   43.894   14.198   38.658   6.3497   42.928   8.3191 -4.270050 10.46550 
1 1 1    7   30   30 o   24.943   6.2823   13.653   7.8361   12.812   9.6396   15.290   13.455   23.817   8.1533   26.069   9.5600 -2.251656 12.56460 
1 1 1    7   30   31 o   21.531   5.8197   7.8292   7.9485   14.956   10.217  -3.0985   12.651   25.215   8.3939   17.847   8.0633 7.368069 11.63932 
1 1 1    7   30   32 o   24.460   7.3056   10.638   10.090   12.129   10.731  -0.7305   29.631   23.305   8.5389   25.615   11.856 -2.310013 14.61126 
1 1 1    7   30   33 o   21.953   7.6991 -41.2691   24.496 -56.1298   44.553 -34.8305   29.326   23.395   11.649   20.512   10.070 2.882353 15.39830 
1 1 1    7   30   34 o   30.261   9.2062   25.498   20.803   27.752   28.363   22.873   30.606   30.809   13.008   29.714   13.031 1.095320 18.41239 
1 1 1    7   30   35 o   32.376   9.5267   35.673   21.036   29.866   28.828   42.287   30.765   30.745   13.055   34.006   13.878 -3.261265 19.05342 
1 1 1    7   31    0 o   49.549   3.3361   52.304   9.4408   52.304   9.4408   52.304   9.4408   49.549   4.7179   49.549   4.7179 0.000000 0.000000 
1 1 1    7   31    1 o   95.264   2.0600  188.226   8.0867  195.215   11.362  181.051   11.512   97.070   2.8379   93.459   2.9866 3.610779 4.119907 
1 1 1    7   31    2 o   38.714   3.7080   29.122   5.4522   37.372   10.371   25.971   6.4094   42.138   5.9671   35.290   4.4036 6.847801 7.416058 
1 1 1    7   31    3 o   50.355   3.3673   51.265   6.4570   57.471   11.928   48.693   7.6796   52.326   5.5268   48.383   3.8484 3.942593 6.734637 
1 1 1    7   31    4 o   78.275   3.4861  135.840   9.1960  114.638   19.025  142.304   10.505   73.712   6.2577   82.839   3.0746 -9.126640 6.972244 
1 1 1    7   31    5 o   78.234   2.9530  131.260   8.9015  116.473   15.162  139.038   10.996   74.616   4.9267   81.853   3.2572 -7.236526 5.906034 
1 1 1    7   31    6 o   56.584   3.5497   67.391   8.2349   73.772   11.459   60.577   11.842   59.425   4.6753   53.743   5.3424 5.681801 7.099308 
1 1 1    7   31    7 o   29.315   5.5400   18.915   6.8727   15.832   9.5674   22.203   9.8789   26.971   8.0146   31.660   7.6506 -4.689066 11.07997 
1 1 1    7   31    8 o   84.508   4.1849  161.625   11.524  170.036   13.038  131.589   24.637   90.476   3.4940   78.540   7.6057 11.93530 8.369837 
1 1 1    7   31    9 o   73.647   4.7630  113.425   14.468   0.0000   0.0000  113.425   14.468  ?   ?    73.647   4.7630      ?      ? 
1 1 1    7   31   10 o   44.500   6.1759   43.439   10.001   44.223   18.992   43.138   11.764   43.866   10.613   45.134   6.3197 -1.268402 12.35187 
1 1 1    7   31   11 o   24.096   6.7830   8.1385   9.0740   6.3427   18.557   8.7028   10.403   25.771   10.675   22.420   8.3718 3.350342 13.56599 
1 1 1    7   31   12 o   24.477   6.7715   4.4111   8.2921   20.863   18.897   0.4880   9.2280   31.717   11.372   17.238   7.3545 14.47900 13.54301 
1 1 1    7   31   13 o   52.817   6.2980   67.968   11.163   50.639   21.669   74.228   13.024   46.319   11.416   59.316   5.3235 -12.99653 12.59609 
1 1 1    7   31   14 o   97.849   4.6337  218.209   16.986  166.055   28.781  246.084   21.041   87.452   7.9795  108.244   4.7131 -20.79208 9.267407 
1 1 1    7   31   15 f   67.665   6.5117   97.404   17.819   78.101   22.855  127.325   28.455   59.377   9.3326   75.952   9.0836 -16.57461 13.02336 
1 1 1    7   31   16 o   61.363   6.5972   92.171   9.4367   94.388   10.005   74.307   28.399   67.281   3.6056   55.446   12.692 11.83469 13.19444 
1 1 1    7   31   17 o   34.328   7.6827   19.452   7.4698   17.977   7.7574   38.248   27.693   28.435   6.7208   40.222   13.818 -11.78663 15.36536 
1 1 1    7   31   18 o   34.295   7.7240   24.012   8.8298   23.582   9.3017   27.938   28.081   32.459   7.1419   36.132   13.698 -3.672600 15.44796 
1 1 1    7   31   19 o   47.328   8.4760   61.559   9.9298   63.150   10.208   33.549   42.833   54.763   4.5195   39.892   16.338 14.87072 16.95201 
1 1 1    7   31   20 o   74.178   5.7236  123.306   14.775  125.471   17.009  116.652   29.819   76.857   5.3658   71.499   10.112 5.358658 11.44724 
1 1 1    7   31   21 o   25.914   7.3570   10.920   8.4455   11.696   8.8563   3.1367   28.055   23.420   7.8160   28.408   12.466 -4.987564 14.71404 
1 1 1    7   31   22 o   75.512   5.5921  129.410   11.950  130.828   12.944  121.230   31.091   78.908   3.9773   72.115   10.453 6.793266 11.18425 
1 1 1    7   31   23 o   66.997   3.2152   94.534   8.8619   86.214   12.110  104.127   13.003   63.817   4.6007   70.176   4.4926 -6.358974 6.430407 
1 1 1    7   31   24 o   31.395   4.7186   22.778   6.1644   12.101   8.7876   33.122   8.6495   23.497   7.7830   39.293   5.3372 -15.79556 9.437173 
1 1 1    7   31   25 o   26.926   5.1553   16.890   6.1380   22.583   8.4240   10.446   8.9618   31.529   6.6854   22.323   7.8494 9.205160 10.31061 
1 1 1    7   31   26 o   58.939   3.6409   73.369   8.7562   66.044   11.410   83.863   13.657   55.498   4.9848   62.379   5.3082 -6.880905 7.281797 
1 1 1    7   31   27 o   56.649   3.7604   64.724   8.4167   45.036   10.549   99.207   13.961   45.449   5.6277   67.849   4.9890 -22.40061 7.520727 
1 1 1    7   31   28 o   15.935   4.9752  -1.4257   6.5211   1.8583   8.5885  -5.8963   10.021   16.853   7.1393   15.017   6.9311 1.836661 9.950434 
1 1 1    7   31   29 o   22.020   7.1759  -6.9593   15.361   3.8558   18.196 -33.7754   28.653   23.134   10.099   20.905   10.198 2.228647 14.35182 
1 1 1    7   31   30 o   29.517   8.8016   15.618   20.868   34.561   25.026 -27.6024   37.802   34.509   12.966   24.526   11.907 9.983047 17.60321 
1 1 1    7   31   31 o   41.281   10.388   58.053   22.064   64.102   33.886   53.600   29.070   42.349   15.224   40.212   14.137 2.136448 20.77555 
1 1 1    7   31   32 o   25.280   8.2208  -1.5859   20.073 -18.7765   27.593   17.737   29.254   21.721   10.453   28.840   12.691 -7.119196 16.44169 
1 1 1    7   31   33 f   29.273   9.8203   11.527   31.941  -7.1575   43.927   32.492   46.530   26.729   12.943   31.816   14.773 -5.087618 19.64061 
1 1 1    7   31   34 f   25.960   8.4110   9.0479   20.138   5.3272   26.692   13.964   30.681   24.750   11.383   27.169   12.386 -2.419767 16.82207 
1 1 1    7   32    0 o   29.685   4.9127   21.112   7.3930   21.112   7.3930   21.112   7.3930   29.685   6.9476   29.685   6.9476 0.000000 0.000000 
1 1 1    7   32    1 o   22.181   4.4307   10.540   4.0915   10.280   5.0573   11.031   6.9614   21.698   5.6098   22.664   6.8596 -0.9657173 8.861371 
1 1 1    7   32    2 o  100.650   2.6021  212.184   10.054  207.038   17.718  214.628   12.210   99.573   4.3144  101.727   2.9101 -2.154015 5.204129 
1 1 1    7   32    3 o   57.391   3.7787   73.221   7.5993   61.518   14.839   77.381   8.8475   53.787   6.6892   60.994   3.5169 -7.207596 7.557353 
1 1 1    7   32    4 o   72.851   6.8587  113.155   20.609   0.0000   0.0000  113.155   20.609  ?   ?    72.851   6.8587      ?      ? 
1 1 1    7   32    5 o   68.268   3.4726   98.198   9.7264   87.101   13.791  109.180   13.720   64.344   5.1967   72.191   4.6077 -7.847824 6.945293 
1 1 1    7   32    6 o  157.058   3.3277  520.536   21.024  532.313   27.096  502.720   33.328  159.616   4.1159  154.501   5.2301 5.115799 6.655402 
1 1 1    7   32    7 o   77.318   3.9195  123.851   11.631  133.123   20.963  119.727   13.980   79.047   6.4298   75.589   4.4842 3.457832 7.838980 
1 1 1    7   32    8 o   80.319   5.0611  138.881   16.697  142.930   22.829  134.224   24.482   81.749   6.7709   78.889   7.5243 2.859764 10.12225 
1 1 1    7   32    9 o   41.899   6.3803   37.409   11.026   0.0000   0.0000   37.409   11.026  ?   ?    41.899   6.3803      ?      ? 
1 1 1    7   32   10 o   34.740   6.6951   21.701   8.9432   43.430   18.407   14.987   10.232   43.189   10.447   26.292   8.3757 16.89715 13.39030 
1 1 1    7   32   11 o   67.164   4.6819   94.247   11.619  101.644   22.331   91.501   13.607   68.414   7.9139   65.915   5.0050 2.498840 9.363732 
1 1 1    7   32   12 o   57.838   5.2878   74.153   11.020   68.110   21.065   76.430   12.931   55.493   9.2036   60.183   5.2094 -4.690643 10.57564 
1 1 1    7   32   13 o   54.346   6.0992   64.816   11.352   67.097   22.996   64.081   13.053   53.717   10.754   54.974   5.7568 -1.256546 12.19834 
1 1 1    7   32   14 o   65.875   5.5811   98.800   13.242   84.099   24.726  104.711   15.679   61.376   9.7679   70.374   5.4020 -8.998112 11.16211 
1 1 1    7   32   15 o   92.250   4.8259  199.627   15.664  148.290   29.052  220.669   18.600   81.990   8.5911  102.511   4.3991 -20.52155 9.651873 
1 1 1    7   32   16 o   45.539   7.8872   54.526   16.761   76.798   21.208   17.469   27.357   58.766   8.7500   32.311   13.125 26.45477 15.77435 
1 1 1    7   32   17 o   36.585   9.0380   31.615   16.754   34.618   21.304   26.747   27.123   37.898   12.087   35.271   13.441 2.627110 18.07599 
1 1 1    7   32   18 o   18.668   6.4575 -36.2037   15.932 -37.8706   20.486 -33.6527   25.342   16.980   8.3524   20.357   9.8507 -3.376492 12.91508 
1 1 1    7   32   19 o   83.692   5.0019  158.570   11.190  160.691   11.998  144.399   31.012   87.716   3.3165   79.667   9.4381 8.048592 10.00383 
1 1 1    7   32   20 o   36.663   7.3462   30.083   8.0933   30.158   8.4551   29.262   27.967   37.576   5.4557   35.750   13.642 1.825607 14.69249 
1 1 1    7   32   21 o   70.871   5.4436   95.315   10.325   90.599   10.918  135.205   31.755   65.602   4.0352   76.140   10.112 -10.53862 10.88722 
1 1 1    7   32   22 o   26.492   8.3880   0.0000   12.536  -3.1408   13.393   22.214   35.618   18.756   8.3997   34.229   14.522 -15.47342 16.77594 
1 1 1    7   32   23 o   35.293   7.7319   28.986   9.6809   28.803   10.304   30.363   28.269   35.437   7.2930   35.148   13.636 0.2890549 15.46384 
1 1 1    7   32   24 o   62.095   6.9665  103.376   11.299  108.398   12.277   75.567   28.889   71.520   4.1621   52.670   13.297 18.85000 13.93297 
1 1 1    7   32   25 o   49.761   7.6539   63.824   12.653   64.770   14.106   59.931   28.620   54.162   6.3146   45.361   13.945 8.800720 15.30775 
1 1 1    7   32   26 o   51.059   9.2086   49.243   10.491   45.612   10.788  112.377   44.986   45.616   5.7342   56.502   17.502 -10.88529 18.41723 
1 1 1    7   32   27 o   51.877   9.0666   77.121   19.504   87.010   25.832   64.008   29.746   57.825   11.236   45.929   14.233 11.89566 18.13317 
1 1 1    7   32   28 o   24.246   7.8761  -7.4332   19.005   11.341   25.482 -30.9664   28.529   27.471   11.972   21.022   10.237 6.449306 15.75217 
1 1 1    7   32   29 o   28.512   8.6614   9.6008   19.243 -11.6635   25.574   37.354   29.216   22.300   10.542   34.724   13.746 -12.42368 17.32285 
1 1 1    7   32   30 o   28.795   9.2350   11.140   22.685   2.0182   28.298   27.544   37.949   25.523   11.732   32.066   14.265 -6.542603 18.47003 
1 1 1    7   32   31 o   20.520   7.0653 -25.8806   19.104 -35.0924   26.244 -15.4974   27.863   18.976   9.3572   22.064   10.589 -3.088375 14.13061 
1 1 1    7   32   32 o   26.566   8.8620   4.6910   25.218 -13.8364   45.103   13.118   30.417   26.013   12.712   27.119   12.351 -1.105860 17.72409 
1 1 1    7   32   33 o   28.363   9.4073   13.379   24.196   5.9391   27.850   36.280   48.864   25.093   11.573   31.633   14.835 -6.540075 18.81467 
1 1 1    7   33    0 o   74.787   2.0720  116.280   9.0069  116.280   9.0069  116.280   9.0069   74.787   2.9302   74.787   2.9302 0.000000 0.000000 
1 1 1    7   33    1 o   45.955   3.4993   46.140   5.8462   40.683   10.957   48.312   6.9124   43.750   6.0720   48.160   3.4800 -4.409729 6.998518 
1 1 1    7   33    2 f   89.904   2.9627  167.907   10.986   0.0000   0.0000  167.907   10.986  ?   ?    89.904   2.9627      ?      ? 
1 1 1    7   33    3 o   54.439   3.5610   60.433   6.9972   66.598   14.050   58.399   8.0690   55.965   6.0870   52.913   3.6974 3.052490 7.121928 
1 1 1    7   33    4 o   54.652   3.5260   62.293   7.9067   68.997   11.945   57.066   10.548   57.227   5.0610   52.077   4.9108 5.149952 7.051935 
1 1 1    7   33    5 o   98.343   3.5021  201.525   14.205  201.525   14.205   0.0000   0.0000   98.343   3.5021  ?   ?       ?      ? 
1 1 1    7   33    6 o   76.624   3.7580  119.760   11.171  136.573   19.974  112.106   13.476   80.138   6.0429   73.109   4.4691 7.029381 7.516011 
1 1 1    7   33    7 o   33.802   6.1621   26.212   8.1503   24.211   15.191   27.022   9.6580   32.675   10.178   34.929   6.9486 -2.253330 12.32412 
1 1 1    7   33    8 o   92.831   4.6202  184.274   17.674  186.610   24.586  181.776   25.424   93.519   6.3742   92.143   6.6899 1.375687 9.240408 
1 1 1    7   33    9 o   97.224   6.6918  202.369   26.834   0.0000   0.0000  202.369   26.834  ?   ?    97.224   6.6918      ?      ? 
1 1 1    7   33   10 o   73.461   5.8105  119.635   17.250  130.715   23.024  105.455   26.046   77.889   7.1670   69.034   9.1478 8.854698 11.62099 
1 1 1    7   33   11 o   91.895   4.1746  181.807   14.333  174.717   26.287  184.807   17.099   89.971   7.0839   93.818   4.4189 -3.846886 8.349159 
1 1 1    7   33   12 o   70.810   4.8042  111.295   12.409  100.896   23.201  115.462   14.686   67.647   8.3157   73.974   4.8134 -6.326996 9.608318 
1 1 1    7   33   13 f   40.863   6.6385   45.197   10.369   21.480   21.145   52.706   11.898   32.031   11.941   49.694   5.8049 -17.66304 13.27698 
1 1 1    7   33   14 o   47.547   6.6323   53.685   11.232   47.071   21.604   56.134   13.149   43.940   11.709   51.153   6.2323 -7.213474 13.26455 
1 1 1    7   33   15 o   33.925   5.7633   32.497   10.308 -17.1781   21.505   47.313   11.745   20.869   9.8043   46.980   6.0613 -26.11063 11.52667 
1 1 1    7   33   16 o   70.114   5.1654  101.508   13.075  120.849   26.564   95.325   15.020   73.370   8.7782   66.858   5.4469 6.512505 10.33080 
1 1 1    7   33   17 o   54.189   10.566   81.395   23.435   73.323   44.813   84.434   27.495   49.729   17.546   58.649   11.776 -8.919895 21.13100 
1 1 1    7   33   18 o   39.508   10.214   37.340   19.308   35.498   21.840   43.929   41.311   37.764   12.258   41.253   16.340 -3.489311 20.42729 
1 1 1    7   33   19 o   56.693   8.0532   84.695   17.876  103.809   23.065   55.944   28.288   67.893   8.2368   45.493   13.841 22.40060 16.10641 
1 1 1    7   33   20 o   55.721   8.1818   80.675   18.176   94.155   23.797   61.797   28.161   63.863   9.0347   47.580   13.643 16.28278 16.36351 
1 1 1    7   33   21 o   53.328   8.3874   73.202   17.829   74.586   23.534   71.338   27.315   54.883   10.781   51.773   12.852 3.110237 16.77490 
1 1 1    7   33   22 o   36.315   7.2027   36.539   8.3934   38.314   8.6580   8.8401   34.209   42.271   4.9661   30.359   13.522 11.91167 14.40548 
1 1 1    7   33   23 o   75.266   5.3059  127.266   11.572  126.844   12.562  129.629   29.740   77.360   3.9372   73.172   9.8544 4.188499 10.61185 
1 1 1    7   33   24 o   31.762   9.0271   24.428   18.176   27.825   24.321   20.130   27.356   32.811   12.671   30.713   12.861 2.097425 18.05413 
1 1 1    7   33   25 o   35.298   10.134   34.946   23.398   21.157   41.441   41.398   28.349   33.043   14.788   37.554   13.860 -4.510700 20.26809 
1 1 1    7   33   26 o   28.375   8.8149   11.597   20.321   22.430   23.089 -25.6203   42.798   30.390   12.158   26.360   12.767 4.030886 17.62978 
1 1 1    7   33   27 f   28.256   8.6235   15.149   18.612   21.715   24.533   6.2457   28.566   29.814   12.306   26.698   12.084 3.116554 17.24692 
1 1 1    7   33   28 o   29.775   8.8575   21.561   18.349   19.650   24.350   24.073   27.911   28.939   12.127   30.611   12.913 -1.672382 17.71491 
1 1 1    7   33   29 o   31.772   9.2602   29.335   21.567   43.771   26.551   1.3305   36.979   36.467   13.421   27.077   12.763 9.390369 18.52032 
1 1 1    7   33   30 o   27.132   8.7617   8.6376   21.555   29.144   33.631  -5.6583   28.080   30.870   13.595   23.395   11.056 7.474554 17.52339 
1 1 1    7   33   31 o   33.078   9.4614   37.985   19.958   32.771   27.026   44.240   29.599   31.518   12.951   34.639   13.796 -3.121134 18.92285 
1 1 1    7   34    0 o   99.687   1.8990  206.029   11.024  206.029   11.024  206.029   11.024   99.687   2.6856   99.687   2.6856 0.000000 0.000000 
1 1 1    7   34    1 o   34.638   5.2096   43.689   6.6041 -30.0103   24.259   49.588   6.8634   20.489   9.8450   48.787   3.4109 -28.29856 10.41916 
1 1 1    7   34    2 o   26.466   4.8047   12.957   4.5609   21.553   9.9220   10.653   5.1356   30.925   7.7846   22.007   5.6340 8.917580 9.609435 
1 1 1    7   34    3 o   69.262   2.9350  104.055   7.6243   91.405   13.580  109.878   9.2134   65.838   5.0010   72.685   3.0733 -6.847130 5.869902 
1 1 1    7   34    4 o   65.001   3.2643   88.340   8.7095   93.821   13.104   84.003   11.657   66.757   4.7593   63.244   4.4688 3.512787 6.528525 
1 1 1    7   34    5 o   59.122   4.1637   75.168   9.7397   71.796   16.008   77.151   12.273   57.773   6.7181   60.470   4.9207 -2.697056 8.327471 
1 1 1    7   34    6 o  115.983   3.4753  286.983   15.380  275.877   27.243  292.178   18.633  113.785   5.8050  118.181   3.8226 -4.395546 6.950593 
1 1 1    7   34    7 o   39.940   5.7801   37.333   8.6705   31.332   15.426   40.104   10.483   36.532   9.9629   43.348   5.8635 -6.816135 11.56026 
1 1 1    7   34    8 o   38.034   7.6550   35.902   12.859   42.255   16.085   24.651   21.406   42.659   9.3962   33.409   12.087 9.249989 15.30993 
1 1 1    7   34    9 f   47.277   5.5963   47.587   10.912   0.0000   0.0000   47.587   10.912  ?   ?    47.277   5.5963      ?      ? 
1 1 1    7   34   10 o   59.565   4.9680   80.238   10.762   69.168   19.889   84.822   12.798   55.783   8.6445   63.347   4.8984 -7.563419 9.935918 
1 1 1    7   34   11 o   38.885   6.4797   38.396   9.7638   24.211   18.938   43.532   11.395   32.725   11.416   45.045   6.1335 -12.31985 12.95938 
1 1 1    7   34   12 o   77.867   4.4766  125.563   12.985  143.077   24.919  119.035   15.214   80.778   7.4793   74.955   4.9212 5.823303 8.953135 
1 1 1    7   34   13 o   59.928   6.4691   96.220   12.593   53.707   23.010  114.398   15.046   46.435   11.946   73.421   4.9687 -26.98654 12.93813 
1 1 1    7   34   14 o   21.793   6.6597  -0.1783   8.5223   11.851   20.281  -2.7580   9.3917   27.751   11.290   15.836   7.0671 11.91494 13.31938 
1 1 1    7   34   15 o   32.072   7.2550   23.412   9.8675   24.314   20.250   23.131   11.300   32.602   11.763   31.542   8.4958 1.060476 14.50994 
1 1 1    7   34   16 o   43.867   7.0052   50.859   11.285   34.165   22.937   56.190   12.962   36.827   12.577   50.906   6.1734 -14.07928 14.01039 
1 1 1    7   34   17 o   49.231   7.9963   81.447   13.518   16.312   41.669   89.108   14.291   34.062   15.060   64.399   5.3804 -30.33701 15.99261 
1 1 1    7   34   18 o   41.900   10.030   45.752   18.561   42.672   21.129   56.159   38.842   40.567   11.872   43.233   16.170 -2.665882 20.06042 
1 1 1    7   34   19 o   29.054   8.4457   13.829   17.057   24.652   22.288  -1.4719   26.500   32.278   12.212   25.831   11.670 6.446560 16.89146 
1 1 1    7   34   20 o   25.110   7.9365   0.9124   16.687  -0.2162   22.209   2.3755   25.287   24.179   10.823   26.042   11.611 -1.863003 15.87299 
1 1 1    7   34   21 o   27.716   8.3979   11.558   16.892   11.102   21.802   12.241   26.719   26.857   11.376   28.575   12.357 -1.718254 16.79589 
1 1 1    7   34   22 f   25.566   8.0959   3.0977   17.257   4.4042   21.920   0.9674   27.989   24.895   10.969   26.238   11.910 -1.343060 16.19189 
1 1 1    7   34   23 o   31.572   8.9269   23.828   17.408   20.065   22.847   29.036   26.880   29.847   12.040   33.297   13.183 -3.449930 17.85386 
1 1 1    7   34   24 o   24.217   7.8302  -7.4015   17.691 -23.5942   23.335   14.488   27.131   19.717   9.5197   28.716   12.435 -8.999836 15.66039 
1 1 1    7   34   25 o   28.915   9.1420   13.957   20.574   13.662   23.964   14.785   40.127   27.349   11.765   30.482   13.996 -3.133379 18.28398 
1 1 1    7   34   26 o   26.718   8.3436   10.597   17.998   12.000   24.100   8.8283   27.061   26.746   11.650   26.690   11.947 0.5593681E-01 16.68720 
1 1 1    7   34   27 o   30.258   8.9760   23.206   18.769   15.121   24.691   34.272   28.886   27.397   11.863   33.119   13.474 -5.721876 17.95209 
1 1 1    7   34   28 o   34.236   9.0462   31.226   19.034   4.7677   24.950   68.063   29.440   24.520   11.175   43.951   14.229 -19.43118 18.09236 
1 1 1    7   34   29 o   29.363   9.2236   23.456   21.231   22.402   25.143   26.075   39.633   28.579   12.165   30.147   13.867 -1.567902 18.44721 
1 1 1    7   35    0 o   52.002   3.6747   58.173   10.891   58.173   10.891   58.173   10.891   52.002   5.1968   52.002   5.1968 0.000000 0.000000 
1 1 1    7   35    1 o   36.084   6.6214   33.414   7.3008   17.986   23.897   35.002   7.6674   31.411   12.432   40.756   4.5613 -9.344866 13.24276 
1 1 1    7   35    2 o   44.216   3.6061   41.492   6.3394   41.135   10.417   41.702   7.9893   43.904   5.7525   44.527   4.3503 -0.6232529 7.212200 
1 1 1    7   35    3 o  111.385   3.5930  259.358   16.506   0.0000   0.0000  259.358   16.506  ?   ?   111.385   3.5930      ?      ? 
1 1 1    7   35    4 o   34.944   5.5683   28.153   7.7081   25.664   12.295   29.764   9.8941   33.308   8.8128   36.579   6.8086 -3.271076 11.13653 
1 1 1    7   35    5 o   70.955   3.7012  104.967   10.303  113.390   17.797  100.721   12.635   72.763   5.9302   69.147   4.4304 3.616447 7.402402 
1 1 1    7   35    6 f   39.353   5.2690   31.077   8.0226   47.144   14.307   23.707   9.6895   46.375   7.4798   32.332   7.4229 14.04291 10.53792 
1 1 1    7   35    7 o   66.139   4.1287   93.798   10.547   93.599   18.416   93.895   12.865   65.639   6.8025   66.639   4.6808 -0.9995499 8.257339 
1 1 1    7   35    8 o   19.616   6.2262  -8.1465   11.445   4.7614   14.056 -33.5390   19.714   22.224   9.2550   17.008   8.3311 5.215363 12.45235 
1 1 1    7   35    9 o   86.643   4.3250  158.273   15.456   0.0000   0.0000  158.273   15.456  ?   ?    86.643   4.3250      ?      ? 
1 1 1    7   35   10 o   26.301   6.5298   7.8127   7.9761   29.731   17.154   1.7673   9.0091   35.139   10.795   17.463   7.3501 17.67651 13.05969 
1 1 1    7   35   11 o   39.813   6.3794   35.778   9.3688   38.423   18.423   34.855   10.881   39.585   10.926   40.041   6.5886 -0.4558144 12.75877 
1 1 1    7   35   12 o   58.369   5.2722   73.859   11.278   78.946   21.797   72.000   13.179   58.807   8.9867   57.932   5.5157 0.8748550 10.54435 
1 1 1    7   35   13 o   37.392   6.0396   41.897   10.226   1.2213   20.722   54.992   11.757   24.267   10.680   50.517   5.6430 -26.25016 12.07921 
1 1 1    7   35   14 o   45.956   6.4754   43.731   10.444   62.972   22.088   38.190   11.853   50.317   10.954   41.595   6.9092 8.722305 12.95078 
1 1 1    7   35   15 f   29.344   8.2174   9.5199   15.661  -7.5642   20.071   36.111   25.041   21.586   9.9068   37.102   13.113 -15.51679 16.43472 
1 1 1    7   35   16 o   79.833   5.0203  137.299   14.036  150.786   29.158  133.232   16.013   80.779   8.7518   78.888   4.9216 1.890465 10.04070 
1 1 1    7   35   17 o   50.115   6.1838   55.083   12.782   0.0000   0.0000   55.083   12.782  ?   ?    50.115   6.1838      ?      ? 
1 1 1    7   35   18 o   58.134   6.6637   88.007   13.481   64.295   23.985   98.957   16.299   49.071   11.960   67.197   5.8809 -18.12643 13.32746 
1 1 1    7   35   19 o   42.215   8.3850   51.430   17.292   72.036   22.664   22.731   26.748   53.044   10.728   31.386   12.889 21.65778 16.76995 
1 1 1    7   35   20 o   32.441   8.0940   24.747   16.399   45.695   21.035  -7.7081   26.183   41.016   11.801   23.866   11.081 17.14983 16.18802 
1 1 1    7   35   21 o   35.283   8.4468   34.939   18.978   55.836   22.200 -21.7883   36.577   45.325   11.771   25.241   12.118 20.08422 16.89363 
1 1 1    7   35   22 o   22.887   7.6223 -12.3294   18.554 -19.8356   25.350  -3.6681   27.231   21.145   10.135   24.628   11.388 -3.482721 15.24464 
1 1 1    7   35   23 o   34.848   9.0178   36.621   17.915   46.383   23.164   22.092   28.260   39.398   12.608   30.298   12.897 9.099693 18.03568 
1 1 1    7   35   24 o   30.608   9.6368   14.833   22.751   47.042   40.801   0.2999   27.407   36.222   15.460   24.993   11.510 11.22813 19.27361 
1 1 1    7   35   25 o   36.700   10.452   34.083   20.769   18.180   23.488   91.088   44.470   28.041   11.839   45.358   17.228 -17.31675 20.90340 
1 1 1    7   35   26 o   29.279   8.7393   22.950   17.746   20.157   22.723   27.317   28.413   28.082   11.737   30.477   12.951 -2.394670 17.47857 
1 1 1    7   35   27 o   26.886   8.1962   14.483   17.974   29.408   23.046  -8.6949   28.720   30.822   12.206   22.951   10.942 7.870533 16.39237 
1 1 1    7   36    0 o   25.940   5.7977   17.911   7.7130   17.911   7.7130   17.911   7.7130   25.940   8.1992   25.940   8.1992 0.000000 0.000000 
1 1 1    7   36    1 o   40.826   3.9943   35.582   6.6176   36.485   10.370   34.961   8.5952   41.130   6.1131   40.522   5.1428 0.6077766 7.988627 
1 1 1    7   36    2 o   93.608   3.9073  194.148   12.245  175.451   25.902  199.529   13.896   89.566   7.0116   97.650   3.4503 -8.084686 7.814542 
1 1 1    7   36    3 o   45.394   4.1549   44.051   7.3702   45.162   12.663   43.482   9.0634   45.528   6.7438   45.260   4.8552 0.2681351 8.309743 
1 1 1    7   36    4 o   26.048   5.4168   12.202   6.8823   27.177   11.054   2.7237   8.7946   34.348   7.9589   17.748   7.3499 16.60044 10.83354 
1 1 1    7   36    5 o   52.400   4.1860   54.492   8.6642   77.947   15.123   43.032   10.571   60.055   6.1057   44.744   5.7281 15.31049 8.371974 
1 1 1    7   36    6 o   67.523   3.8527   95.931   10.194  103.597   17.638   92.087   12.491   69.141   6.1853   65.905   4.5953 3.235573 7.705461 
1 1 1    7   36    7 f   20.999   5.8395   7.1022   6.9922   4.7100   13.183   8.0386   8.2480   21.517   8.9621   20.480   7.4888 1.037298 11.67906 
1 1 1    7   36    8 o   28.974   7.5588   18.465   11.918   21.113   15.060   14.027   19.496   30.066   10.192   27.882   11.166 2.184601 15.11769 
1 1 1    7   36    9 o   61.167   5.0406   80.022   12.716   0.0000   0.0000   80.022   12.716  ?   ?    61.167   5.0406      ?      ? 
1 1 1    7   36   10 o   26.609   6.5999   10.130   8.3266   29.350   16.821   3.8922   9.5831   34.419   10.709   18.799   7.7170 15.61983 13.19970 
1 1 1    7   36   11 o   18.648   5.8811  -0.6510   7.9107  -3.1244   16.685   0.0662   8.9848   20.789   9.3381   16.507   7.1519 4.281576 11.76223 
1 1 1    7   36   12 o   67.659   4.7748  100.684   11.992  102.100   22.417  100.117   14.194   66.988   8.1135   68.330   5.0366 -1.341492 9.549691 
1 1 1    7   36   13 f   33.939   6.1257   31.948   10.404  -0.2396   19.822   44.188   12.223   23.154   10.305   44.724   6.6265 -21.57026 12.25146 
1 1 1    7   36   14 o   40.567   6.8457   39.421   10.195   41.257   20.957   38.852   11.669   39.347   11.900   41.786   6.7706 -2.438602 13.69148 
1 1 1    7   36   15 o   39.188   8.8258   41.854   16.107   34.532   21.614   50.998   24.156   35.723   12.209   42.654   12.748 -6.931236 17.65167 
1 1 1    7   36   16 o   48.091   7.0304   57.777   11.136   56.526   24.741   58.095   12.471   44.779   12.771   51.402   5.8825 -6.622192 14.06073 
1 1 1    7   36   17 o   42.517   6.7252   57.328   12.447   11.408   25.106   72.294   14.333   27.807   12.002   57.226   6.0725 -29.41860 13.45036 
1 1 1    7   36   18 o   20.120   6.5631  -3.3225   8.8737   4.1580   23.122  -4.6146   9.6096   25.185   11.173   15.056   6.8896 10.12926 13.12628 
1 1 1    7   36   19 o   39.725   7.2556   38.559   10.938   47.345   21.336   35.428   12.739   41.229   11.891   38.222   8.3171 3.007240 14.51121 
1 1 1    7   36   20 o   24.457   7.8246   1.7086   16.479  -1.5290   21.071   6.8075   26.443   22.576   10.281   26.337   11.798 -3.760719 15.64930 
1 1 1    7   36   21 o   51.702   9.1686   88.684   20.546   99.790   24.296   60.799   38.498   63.342   9.2998   40.063   15.804 23.27871 18.33724 
1 1 1    7   36   22 o   26.359   8.2294   0.3940   18.811 -25.4735   25.444   31.575   27.936   20.054   9.7434   32.663   13.265 -12.60830 16.45877 
1 1 1    7   36   23 o   38.891   9.1385   43.375   17.397   25.935   21.835   73.693   28.789   30.349   11.924   47.432   13.851 -17.08257 18.27694 
1 1 1    7   36   24 o   27.837   8.8820   14.160   22.672 -10.9455   38.946   27.030   27.884   25.382   12.265   30.292   12.850 -4.910288 17.76408 
1 1 1    7   36   25 o   30.987   9.3964   30.034   20.064   29.762   22.689   31.009   42.969   30.952   12.157   31.022   14.331 -0.7031441E-01 18.79275 
1 1 1    7   37    1 o   80.150   2.9858  136.102   9.8668  133.767   14.055  138.371   13.854   79.438   4.2900   80.862   4.1540 -1.424034 5.971584 
1 1 1    7   37    2 o   40.735   5.1377   39.606   6.6815   33.769   14.480   41.185   7.5311   37.353   9.4050   44.117   4.1389 -6.764294 10.27545 
1 1 1    7   37    3 o   66.280   4.1721   95.920   11.242  115.093   16.043   77.422   15.758   73.140   5.3183   59.421   6.4298 13.71894 8.344266 
1 1 1    7   37    4 o   89.434   4.1365  170.803   14.859  231.390   22.470  123.725   19.807  103.743   5.2515   75.125   6.3925 28.61745 8.272984 
1 1 1    7   37    5 o   72.533   3.6607  108.907   10.306  125.415   18.421  101.385   12.434   75.966   5.8794   69.100   4.3629 6.866562 7.321346 
1 1 1    7   37    6 o   32.416   6.0076   23.539   7.6621   29.540   13.850   20.892   9.1977   34.847   9.4141   29.985   7.4660 4.862293 12.01523 
1 1 1    7   37    7 o   29.137   6.1572   18.381   7.3948   25.547   13.844   15.520   8.7472   32.362   9.6464   25.911   7.6546 6.451586 12.31443 
1 1 1    7   37    8 o   16.719   5.0247  -1.1100   6.9001 -22.7867   13.325   6.8319   8.0657   13.998   6.8551   19.441   7.3483 -5.442523 10.04930 
1 1 1    7   37    9 o   49.535   5.5910   53.308   11.422   0.0000   0.0000   53.308   11.422  ?   ?    49.535   5.5910      ?      ? 
1 1 1    7   37   10 o   49.004   5.6050   51.352   9.8774   66.084   19.541   46.295   11.448   52.114   9.4387   45.894   6.0478 6.220760 11.21000 
1 1 1    7   37   11 o   43.548   6.6003   46.119   10.180   46.146   20.745   46.111   11.683   41.432   11.652   45.664   6.2035 -4.231815 13.20054 
1 1 1    7   37   12 f   40.366   6.5691   44.267   10.137   29.188   19.807   49.619   11.800   33.303   11.672   47.429   6.0320 -14.12521 13.13819 
1 1 1    7   37   13 o   55.097   5.5860   56.937   11.170  111.981   22.408   38.739   12.885   69.764   7.7877   40.429   8.0102 29.33498 11.17195 
1 1 1    7   37   14 o   53.388   6.0642   62.529   11.212   78.814   23.235   57.587   12.801   55.726   10.494   51.050   6.0797 4.675411 12.12831 
1 1 1    7   37   15 o   24.160   7.5350   0.8488   15.473   14.333   20.912 -15.4646   23.002   27.371   11.334   20.950   9.9317 6.421219 15.07000 
1 1 1    7   37   16 o   58.556   5.5694   75.372   13.451   0.0000   0.0000   75.372   13.451  ?   ?    58.556   5.5694      ?      ? 
1 1 1    7   37   17 o   28.937   7.6949   14.579   10.295   38.482   23.690   9.0129   11.431   36.007   12.751   21.867   8.6165 14.13966 15.38972 
1 1 1    7   37   18 o   79.879   5.1348  149.647   14.604  143.136   28.312  152.007   17.047   76.300   8.9967   83.458   4.9523 -7.158012 10.26965 
1 1 1    7   37   19 o   74.313   5.4874  129.745   14.229  130.612   28.679  129.461   16.388   71.846   9.6782   76.780   5.1749 -4.933784 10.97486 
1 1 1    7   37   20 o   23.222   6.8313   9.8895   10.403  -9.0647   24.598   14.018   11.480   22.094   10.413   24.350   8.8454 -2.255453 13.66253 
1 1 1    7   37   21 o   36.704   9.0256   43.915   16.954   47.326   22.026   38.957   26.557   39.113   12.268   34.295   13.241 4.817314 18.05112 
1 1 1    7   37   22 o   23.825   7.8081  -0.5203   18.518   10.248   25.988 -11.6283   26.395   25.792   11.613   21.858   10.440 3.933372 15.61621 
1 1 1    7   37   23 o   26.785   8.3190   15.931   17.672   18.525   22.766   11.997   28.031   27.206   11.578   26.365   11.949 0.8414021 16.63797 
1 1 1    7   38    0 o   10.907   4.6306   2.7602   5.2995   2.7602   5.2995   2.7602   5.2995   10.907   6.5487   10.907   6.5487 0.000000 0.000000 
1 1 1    7   38    1 o   42.927   6.6155   31.089   8.4529   25.136   9.0361   72.794   23.916   32.991   6.8642   52.862   11.311 -19.87099 13.23105 
1 1 1    7   38    2 o   23.402   6.3459   11.514   8.1001   15.137   8.5846 -17.8975   24.457   25.429   7.5998   21.376   10.165 4.052956 12.69173 
1 1 1    7   38    3 o   52.029   3.7119   59.086   7.4484   57.583   12.938   59.830   9.1095   51.056   6.1439   53.002   4.1671 -1.946686 7.423805 
1 1 1    7   38    4 o   34.732   5.1059   29.977   6.8017   21.260   11.636   34.501   8.3832   29.534   8.8527   39.931   5.0903 -10.39689 10.21177 
1 1 1    7   38    5 o   21.510   5.6171   9.0715   6.9859   1.8103   11.249   13.630   8.9129   18.736   8.0601   24.284   7.8258 -5.547131 11.23425 
1 1 1    7   38    6 o   74.749   3.8430  118.569   11.387  133.372   19.356  110.735   14.081   77.758   6.0354   71.741   4.7589 6.016617 7.685930 
1 1 1    7   38    7 o   19.357   5.6267   4.9033   7.0667  -0.9495   13.057   7.3281   8.4041   18.912   8.3927   19.801   7.4969 -0.8889141 11.25347 
1 1 1    7   38    8 f   44.298   5.5720   44.234   9.1222   49.993   16.829   41.838   10.855   45.051   9.3625   43.546   6.0441 1.505844 11.14399 
1 1 1    7   38    9 o   18.118   7.4084   4.0733   8.7883   0.0000   0.0000   4.0733   8.7883  ?   ?    18.118   7.4084      ?      ? 
1 1 1    7   38   10 o   29.307   5.2414   22.689   8.7062 -11.8191   16.273   36.526   10.305   18.021   8.4856   40.592   6.1551 -22.57180 10.48287 
1 1 1    7   38   11 f   26.203   6.8145   15.572   9.2065   14.814   17.076   15.882   10.931   26.516   10.505   25.891   8.6833 0.6251297 13.62899 
1 1 1    7   38   12 o   45.952   6.3125   47.769   10.139   59.874   20.967   44.076   11.583   47.536   10.924   44.369   6.3296 3.166534 12.62498 
1 1 1    7   38   13 f   31.178   7.3852   22.143   9.9335   35.281   20.248   17.979   11.400   35.309   11.818   27.047   8.8600 8.262293 14.77040 
1 1 1    7   38   14 o   22.487   6.5280   8.9390   9.3378  -6.0021   21.052   12.599   10.419   21.477   9.9597   23.496   8.4419 -2.019232 13.05605 
1 1 1    7   38   15 o   38.230   9.0483   44.378   16.898   38.115   23.456   51.136   24.363   35.562   12.678   40.898   12.913 -5.335644 18.09669 
1 1 1    7   38   16 o   19.230   7.9929   4.8230   10.455   0.0000   0.0000   4.8230   10.455  ?   ?    19.230   7.9929      ?      ? 
1 1 1    7   38   17 o   17.846   6.0570 -10.2216   9.3146  -2.2111   21.772 -12.0163   10.305   22.317   10.270   13.374   6.4240 8.942687 12.11392 
1 1 1    7   38   18 o   29.358   7.7206   15.051   10.453   46.087   24.002   7.7867   11.612   37.745   12.866   20.971   8.5385 16.77443 15.44128 
1 1 1    7   38   19 o   46.583   7.3943   63.333   12.286   53.281   25.957   66.236   13.947   39.487   13.380   53.679   6.2997 -14.19131 14.78868 
1 1 1    7   38   20 o   45.673   7.5089   55.975   12.304   64.190   25.864   53.572   13.989   43.870   13.210   47.476   7.1440 -3.605927 15.01778 
1 1 1    7   38   21 o   43.675   7.3801   56.747   12.300   47.042   25.058   59.829   14.118   36.888   13.109   50.462   6.7836 -13.57333 14.76018 
1 1 1    7   39    8 o   41.694   7.1193   57.457   15.321   76.186   17.662   0.4998   30.801   57.196   7.4868   26.193   12.111 31.00336 14.23857 
1 1 1    7   39    9 o   25.761   12.085  -4.1829   32.480   0.0000   0.0000  -4.1829   32.480  ?   ?    25.761   12.085      ?      ? 
1 1 1    7   39   10 o   35.197   7.6659   39.251   16.452   55.954   18.481 -24.5338   36.116   46.373   9.9600   24.021   11.656 22.35245 15.33184 
1 1 1    7   39   11 o   27.174   8.5157   9.7360   15.300   6.0388   17.004   25.459   35.065   22.805   9.8596   31.543   13.887 -8.737453 17.03148 
1 1 1    7   39   12 o   34.310   9.3846   34.476   17.111   32.829   19.237   40.714   37.444   33.876   11.518   34.745   14.819 -0.8696899 18.76911 
1 1 1    7   39   13 o   29.696   8.7016   20.312   16.290   13.279   19.590   36.074   29.325   25.778   10.843   33.615   13.612 -7.836987 17.40314 
1 1 1    7   39   14 f   26.289   7.7903   12.670   15.459   26.472   20.341  -6.2035   23.786   30.458   11.631   22.121   10.366 8.336296 15.58051 
1 1 1    7   39   15 o   35.867   8.7707   39.310   16.578   23.653   22.373   58.369   24.685   29.160   11.860   42.574   12.924 -13.41415 17.54135 
1 1 1    7   39   16 o   14.516   6.8172  -7.3217   10.383   0.0000   0.0000  -7.3217   10.383  ?   ?    14.516   6.8172      ?      ? 
1 1 1    7   39   17 o   26.294   7.4579   16.313   10.917   21.201   23.101   14.908   12.387   28.056   11.787   24.533   9.1405 3.522636 14.91585 
1 1 1    7   39   18 o   24.339   7.1949   12.291   10.455   12.261   24.077   12.297   11.606   25.682   11.397   22.995   8.7850 2.686913 14.38983 
1 1 1    8    0    0 o  280.806   3.4179  1628.09   55.944  1628.09   55.944  1628.09   55.944  280.806   4.8336  280.806   4.8336 0.000000 0.000000 
1 1 1    8    0    1 f  182.446   1.9906  687.091   21.172  687.091   21.172  687.091   21.172  182.446   2.8151  182.446   2.8151 0.000000 0.000000 
1 1 1    8    0    2 o   28.629   3.0182   18.000   4.7102   18.000   4.7102   18.000   4.7102   28.629   4.2684   28.629   4.2684 0.000000 0.000000 
1 1 1    8    0    3 o  131.224   1.8496  355.604   14.144  355.604   14.144  355.604   14.144  131.224   2.6157  131.224   2.6157 0.000000 0.000000 
1 1 1    8    0    4 o  369.621   4.0917  2822.25   88.166  2822.25   88.166  2822.25   88.166  369.621   5.7865  369.621   5.7865 0.000000 0.000000 
1 1 1    8    0    5 o  353.211   3.9679  2577.09   81.701  2577.09   81.701  2577.09   81.701  353.211   5.6114  353.211   5.6114 0.000000 0.000000 
1 1 1    8    0    6 o   6.1831   3.1124  -6.9752   4.8921  -6.9752   4.8921  -6.9752   4.8921   6.1831   4.4015   6.1831   4.4015 0.000000 0.000000 
1 1 1    8    0    7 o  155.891   2.7136  502.267   24.641  502.267   24.641  502.267   24.641  155.891   3.8376  155.891   3.8376 0.000000 0.000000 
1 1 1    8    0    8 o  448.215   3.3420  4146.63   87.350  4146.63   87.350  4146.63   87.350  448.215   4.7263  448.215   4.7263 0.000000 0.000000 
1 1 1    8    0    9 o  540.016   4.4949  6021.57  141.539  6021.57  141.539  6021.57  141.539  540.016   6.3568  540.016   6.3568 0.000000 0.000000 
1 1 1    8    0   10 f  244.620   2.3488  1234.93   33.500  1234.93   33.500  1234.93   33.500  244.620   3.3217  244.620   3.3217 0.000000 0.000000 
1 1 1    8    0   11 o   79.549   2.5516  131.325   11.784  131.325   11.784  131.325   11.784   79.549   3.6086   79.549   3.6086 0.000000 0.000000 
1 1 1    8    0   12 o   34.177   5.1047   27.084   8.9537   27.084   8.9537   27.084   8.9537   34.177   7.2192   34.177   7.2192 0.000000 0.000000 
1 1 1    8    0   13 o   52.872   5.3453   61.125   15.508   61.125   15.508   61.125   15.508   52.872   7.5594   52.872   7.5594 0.000000 0.000000 
1 1 1    8    0   14 o  167.831   2.8470  581.998   27.834  581.998   27.834  581.998   27.834  167.831   4.0263  167.831   4.0263 0.000000 0.000000 
1 1 1    8    0   15 o   19.459   8.0555   9.1333   15.310   9.1333   15.310   9.1333   15.310   19.459   11.392   19.459   11.392 0.000000 0.000000 
1 1 1    8    0   16 f   98.226   2.8392  200.018   16.205  200.018   16.205  200.018   16.205   98.226   4.0152   98.226   4.0152 0.000000 0.000000 
1 1 1    8    0   17 o  281.186   2.6629  1631.77   43.657  1631.77   43.657  1631.77   43.657  281.186   3.7659  281.186   3.7659 0.000000 0.000000 
1 1 1    8    0   18 o  468.843   3.5649  4536.90   97.463  4536.90   97.463  4536.90   97.463  468.843   5.0415  468.843   5.0415 0.000000 0.000000 
1 1 1    8    0   19 o  261.607   3.7538  1414.04   57.227  1414.04   57.227  1414.04   57.227  261.607   5.3087  261.607   5.3087 0.000000 0.000000 
1 1 1    8    0   20 o  603.409   4.3531  7518.53  153.176  7518.53  153.176  7518.53  153.176  603.409   6.1562  603.409   6.1562 0.000000 0.000000 
1 1 1    8    0   21 o  120.255   3.0269  299.521   21.170  299.521   21.170  299.521   21.170  120.255   4.2806  120.255   4.2806 0.000000 0.000000 
1 1 1    8    0   22 o  216.191   2.7037  965.237   34.070  965.237   34.070  965.237   34.070  216.191   3.8236  216.191   3.8236 0.000000 0.000000 
1 1 1    8    0   23 o  176.696   2.7837  645.215   28.658  645.215   28.658  645.215   28.658  176.696   3.9367  176.696   3.9367 0.000000 0.000000 
1 1 1    8    0   24 o   40.583   9.2692   43.324   19.385   43.324   19.385   43.324   19.385   40.583   13.109   40.583   13.109 0.000000 0.000000 
1 1 1    8    0   25 o  267.840   3.8564  1483.65   60.191  1483.65   60.191  1483.65   60.191  267.840   5.4538  267.840   5.4538 0.000000 0.000000 
1 1 1    8    0   26 o  143.109   3.0506  423.930   25.412  423.930   25.412  423.930   25.412  143.109   4.3142  143.109   4.3142 0.000000 0.000000 
1 1 1    8    0   27 o  195.509   2.8277  790.063   32.216  790.063   32.216  790.063   32.216  195.509   3.9990  195.509   3.9990 0.000000 0.000000 
1 1 1    8    0   28 o   51.933   7.1506   61.849   19.305   61.849   19.305   61.849   19.305   51.933   10.113   51.933   10.113 0.000000 0.000000 
1 1 1    8    0   29 o   89.384   5.9002  169.859   30.145  169.859   30.145  169.859   30.145   89.384   8.3441   89.384   8.3441 0.000000 0.000000 
1 1 1    8    0   30 o   90.385   4.4258  171.400   23.076  171.400   23.076  171.400   23.076   90.385   6.2590   90.385   6.2590 0.000000 0.000000 
1 1 1    8    0   31 o   90.363   4.4724  171.400   23.307  171.400   23.307  171.400   23.307   90.363   6.3249   90.363   6.3249 0.000000 0.000000 
1 1 1    8    0   32 o  155.347   4.2199  501.486   38.109  501.486   38.109  501.486   38.109  155.347   5.9678  155.347   5.9678 0.000000 0.000000 
1 1 1    8    0   33 f   20.108   8.9605   4.1401   22.228   4.1401   22.228   4.1401   22.228   20.108   12.672   20.108   12.672 0.000000 0.000000 
1 1 1    8    0   34 o   38.987   12.238   46.460   29.402   46.460   29.402   46.460   29.402   38.987   17.306   38.987   17.306 0.000000 0.000000 
1 1 1    8    0   35 o   93.027   5.0214  182.844   26.882  182.844   26.882  182.844   26.882   93.027   7.1013   93.027   7.1013 0.000000 0.000000 
1 1 1    8    0   36 o   75.590   8.8894  130.024   35.934  130.024   35.934  130.024   35.934   75.590   12.572   75.590   12.572 0.000000 0.000000 
1 1 1    8    0   37 f  133.868   10.556  400.675   79.799  400.675   79.799  400.675   79.799  133.868   14.928  133.868   14.928 0.000000 0.000000 
1 1 1    8    0   38 o   33.173   11.161   35.373   24.652   35.373   24.652   35.373   24.652   33.173   15.785   33.173   15.785 0.000000 0.000000 
1 1 1    8    0   39 o   52.938   10.253   72.069   27.374   72.069   27.374   72.069   27.374   52.938   14.501   52.938   14.501 0.000000 0.000000 
1 1 1    8    0   40 o   11.774   6.0533 -48.7764   23.534 -48.7764   23.534 -48.7764   23.534   11.774   8.5607   11.774   8.5607 0.000000 0.000000 
1 1 1    8    0   41 o   12.683   6.4373 -35.3189   22.706 -35.3189   22.706 -35.3189   22.706   12.683   9.1037   12.683   9.1037 0.000000 0.000000 
1 1 1    8    0   42 o  109.630   5.5231  258.349   34.906  258.349   34.906  258.349   34.906  109.630   7.8109  109.630   7.8109 0.000000 0.000000 
1 1 1    8    0   43 o   17.955   8.3948  -2.3415   22.893  -2.3415   22.893  -2.3415   22.893   17.955   11.872   17.955   11.872 0.000000 0.000000 
1 1 1    8    0   44 f   57.228   14.303  102.430   43.401  102.430   43.401  102.430   43.401   57.228   20.227   57.228   20.227 0.000000 0.000000 
1 1 1    8    0   45 o   28.901   10.820   29.896   24.471   29.896   24.471   29.896   24.471   28.901   15.302   28.901   15.302 0.000000 0.000000 
1 1 1    8    0   46 o   14.645   7.2319 -17.5487   22.639 -17.5487   22.639 -17.5487   22.639   14.645   10.227   14.645   10.227 0.000000 0.000000 
1 1 1    8    0   47 f   14.559   7.1745 -15.4018   21.971 -15.4018   21.971 -15.4018   21.971   14.559   10.146   14.559   10.146 0.000000 0.000000 
1 1 1    8    0   48 o   22.003   9.8094   12.818   26.673   12.818   26.673   12.818   26.673   22.003   13.873   22.003   13.873 0.000000 0.000000 
1 1 1    8    0   49 o   33.940   11.993   46.979   28.959   46.979   28.959   46.979   28.959   33.940   16.961   33.940   16.961 0.000000 0.000000 
1 1 1    8    1    0 o  178.010   1.9750  654.101   20.495  654.101   20.495  654.101   20.495  178.010   2.7931  178.010   2.7931 0.000000 0.000000 
1 1 1    8    1    1 o  208.983   2.0899  901.041   18.013  894.467   25.321  907.777   25.629  208.211   2.9485  209.754   2.9625 -1.542831 4.179737 
1 1 1    8    1    2 o  137.165   1.8592  388.139   10.518  389.400   14.927  386.896   14.823  137.386   2.6342  136.943   2.6245 0.4423218 3.718480 
1 1 1    8    1    3 o  207.932   2.0928  892.072   17.948  890.214   25.346  893.941   25.418  207.715   2.9585  208.149   2.9607 -0.4343262 4.185521 
1 1 1    8    1    4 o  372.601   3.7538  2866.96   56.486  2871.78   89.513  2863.76   72.815  372.799   5.8216  372.403   4.7407 0.3957214 7.507699 
1 1 1    8    1    5 o  173.504   2.7953  621.370   20.003  621.779   28.274  620.960   28.304  173.562   3.9497  173.447   3.9566 0.1146088 5.590555 
1 1 1    8    1    6 o   85.401   2.0653  149.888   7.1959  146.626   9.4562  154.374   11.091   84.304   2.7196   86.497   3.1089 -2.193275 4.130583 
1 1 1    8    1    7 o  308.540   2.5712  1964.55   32.720  1967.79   46.347  1961.33   46.200  308.793   3.6391  308.287   3.6334 0.5066223 5.142435 
1 1 1    8    1    8 o  278.536   2.4325  1600.82   27.944  1595.34   39.352  1606.39   39.688  278.056   3.4314  279.016   3.4488 -0.9597473 4.865021 
1 1 1    8    1    9 o  223.062   3.1709  1026.98   29.173  1028.89   41.213  1025.07   41.300  223.270   4.4754  222.855   4.4933 0.4152832 6.341852 
1 1 1    8    1   10 o  445.347   3.3541  4093.32   61.609  4093.69   87.113  4092.96   87.142  445.367   4.7424  445.327   4.7444 0.3961182E-01 6.708206 
1 1 1    8    1   11 o  453.910   3.9538  4252.16   74.016  4270.88  105.349  4233.90  104.013  454.895   5.6150  452.924   5.5680 1.970734 7.907648 
1 1 1    8    1   12 o  410.092   3.1697  3469.67   53.607  3488.43   76.410  3451.49   75.228  411.183   4.5055  409.002   4.4595 2.181091 6.339343 
1 1 1    8    1   13 o   32.020   6.4960   21.167   9.1568   15.663   12.470   27.607   13.489   28.182   9.2682   35.858   9.1044 -7.676344 12.99192 
1 1 1    8    1   14 o  322.362   3.2402  2144.25   43.079  2150.32   60.776  2138.13   61.072  322.821   4.5646  321.904   4.5999 0.9172058 6.480351 
1 1 1    8    1   15 o  375.721   3.5200  2913.10   54.544  2891.37   76.696  2935.34   77.587  374.304   4.9680  377.139   4.9879 -2.834808 7.039917 
1 1 1    8    1   16 o  323.818   2.8094  2163.30   37.519  2177.31   53.450  2149.69   52.678  324.851   3.9893  322.784   3.9569 2.066132 5.618841 
1 1 1    8    1   17 o  392.540   3.1498  3179.54   50.992  3195.92   72.630  3163.61   71.607  393.536   4.4747  391.544   4.4341 1.992004 6.299590 
1 1 1    8    1   18 o  307.014   2.9852  1936.69   37.212  1898.43   48.310  1992.52   58.352  303.319   3.8616  310.709   4.5534 -7.390015 5.970376 
1 1 1    8    1   19 o  352.292   3.8742  2563.24   55.261  2562.14   86.849  2563.99   71.632  352.180   5.9791  352.403   4.9283 -0.2225952 7.748410 
1 1 1    8    1   20 o   62.499   4.6105   80.872   11.865   84.518   16.577   77.043   16.989   63.951   6.2849   61.048   6.7474 2.903072 9.221037 
1 1 1    8    1   21 o  130.868   2.9204  353.194   15.754  368.411   22.683  339.013   21.898  133.589   4.1168  128.148   4.1432 5.441605 5.840701 
1 1 1    8    1   22 o  172.520   2.7819  614.409   19.793  616.357   28.195  612.516   27.791  172.788   3.9564  172.251   3.9118 0.5372009 5.563726 
1 1 1    8    1   23 o  282.295   3.0135  1646.10   34.778  1643.53   52.781  1648.07   46.234  282.073   4.5368  282.517   3.9678 -0.4448242 6.027099 
1 1 1    8    1   24 o   69.926   4.6921  101.358   13.512   94.848   19.080  107.910   19.140   67.662   6.8369   72.190   6.4282 -4.528282 9.384272 
1 1 1    8    1   25 f  163.956   3.6287  548.615   24.019  522.171   30.633  590.813   38.697  158.935   4.6731  168.976   5.5525 -10.04094 7.257329 
1 1 1    8    1   26 o   96.948   4.1336  189.056   16.280  229.253   25.877  162.724   20.944  105.229   5.9622   88.668   5.7269 16.56032 8.267164 
1 1 1    8    1   27 o  434.585   3.9920  3910.96   71.553  3907.74  101.120  3914.18  101.263  434.406   5.6438  434.763   5.6472 -0.3569946 7.983980 
1 1 1    8    1   28 o   83.621   4.7095  145.854   16.124  152.982   21.871  137.367   23.866   85.907   6.1728   81.336   7.1143 4.570992 9.418931 
1 1 1    8    1   29 o   68.590   6.6439   99.194   18.434  103.373   24.148   93.359   28.538   70.434   8.3125   66.745   10.367 3.689346 13.28773 
1 1 1    8    1   30 f   31.109   7.9549   12.766   14.193  -2.1888   19.384   30.047   20.837   24.299   10.516   37.920   11.939 -13.62100 15.90987 
1 1 1    8    1   31 o   52.523   7.3006   60.639   15.337   76.546   21.213   43.217   22.201   60.562   8.4925   44.484   11.877 16.07826 14.60115 
1 1 1    8    1   32 o  159.206   3.7559  528.877   24.062  542.043   31.028  509.017   38.110  161.804   4.6495  156.609   5.9000 5.195480 7.511839 
1 1 1    8    1   33 o  135.567   4.3267  389.924   23.235  350.847   37.510  414.253   29.597  129.779   7.0077  141.356   5.0766 -11.57736 8.653328 
1 1 1    8    1   34 o   59.157   8.6994   77.435   20.905   57.558   29.839   96.598   29.297   50.790   13.859   67.525   10.520 -16.73471 17.39889 
1 1 1    8    1   35 o  102.468   7.2579  255.295   25.753  154.910   45.649  302.159   31.190   84.582   13.085  120.354   6.2833 -35.77192 14.51579 
1 1 1    8    1   36 o   93.489   5.0352  183.659   19.392  172.671   27.319  194.817   27.531   90.624   7.3090   96.354   6.9277 -5.729897 10.07049 
1 1 1    8    1   37 o   53.340   10.203   49.371   22.966  118.517   43.612   22.839   27.015   71.003   15.341   35.677   13.457 35.32577 20.40662 
1 1 1    8    1   38 o   40.891   8.9005   37.641   16.800   27.961   23.513   47.735   24.011   36.414   12.719   45.368   12.454 -8.954102 17.80100 
1 1 1    8    1   39 o   43.375   9.7088   39.541   18.908   60.180   32.417   28.898   23.279   50.079   14.719   36.672   12.665 13.40636 19.41758 
1 1 1    8    1   40 o   52.697   9.2439   63.681   19.348   83.009   32.852   53.415   23.941   58.122   13.893   47.273   12.198 10.84917 18.48780 
1 1 1    8    1   41 o   52.082   8.5435   64.113   18.123   49.732   24.516   81.440   26.910   45.299   12.641   58.865   11.496 -13.56549 17.08710 
1 1 1    8    1   42 o   85.035   6.4216  163.139   21.961  178.025   29.058  143.310   33.538   90.429   7.7910   79.641   10.210 10.78737 12.84316 
1 1 1    8    1   43 o   30.520   8.7052   13.755   17.587   0.1321   26.177   24.961   23.743   27.086   11.958   33.954   12.654 -6.868120 17.41037 
1 1 1    8    1   44 o   39.143   10.678   38.267   25.629 -14.1961   58.473   50.742   28.514   34.338   16.143   43.947   13.980 -9.609116 21.35512 
1 1 1    8    1   45 o   36.353   8.9951   32.611   17.205   44.609   24.434   20.812   24.231   41.120   12.925   31.586   12.513 9.533802 17.99025 
1 1 1    8    1   46 o   29.520   8.4586   16.790   16.090   20.267   22.663   13.257   22.847   30.676   12.118   28.363   11.804 2.312984 16.91725 
1 1 1    8    1   47 o   23.222   7.4602  -3.6527   15.700   4.3347   22.572 -11.1390   21.853   25.133   11.100   21.312   9.9707 3.821354 14.92047 
1 1 1    8    1   48 o   45.773   9.9640   63.975   20.664   62.792   29.604   65.098   28.858   45.143   14.232   46.404   13.949 -1.261322 19.92809 
1 1 1    8    1   49 o   24.241   8.0349  -6.3062   20.217  -4.6558   29.042  -7.8580   28.161   24.653   11.521   23.829   11.203 0.8238125 16.06980 
1 1 1    8    1   50 o   35.483   15.127   47.996   38.981   0.0000   0.0000   47.996   38.981  ?   ?    35.483   15.127      ?      ? 
1 1 1    8    2    0 o   53.845   2.0230   60.309   6.3125   60.309   6.3125   60.309   6.3125   53.845   2.8609   53.845   2.8609 0.000000 0.000000 
1 1 1    8    2    1 o   38.182   2.3708   30.076   3.7318   31.382   5.3239   28.814   5.2326   38.997   3.3100   37.367   3.3952 1.630035 4.741687 
1 1 1    8    2    2 o  318.815   2.6101  2097.73   34.320  2089.78   48.341  2105.80   48.734  318.206   3.6834  319.423   3.6991 -1.216522 5.220195 
1 1 1    8    2    3 o  337.795   2.9282  2356.33   40.412  2349.31   61.466  2361.67   53.633  337.328   4.4179  338.261   3.8442 -0.9331970 5.856305 
1 1 1    8    2    4 o  190.194   2.6182  747.807   20.176  739.979   31.559  753.220   26.239  189.336   4.0413  191.052   3.3300 -1.715805 5.236467 
1 1 1    8    2    5 o  145.056   2.6979  434.198   16.139  427.764   22.640  440.845   23.013  143.964   3.8130  146.148   3.8177 -2.184402 5.395718 
1 1 1    8    2    6 o  247.506   3.7322  1264.28   38.100  1264.28   38.100   0.0000   0.0000  247.506   3.7322  ?   ?       ?      ? 
1 1 1    8    2    7 o  236.140   2.2395  1149.74   21.801  1125.74   30.269  1175.62   31.427  233.582   3.1419  238.699   3.1922 -5.117096 4.479037 
1 1 1    8    2    8 o  344.516   2.8720  2450.91   39.605  2444.24   64.250  2454.99   50.297  344.105   4.5271  344.927   3.5355 -0.8216553 5.744040 
1 1 1    8    2    9 o  350.713   2.9116  2533.98   40.671  2554.82   66.984  2521.81   51.186  351.823   4.6162  349.604   3.5498 2.218323 5.823260 
1 1 1    8    2   10 o  107.798   2.9125  241.713   12.822  222.954   19.065  257.204   17.326  103.944   4.4471  111.653   3.7623 -7.709282 5.825083 
1 1 1    8    2   11 o  665.195   5.3962  9114.48  147.538  8865.93  199.391  9415.24  219.331  655.230   7.3781  675.159   7.8764 -19.92822 10.79234 
1 1 1    8    2   12 o  169.847   2.1992  594.971   15.405  605.900   21.929  584.322   21.645  171.387   3.1022  168.307   3.1182 3.079575 4.398497 
1 1 1    8    2   13 f  278.099   2.6734  1594.75   29.678  1592.34   37.501  1598.78   48.546  277.832   3.2726  278.365   4.2284 -0.5328369 5.346877 
1 1 1    8    2   14 o  324.014   3.6124  2161.51   47.116  2143.70   60.258  2189.52   75.579  322.326   4.5327  325.703   5.6262 -3.377716 7.224900 
1 1 1    8    2   15 o  382.636   3.5574  3021.57   56.141  3007.34   79.208  3035.94   79.583  381.731   5.0309  383.541   5.0309 -1.810699 7.114764 
1 1 1    8    2   16 o  413.786   3.2501  3531.94   55.445  3577.88   79.727  3488.92   77.159  416.388   4.6424  411.184   4.5497 5.204010 6.500113 
1 1 1    8    2   17 o  307.892   2.7625  1955.38   35.071  1979.52   50.298  1932.55   48.926  309.740   3.9372  306.045   3.8760 3.694733 5.524948 
1 1 1    8    2   18 o  266.440   3.0418  1465.15   33.425  1446.11   47.263  1484.19   47.276  264.707   4.3290  268.173   4.2743 -3.465820 6.083553 
1 1 1    8    2   19 o  241.520   2.7708  1206.55   27.440  1177.01   40.802  1230.93   37.076  238.805   4.1426  244.235   3.6806 -5.429749 5.541507 
1 1 1    8    2   20 o  197.784   2.8410  812.364   22.928  845.741   30.655  769.982   34.543  202.438   3.6715  193.130   4.3366 9.307663 5.682084 
1 1 1    8    2   21 o  361.996   3.0680  2702.45   45.756  2768.00   66.573  2643.77   62.992  366.145   4.4084  357.848   4.2680 8.296783 6.135924 
1 1 1    8    2   22 o  233.587   2.6910  1126.36   25.926  1125.23   36.662  1127.49   36.668  233.470   3.8073  233.705   3.8041 -0.2350769 5.382064 
1 1 1    8    2   23 o  138.670   2.9663  397.022   16.960  382.693   23.796  411.813   24.177  136.126   4.2384  141.214   4.1511 -5.088303 5.932602 
1 1 1    8    2   24 o  178.010   3.1188  653.995   22.883  686.503   32.960  623.747   31.794  182.277   4.3843  173.742   4.4369 8.535095 6.237587 
1 1 1    8    2   25 o  155.754   3.9717  502.985   22.984  504.273   27.166  499.741   43.117  156.222   4.2161  155.286   6.7321 0.9368591 7.943373 
1 1 1    8    2   26 o  190.601   3.1952  751.416   25.095  736.541   36.059  765.388   34.946  188.760   4.6317  192.443   4.4028 -3.683151 6.390427 
1 1 1    8    2   27 o   81.602   4.3982  137.964   14.748  154.386   21.199  122.560   20.531   86.323   5.9541   76.880   6.4748 9.442917 8.796319 
1 1 1    8    2   28 o   62.036   6.9409   80.120   17.688   83.631   26.431   77.272   23.804   63.236   10.134   60.837   9.4869 2.398968 13.88176 
1 1 1    8    2   29 o  118.463   4.2970  292.317   20.762  300.503   27.615  281.674   31.488  120.433   5.5595  116.494   6.5536 3.939392 8.594069 
1 1 1    8    2   30 o   52.315   7.5325   59.827   15.734   51.203   24.142   66.195   20.746   48.334   12.129   56.297   8.9347 -7.962421 15.06500 
1 1 1    8    2   31 o   43.591   8.7433   41.169   16.340   41.492   24.928   40.925   21.636   43.848   12.913   43.335   11.791 0.5129166 17.48670 
1 1 1    8    2   32 o  110.827   4.2872  252.173   19.449  277.818   29.820  233.188   25.657  115.653   6.2514  106.002   5.8685 9.651031 8.574336 
1 1 1    8    2   33 o   19.027   6.5156 -41.0739   15.968 -60.0769   22.377 -21.3584   22.793   16.206   8.0985   21.848   10.209 -5.641705 13.03117 
1 1 1    8    2   34 o   96.409   4.9025  193.921   19.414  193.307   26.275  194.659   28.810   96.292   6.6159   96.526   7.2366 -0.2334747 9.805037 
1 1 1    8    2   35 o   38.390   8.9151   25.832   17.707   50.817   26.647   6.0757   23.695   47.673   13.133   29.107   12.060 18.56598 17.83028 
1 1 1    8    2   36 o   93.388   5.3392  182.400   20.493  166.049   27.691  202.198   30.471   88.790   7.5616   97.985   7.5399 -9.195061 10.67837 
1 1 1    8    2   37 o   37.919   9.0000   29.838   17.021   40.620   24.371   19.569   23.784   42.423   12.834   33.416   12.621 9.007111 17.99992 
1 1 1    8    2   38 o   63.582   7.8328   85.106   19.525   70.325   24.165  112.908   33.140   55.720   10.905   71.443   11.247 -15.72328 15.66564 
1 1 1    8    2   39 o   33.323   8.6073   20.062   16.151   7.1041   23.021   32.621   22.664   28.445   11.845   38.200   12.492 -9.754454 17.21462 
1 1 1    8    2   40 o   31.517   8.4617   15.000   16.307  -1.6101   22.843   32.264   23.287   25.488   11.215   37.547   12.673 -12.05916 16.92340 
1 1 1    8    2   41 f   60.393   7.6715   83.472   18.500   66.135   25.322  103.319   27.093   52.662   11.934   68.124   9.6427 -15.46257 15.34302 
1 1 1    8    2   42 o   27.754   8.4004   5.1994   17.100   6.2752   23.314   3.9468   25.157   27.679   11.746   27.829   12.012 -0.1506157 16.80073 
1 1 1    8    2   43 o   27.077   8.5489  -7.3336   18.916   13.662   31.465 -19.2159   23.670   32.402   13.692   21.753   10.240 10.64954 17.09788 
1 1 1    8    2   44 o   36.849   9.0439   17.924   20.302   67.896   31.443 -17.8052   26.588   50.384   14.407   23.314   10.936 27.06959 18.08771 
1 1 1    8    2   45 o   43.061   9.0139   52.905   20.183   73.802   24.900   12.880   34.461   54.280   11.481   31.842   13.899 22.43715 18.02771 
1 1 1    8    2   46 o   29.043   8.3380   9.7111   17.830   32.499   23.830 -19.2736   26.876   35.453   12.764   22.633   10.731 12.82004 16.67594 
1 1 1    8    2   47 o   28.882   8.2446   12.345   16.555   34.268   23.960  -7.6830   22.901   35.275   12.784   22.489   10.414 12.78672 16.48926 
1 1 1    8    2   48 o   28.479   8.3246   10.813   17.480 -11.6738   24.637   33.604   24.804   22.329   10.491   34.630   12.928 -12.30089 16.64924 
1 1 1    8    2   49 f   27.413   8.7077   9.7999   20.527   12.265   29.340   7.4361   28.728   27.995   12.492   26.832   12.134 1.162558 17.41534 
1 1 1    8    2   50 o   27.853   9.3848   2.2846   28.997   7.1840   47.095  -0.7067   36.799   29.140   13.926   26.565   12.584 2.575764 18.76953 
1 1 1    8    3    0 o  508.149   3.6826  5330.92  109.125  5330.92  109.125  5330.92  109.125  508.149   5.2080  508.149   5.2080 0.000000 0.000000 
1 1 1    8    3    1 o  191.853   2.0261  758.902   16.026  740.723   22.289  778.360   23.059  189.477   2.8521  194.230   2.8785 -4.753235 4.052142 
1 1 1    8    3    2 o  373.437   2.9055  2878.40   44.746  2858.00   62.714  2899.55   63.861  372.091   4.0865  374.782   4.1313 -2.690948 5.810966 
1 1 1    8    3    3 o  153.503   2.0637  482.241   12.872  508.346   20.230  464.482   16.686  156.960   3.1250  150.046   2.6962 6.913635 4.127361 
1 1 1    8    3    4 o   87.933   2.4173  158.993   8.5996  162.452   13.620  156.700   11.090   88.720   3.7220   87.146   3.0854 1.573738 4.834563 
1 1 1    8    3    5 o  195.719   2.3825  789.634   19.220  767.317   26.623  813.928   27.777  192.834   3.3474  198.603   3.3910 -5.769012 4.764916 
1 1 1    8    3    6 o  299.760   3.0991  1853.77   36.074  1851.48   44.108  1858.39   62.689  299.532   3.5703  299.987   5.0667 -0.4549255 6.198274 
1 1 1    8    3    7 o  199.385   2.2529  819.388   18.327  814.469   24.174  826.037   28.106  198.689   2.9499  200.081   3.4059 -1.391464 4.505765 
1 1 1    8    3    8 o  213.919   2.2513  943.753   19.274  945.684   31.318  942.576   24.453  214.084   3.5469  213.755   2.7736 0.3288269 4.502620 
1 1 1    8    3    9 o  247.543   3.2836  1232.40   32.822  1420.66   53.363  1117.83   41.629  262.348   4.9317  232.738   4.3367 29.61020 6.567207 
1 1 1    8    3   10 o  170.307   2.1616  598.140   15.179  592.235   21.169  604.389   21.776  169.442   3.0291  171.171   3.0844 -1.728989 4.323107 
1 1 1    8    3   11 o  583.034   4.8240  7017.52  115.987  6977.56  162.566  7058.96  165.536  581.347   6.7800  584.720   6.8640 -3.372803 9.647958 
1 1 1    8    3   12 o  126.107   2.4565  328.034   12.270  327.953   15.345  328.180   20.435  126.091   2.9506  126.123   3.9284 -0.3169250E-01 4.913068 
1 1 1    8    3   13 o  350.211   3.5522  2540.40   48.516  2560.05   59.715  2502.24   83.215  352.252   4.1102  348.170   5.7948 4.081879 7.104490 
1 1 1    8    3   14 o  170.041   2.4514  593.089   16.477  584.845   20.484  608.201   27.734  168.384   2.9494  171.698   3.9164 -3.313843 4.902782 
1 1 1    8    3   15 o  240.863   2.6752  1194.00   26.284  1177.65   34.584  1216.37   40.443  238.922   3.5096  242.804   4.0385 -3.881287 5.350370 
1 1 1    8    3   16 o  349.257   3.1742  2520.60   45.379  2488.07   68.277  2546.34   60.734  347.221   4.7676  351.293   4.1918 -4.071045 6.348309 
1 1 1    8    3   17 o  155.995   2.5081  500.751   16.115  529.231   23.531  475.597   22.115  160.161   3.5622  151.829   3.5316 8.331665 5.016118 
1 1 1    8    3   18 o  373.897   3.5416  2885.70   54.611  2858.34   76.624  2913.95   77.854  372.097   4.9928  375.697   5.0244 -3.599670 7.083238 
1 1 1    8    3   19 o   25.483   6.8547   9.2210   10.032   6.1870   14.639   11.908   13.776   24.358   9.7020   26.608   9.6860 -2.250055 13.70937 
1 1 1    8    3   20 o  200.923   2.9753  833.616   24.648  855.231   34.759  811.755   34.956  203.546   4.1404  198.299   4.2740 5.247452 5.950610 
1 1 1    8    3   21 o  155.814   2.7537  500.515   17.685  477.809   24.542  525.039   25.505  152.143   3.9111  159.486   3.8774 -7.343628 5.507355 
1 1 1    8    3   22 o  150.414   2.8985  467.128   17.981  463.499   25.377  470.787   25.482  149.827   4.1066  151.001   4.0916 -1.173935 5.797029 
1 1 1    8    3   23 o  240.435   2.7371  1193.40   27.140  1176.74   38.056  1210.64   38.716  238.728   3.8651  242.141   3.8767 -3.413437 5.474239 
1 1 1    8    3   24 o  249.490   3.1543  1286.69   32.441  1299.23   45.279  1273.46   46.502  250.749   4.3782  248.231   4.5421 2.518173 6.308644 
1 1 1    8    3   25 o   74.558   5.2887  113.315   15.928  106.001   20.284  125.077   25.723   71.510   6.8773   77.606   8.0364 -6.095482 10.57736 
1 1 1    8    3   26 o   74.619   5.1750  115.090   15.877  120.819   23.603  110.355   21.456   76.298   7.5005   72.941   7.1321 3.356659 10.35009 
1 1 1    8    3   27 o  125.438   3.5796  322.540   18.298  344.581   28.523  307.126   23.852  129.020   5.3602  121.856   4.7459 7.163826 7.159282 
1 1 1    8    3   28 o   57.786   8.3926   76.595   17.990   58.968   32.720   84.233   21.538   51.962   14.641   63.610   8.2095 -11.64738 16.78513 
1 1 1    8    3   29 o  152.977   3.4333  484.370   21.655  482.363   31.005  486.281   30.257  152.659   4.9243  153.294   4.7856 -0.6342773 6.866673 
1 1 1    8    3   30 o   30.909   8.5455   10.290   17.074   24.227   20.493 -21.3448   30.873   35.074   11.888   26.744   12.279 8.329908 17.09101 
1 1 1    8    3   31 o  164.085   3.1617  556.990   21.395  564.651   30.558  549.624   29.963  165.189   4.4852  162.980   4.4575 2.209610 6.323483 
1 1 1    8    3   32 o  111.479   4.0608  257.632   18.596  290.229   26.799  227.363   25.824  118.303   5.4924  104.655   5.9828 13.64771 8.121563 
1 1 1    8    3   33 o  100.613   4.7692  209.822   19.740  197.421   26.766  224.610   29.229   97.380   6.6641  103.846   6.8242 -6.465591 9.538364 
1 1 1    8    3   34 o   53.917   7.6734   64.348   16.690   42.734   23.693   85.639   23.515   44.039   12.476   63.795   8.9370 -19.75593 15.34683 
1 1 1    8    3   35 o  142.934   4.3945  423.625   25.435  439.082   40.280  413.375   32.801  144.949   6.7377  140.920   5.6435 4.028885 8.788980 
1 1 1    8    3   36 o   57.371   8.9545   80.647   21.324   40.516   33.745  107.327   27.514   43.805   15.241   70.937   9.4041 -27.13247 17.90894 
1 1 1    8    3   37 o   81.359   5.4279  140.340   18.168  127.844   25.445  153.336   25.949   77.583   7.9520   85.136   7.3901 -7.552452 10.85579 
1 1 1    8    3   38 o   81.600   6.9850  151.577   22.265  176.429   29.055  116.224   34.654   90.918   7.7483   72.281   11.624 18.63708 13.96999 
1 1 1    8    3   39 o   96.761   4.6445  197.908   18.492  179.963   25.604  217.476   26.737   92.117   6.7392  101.404   6.3928 -9.287048 9.288929 
1 1 1    8    3   40 o   25.281   7.7686  -2.7026   15.748   10.463   21.894 -16.8167   22.669   28.638   11.700   21.924   10.224 6.713858 15.53713 
1 1 1    8    3   41 o   65.971   6.9958   97.300   19.027   98.432   26.633   96.119   27.191   66.454   9.7171   65.489   10.067 0.9648056 13.99154 
1 1 1    8    3   42 o   26.717   8.0551   1.9500   16.280 -11.5385   23.072   15.326   22.976   23.036   10.591   30.398   12.140 -7.362099 16.11020 
1 1 1    8    3   43 o   61.499   7.7237   89.118   19.029   93.660   25.992   83.871   27.936   64.206   9.8151   58.793   11.928 5.413097 15.44740 
1 1 1    8    3   44 f   36.229   8.7352   29.764   17.001   11.064   24.076   48.359   24.009   28.867   12.075   43.591   12.626 -14.72394 17.47040 
1 1 1    8    3   45 o   24.628   8.0567 -17.2874   20.589   6.1206   27.391 -47.6894   31.216   28.161   12.339   21.094   10.363 7.067286 16.11344 
1 1 1    8    3   46 o   31.011   8.9901   19.393   18.469   10.369   30.407   24.668   23.248   29.703   13.008   32.318   12.413 -2.615433 17.98016 
1 1 1    8    3   47 o   28.280   8.4511   11.620   17.678   25.847   24.860  -2.9344   25.144   32.157   12.695   24.402   11.158 7.755232 16.90214 
1 1 1    8    3   48 o   44.562   9.4872   58.971   18.858   58.305   26.196   59.687   27.170   44.464   13.273   44.659   13.560 -0.1945877 18.97447 
1 1 1    8    3   49 o   36.290   10.767   45.906   28.541   24.930   43.933   61.224   37.543   32.216   14.738   40.364   15.699 -8.148193 21.53322 
1 1 1    8    3   50 o   24.986   8.4883 -20.8249   27.662 -83.5120   46.304   13.961   34.493   21.613   10.912   28.359   13.005 -6.745852 16.97669 
1 1 1    8    4    0 o  216.675   2.1245  968.985   26.839  968.985   26.839  968.985   26.839  216.675   3.0045  216.675   3.0045 0.000000 0.000000 
1 1 1    8    4    1 o  206.044   2.0828  875.782   17.698  865.577   24.800  886.373   25.265  204.822   2.9357  207.267   2.9555 -2.445267 4.165687 
1 1 1    8    4    2 o  231.361   2.3618  1105.24   22.331  1099.61   33.909  1109.54   29.674  230.830   3.5617  231.891   3.1026 -1.060638 4.723511 
1 1 1    8    4    3 o  115.505   2.2493  275.024   10.121  276.096   17.483  274.483   12.413  115.664   3.6647  115.347   2.6092 0.3166275 4.498664 
1 1 1    8    4    4 o  242.307   2.8968  1213.63   28.437  1202.73   44.511  1221.14   36.964  241.365   4.4712  243.250   3.6843 -1.884277 5.793585 
1 1 1    8    4    5 o   79.812   2.1112  131.655   6.8709  132.998   9.0852  129.860   10.502   80.291   2.7435   79.332   3.2096 0.9586639 4.222311 
1 1 1    8    4    6 o  126.611   2.3545  331.582   11.530  333.126   14.065  328.420   20.132  127.074   2.6837  126.148   3.8694 0.9257965 4.708946 
1 1 1    8    4    7 o  162.252   2.1322  542.462   14.109  538.747   18.582  547.519   21.682  161.602   2.7879  162.902   3.2270 -1.300247 4.264497 
1 1 1    8    4    8 o  138.073   2.7657  377.731   15.416  477.720   25.111  317.243   19.531  152.153   4.0014  123.994   3.8190 28.15850 5.531357 
1 1 1    8    4    9 o  267.970   3.4283  1428.10   36.726  1699.02   61.748  1279.81   45.684  286.903   5.2182  249.036   4.4478 37.86742 6.856551 
1 1 1    8    4   10 o  237.189   2.3596  1160.49   23.083  1165.08   32.751  1155.95   32.538  237.656   3.3413  236.722   3.3326 0.9332428 4.719140 
1 1 1    8    4   11 o  640.563   5.2286  8473.33  138.133  8499.07  196.215  8448.04  194.495  641.525   7.4157  639.601   7.3728 1.923828 10.45711 
1 1 1    8    4   12 o  378.486   3.5030  2954.41   54.649  3006.34   78.940  2906.62   75.731  381.674   5.0146  375.297   4.8925 6.376709 7.005907 
1 1 1    8    4   13 o  557.005   4.9494  6402.70  106.927  6395.15  130.600  6418.05  186.228  556.632   5.6887  557.378   8.1008 -0.7462769 9.898702 
1 1 1    8    4   14 o  271.984   2.6688  1517.38   28.842  1494.06   36.088  1558.59   47.986  269.123   3.2512  274.844   4.2332 -5.721008 5.337600 
1 1 1    8    4   15 o  120.006   3.0951  298.428   15.119  305.433   19.965  289.013   23.147  121.670   3.9786  118.341   4.7424 3.328049 6.190299 
1 1 1    8    4   16 o  255.476   2.7792  1348.21   29.002  1335.20   44.078  1358.13   38.513  254.379   4.2012  256.572   3.6394 -2.193466 5.558370 
1 1 1    8    4   17 o  241.848   2.7691  1199.24   27.154  1247.62   42.878  1166.85   35.086  245.882   4.2281  237.813   3.5771 8.069489 5.538230 
1 1 1    8    4   18 o  398.238   3.4326  3279.23   56.049  3324.06   75.571  3224.40   83.562  401.293   4.5659  395.183   5.1268 6.110168 6.865229 
1 1 1    8    4   19 o  216.592   2.5498  968.082   22.777  964.441   32.272  971.696   32.152  216.186   3.6194  216.998   3.5924 -0.8126221 5.099566 
1 1 1    8    4   20 o  249.352   3.0705  1283.80   31.561  1288.79   43.972  1278.50   45.328  249.857   4.2670  248.848   4.4164 1.008896 6.140950 
1 1 1    8    4   21 o  404.580   3.5524  3381.89   58.601  3386.83   77.288  3375.21   89.877  404.977   4.6272  404.183   5.3914 0.7942810 7.104804 
1 1 1    8    4   22 o  288.882   3.0458  1722.30   35.833  1730.30   55.296  1716.50   47.047  289.428   4.6322  288.336   3.9561 1.092743 6.091652 
1 1 1    8    4   23 o  384.047   3.4710  3046.90   54.320  3054.88   83.592  3041.06   71.466  384.421   5.2722  383.673   4.5162 0.7474670 6.942037 
1 1 1    8    4   24 o  189.435   3.4462  740.138   26.717  756.217   40.574  727.830   35.500  191.219   5.1446  187.651   4.5868 3.568069 6.892440 
1 1 1    8    4   25 o  182.231   2.9567  685.759   22.097  682.632   29.683  689.647   33.096  181.783   3.9590  182.679   4.3926 -0.8956757 5.913436 
1 1 1    8    4   26 o  249.027   2.9892  1276.11   30.374  1245.58   39.914  1318.11   46.818  245.538   3.9413  252.515   4.4953 -6.977173 5.978398 
1 1 1    8    4   27 o  119.308   4.7120  289.395   21.303  310.129   39.342  280.794   25.339  122.142   7.8095  116.475   5.2747 5.666977 9.423948 
1 1 1    8    4   28 o  151.816   3.2042  475.137   19.924  463.903   26.515  489.707   30.196  149.785   4.2919  153.847   4.7588 -4.062454 6.408337 
1 1 1    8    4   29 o  134.385   3.2867  373.499   18.202  395.107   26.022  352.797   25.470  138.197   4.5654  130.573   4.7295 7.624130 6.573496 
1 1 1    8    4   30 o  233.792   3.6825  1128.76   35.302  1162.74   53.193  1102.02   47.193  236.880   5.4446  230.705   4.9597 6.174438 7.364902 
1 1 1    8    4   31 o   78.496   5.0166  128.205   16.237  124.830   22.988  131.566   22.936   77.455   7.1958   79.538   6.9918 -2.082298 10.03313 
1 1 1    8    4   32 o   85.845   4.8177  153.191   17.013  168.683   24.439  138.622   23.699   90.079   6.5780   81.611   7.0408 8.467308 9.635489 
1 1 1    8    4   33 o   71.512   6.4438  107.243   18.515   77.537   25.221  141.964   27.268   60.640   10.084   82.385   8.0248 -21.74586 12.88762 
1 1 1    8    4   34 o   91.544   4.8609  175.134   18.331  165.857   25.984  184.326   25.865   89.095   7.0710   93.992   6.6720 -4.896645 9.721874 
1 1 1    8    4   35 o   37.660   8.8607   26.934   17.327   8.8827   24.540   44.879   24.468   30.397   12.399   44.922   12.662 -14.52529 17.72133 
1 1 1    8    4   36 o   43.767   9.5801   32.736   20.606   75.428   33.946   7.8265   25.930   57.067   14.417   30.468   12.619 26.59946 19.16010 
1 1 1    8    4   37 o   31.169   8.5101   11.329   16.628   28.785   23.813  -5.2812   23.229   37.055   12.808   25.283   11.208 11.77146 17.02014 
1 1 1    8    4   38 o   62.656   8.7926   92.118   21.674  101.207   28.013   78.561   34.211   68.081   9.9761   57.231   14.482 10.84975 17.58516 
1 1 1    8    4   39 o  110.136   4.2469  256.101   19.285  262.760   27.214  249.384   27.332  111.614   5.9116  108.658   6.0989 2.955902 8.493745 
1 1 1    8    4   40 o   31.511   8.2789   13.757   16.354  -9.8234   23.451   36.079   22.817   23.822   10.848   39.199   12.510 -15.37697 16.55784 
1 1 1    8    4   41 o   63.889   6.4802   90.251   17.037   83.005   23.932   97.696   24.258   61.132   9.4918   66.646   8.8250 -5.513363 12.96047 
1 1 1    8    4   42 o   22.046   7.2461 -15.4871   16.015 -22.6556   22.668  -8.3426   22.630   20.641   9.8068   23.452   10.670 -2.810472 14.49223 
1 1 1    8    4   43 o   36.780   10.359   27.157   22.322   34.650   39.685   23.690   26.997   39.493   15.890   34.068   13.296 5.424953 20.71879 
1 1 1    8    4   44 o   53.296   8.3006   70.247   17.764   65.464   25.161   75.001   25.084   51.148   12.114   55.444   11.351 -4.295822 16.60120 
1 1 1    8    4   45 o   23.280   7.6471 -11.4315   17.603 -14.9244   26.638  -8.7234   23.455   23.435   10.978   23.125   10.649 0.3102837 15.29414 
1 1 1    8    4   46 o   30.227   8.4703   17.419   16.546   31.279   23.225   3.1324   23.579   34.813   12.591   25.641   11.333 9.172344 16.94069 
1 1 1    8    4   47 o   27.573   8.4490   10.494   17.746   12.317   25.201   8.7014   24.993   28.080   12.071   27.066   11.825 1.014271 16.89793 
1 1 1    8    4   48 o   29.028   8.6004   17.496   17.329   14.443   24.082   20.775   24.955   28.001   11.912   30.055   12.408 -2.053694 17.20077 
1 1 1    8    4   49 o   28.739   9.4721   5.4493   28.081 -16.5614   45.372   19.116   35.752   27.107   13.133   30.371   13.654 -3.263815 18.94430 
1 1 1    8    4   50 o   23.534   8.1625 -26.5671   26.419 -32.8733   43.154 -22.7867   33.412   24.276   11.976   22.792   11.094 1.483885 16.32497 
1 1 1    8    5    0 o  550.515   3.9392  6257.25  126.461  6257.25  126.461  6257.25  126.461  550.515   5.5709  550.515   5.5709 0.000000 0.000000 
1 1 1    8    5    1 o  426.111   3.2077  3747.16   56.346  3794.56   81.174  3703.07   78.276  428.705   4.5908  423.517   4.4812 5.188232 6.415352 
1 1 1    8    5    2 o  352.662   3.0155  2568.58   43.459  2558.31   66.023  2576.44   57.728  352.015   4.5475  353.309   3.9616 -1.293396 6.031065 
1 1 1    8    5    3 o  181.728   2.4501  679.674   17.287  686.879   30.111  676.132   21.113  182.425   4.0020  181.031   2.8277 1.393478 4.900190 
1 1 1    8    5    4 o  303.914   2.7475  1910.69   34.276  1856.61   50.603  1956.54   46.592  299.918   4.0908  307.910   3.6688 -7.991425 5.494978 
1 1 1    8    5    5 o  373.823   3.1531  2883.29   48.065  2875.42   63.344  2893.99   73.793  373.249   4.1147  374.397   4.7788 -1.148010 6.306188 
1 1 1    8    5    6 o  150.649   2.1180  468.440   12.998  469.638   17.105  466.802   19.996  150.882   2.7487  150.416   3.2231 0.4660339 4.235997 
1 1 1    8    5    7 o  452.538   3.8914  4228.27   72.629  4210.56  102.150  4246.37  103.285  451.582   5.4845  453.495   5.5220 -1.912506 7.782827 
1 1 1    8    5    8 o  510.928   4.0254  5383.30   83.766  5428.06  129.330  5350.96  109.943  512.711   6.1159  509.145   5.2355 3.566406 8.050767 
1 1 1    8    5    9 o  116.048   2.1940  278.165   10.369  275.412   15.939  280.185   13.654  115.547   3.3445  116.549   2.8404 -1.001915 4.387906 
1 1 1    8    5   10 o  350.882   3.6764  2545.90   52.369  2570.83   68.455  2510.72   81.317  352.979   4.7021  348.785   5.6528 4.194214 7.352778 
1 1 1    8    5   11 o  324.932   3.1885  2178.39   42.729  2196.16   60.794  2161.03   60.068  326.241   4.5181  323.622   4.5002 2.618805 6.376962 
1 1 1    8    5   12 o  586.629   4.3468  7109.32  101.998  7124.83  129.415  7083.88  165.717  587.550   5.3404  585.707   6.8600 1.843201 8.693618 
1 1 1    8    5   13 o  676.616   5.8369  9452.91  153.204  9442.06  187.156  9474.93  266.726  676.240   6.7102  676.993   9.5525 -0.7526245 11.67378 
1 1 1    8    5   14 o  194.480   2.4362  778.070   18.779  772.389   23.464  788.195   31.323  193.505   2.9400  195.456   3.8855 -1.950577 4.872435 
1 1 1    8    5   15 o  532.933   4.2207  5866.15   91.937  5882.38  122.185  5844.98  139.582  533.824   5.5495  532.043   6.3609 1.780579 8.441416 
1 1 1    8    5   16 o  202.070   2.8078  842.420   23.391  845.321   33.587  839.688   32.596  202.406   4.0233  201.733   3.9176 0.6725922 5.615574 
1 1 1    8    5   17 o  287.840   3.5199  1702.96   40.648  1679.28   51.620  1741.60   65.945  285.250   4.3876  290.430   5.5052 -5.179871 7.039790 
1 1 1    8    5   18 o  333.425   2.8898  2294.23   39.738  2309.24   56.637  2279.69   55.768  334.497   4.1053  332.353   4.0683 2.144440 5.779694 
1 1 1    8    5   19 o  200.896   2.8162  835.184   23.048  818.612   35.293  847.506   30.434  199.140   4.2971  202.652   3.6412 -3.511932 5.632318 
1 1 1    8    5   20 o  233.864   2.8516  1122.28   27.136  1168.98   42.341  1089.72   35.351  237.952   4.3142  229.776   3.7302 8.176300 5.703235 
1 1 1    8    5   21 o  400.741   3.5460  3318.30   57.907  3323.31   76.256  3311.47   88.999  401.151   4.6089  400.331   5.3901 0.8200989 7.091928 
1 1 1    8    5   22 o  159.122   3.0099  525.403   19.653  558.085   27.048  488.849   28.606  164.403   3.9890  153.840   4.5083 10.56235 6.019718 
1 1 1    8    5   23 o  158.866   3.0184  522.078   19.677  528.890   26.618  513.869   29.218  160.025   4.0329  157.707   4.4920 2.317520 6.036743 
1 1 1    8    5   24 f  115.644   3.3165  276.618   15.809  268.471   22.500  284.563   22.219  113.955   4.7871  117.332   4.5913 -3.377457 6.632998 
1 1 1    8    5   25 o   32.620   7.8706   20.390   12.758   17.310   18.056   23.462   18.030   31.119   11.120   34.122   11.141 -3.002544 15.74110 
1 1 1    8    5   26 o   63.980   5.4232   85.677   14.200   93.088   19.517   77.341   20.699   66.977   7.0651   60.983   8.2298 5.994492 10.84638 
1 1 1    8    5   27 o  154.273   4.0437  498.374   24.462  474.973   41.102  511.210   30.440  151.329   6.5854  157.217   4.6944 -5.887634 8.087303 
1 1 1    8    5   28 o   83.896   4.3482  147.644   14.758  114.278   20.797  181.483   20.944   74.187   6.7969   93.606   5.4250 -19.41888 8.696470 
1 1 1    8    5   29 o  153.644   3.4860  493.156   21.635  464.815   33.683  513.058   28.227  149.788   5.4522  157.501   4.3452 -7.712967 6.971916 
1 1 1    8    5   30 o  125.183   4.2392  326.984   21.664  340.431   29.015  310.042   32.568  128.168   5.4889  122.198   6.4619 5.969910 8.478406 
1 1 1    8    5   31 o   86.529   4.6094  155.861   16.385  172.850   23.283  139.195   23.062   91.241   6.1871   81.817   6.8342 9.424088 9.218815 
1 1 1    8    5   32 o   94.551   4.5633  185.688   17.769  200.137   25.494  172.037   24.779   98.143   6.2981   90.959   6.6051 7.184547 9.126514 
1 1 1    8    5   33 o   21.678   7.1343 -20.7801   15.665 -11.7226   22.173 -29.8053   22.134   23.471   10.633   19.885   9.5149 3.585394 14.26860 
1 1 1    8    5   34 o  152.968   3.4453  485.672   21.731  500.452   30.871  471.156   30.596  155.286   4.8201  150.651   4.9241 4.634460 6.890564 
1 1 1    8    5   35 o   31.258   8.7085   11.400   16.862   2.0005   23.265   21.801   24.473   27.605   11.725   34.912   12.879 -7.307026 17.41694 
1 1 1    8    5   36 o   74.124   6.3375  117.912   19.061  112.312   29.287  122.027   25.107   72.345   9.8153   75.903   8.0198 -3.557594 12.67504 
1 1 1    8    5   37 o   40.768   9.0425   37.289   16.996   32.872   24.052   41.695   24.020   38.787   12.877   42.750   12.698 -3.962845 18.08499 
1 1 1    8    5   38 o   70.707   6.4063  108.157   18.420  107.999   28.465  108.271   24.160   70.380   9.8061   71.034   8.2465 -0.6540298 12.81268 
1 1 1    8    5   39 o   49.276   8.4329   56.876   17.163   43.854   23.836   70.899   24.734   43.121   12.607   55.431   11.204 -12.31046 16.86586 
1 1 1    8    5   40 o   26.722   7.9324  -9.6921   17.283 -42.3190   24.125   24.708   24.772   18.777   9.2014   34.666   12.924 -15.88899 15.86484 
1 1 1    8    5   41 o   31.404   8.5053   16.155   16.035   29.248   23.163   4.1085   22.219   36.111   12.624   26.698   11.402 9.412884 17.01068 
1 1 1    8    5   42 o   34.185   8.8650   25.583   16.447   21.504   23.489   29.508   23.038   32.635   12.491   35.735   12.583 -3.100441 17.73004 
1 1 1    8    5   43 o   38.932   10.089   37.436   21.639   20.259   38.482   45.379   26.168   35.591   15.097   42.272   13.387 -6.680347 20.17705 
1 1 1    8    5   44 o   28.355   8.1590   6.5280   16.417 -13.7335   22.884   28.015   23.565   22.118   10.300   34.593   12.657 -12.47473 16.31810 
1 1 1    8    5   45 o   31.158   8.6677   14.385   17.597   39.401   26.538  -5.2443   23.508   38.452   13.508   23.865   10.865 14.58717 17.33533 
1 1 1    8    5   46 o   26.586   7.9142   5.3010   15.962   23.716   22.463 -13.4832   22.687   31.656   12.190   21.517   10.096 10.13976 15.82838 
1 1 1    8    5   47 f   28.441   8.2481   7.7366   17.222 -16.5508   23.554   35.632   25.244   21.140   10.030   35.741   13.096 -14.60081 16.49617 
1 1 1    8    5   48 o   23.941   7.7024  -3.6539   17.174   10.956   24.287 -18.2664   24.289   26.973   11.722   20.909   9.9946 6.063841 15.40486 
1 1 1    8    5   49 o   31.087   9.7523   16.701   27.344 -22.7426   41.291   47.511   36.494   25.517   12.401   36.658   15.055 -11.14148 19.50465 
1 1 1    8    5   50 o   40.570   11.338   74.227   29.113   63.177   46.974   81.119   37.097   36.788   16.138   44.351   15.930 -7.563217 22.67602 
1 1 1    8    6    0 o  138.613   1.8899  396.740   15.267  396.740   15.267  396.740   15.267  138.613   2.6727  138.613   2.6727 0.000000 0.000000 
1 1 1    8    6    1 o  270.983   2.5639  1516.20   28.387  1509.11   43.153  1521.62   37.689  270.411   3.8692  271.555   3.3650 -1.143677 5.127801 
1 1 1    8    6    2 o  190.877   2.1951  750.443   17.085  760.140   26.292  743.356   22.478  191.936   3.3213  189.819   2.8711 2.117310 4.390249 
1 1 1    8    6    3 o  107.228   2.2742  235.637   9.5210  242.162   16.464  232.359   11.670  108.327   3.6849  106.129   2.6661 2.198151 4.548305 
1 1 1    8    6    4 o  375.772   3.1541  2920.69   48.681  2842.83   71.651  2987.45   66.346  371.093   4.6814  380.451   4.2282 -9.358612 6.308154 
1 1 1    8    6    5 o  249.385   2.4761  1281.58   25.162  1272.67   33.057  1293.86   38.796  248.365   3.2271  250.405   3.7565 -2.039261 4.952276 
1 1 1    8    6    6 o   60.130   2.4600   74.454   6.0367   73.632   7.9583   75.568   9.2641   59.742   3.2298   60.518   3.7115 -0.7762909 4.920065 
1 1 1    8    6    7 o   63.712   2.6004   83.402   6.8056   87.421   10.180   80.154   9.1514   65.093   3.7917   62.330   3.5598 2.762707 5.200855 
1 1 1    8    6    8 o  364.828   3.1242  2748.91   46.645  2724.71   70.338  2767.91   62.319  363.381   4.6931  366.275   4.1252 -2.893829 6.248423 
1 1 1    8    6    9 f  176.880   2.2541  646.033   16.260  640.797   24.881  649.937   21.483  176.250   3.4227  177.509   2.9343 -1.259415 4.508292 
1 1 1    8    6   10 o  300.554   2.8059  1863.43   34.470  1865.51   52.386  1861.85   45.777  300.693   4.2240  300.416   3.6945 0.2771912 5.611728 
1 1 1    8    6   11 o  282.887   2.6665  1650.65   30.059  1649.74   37.898  1652.21   49.358  282.796   3.2492  282.978   4.2290 -0.1818237 5.333098 
1 1 1    8    6   12 o  523.593   6.3321  5507.59  102.237  5430.18  111.714  5906.62  253.633  512.952   5.2804  534.234   11.511 -21.28210 12.66422 
1 1 1    8    6   13 o  466.556   4.2985  4516.21   78.761  4568.38   97.779  4419.83  132.907  470.491   5.0388  462.621   6.9656 7.869720 8.597010 
1 1 1    8    6   14 o  348.206   3.1338  2499.18   44.476  2484.08   58.492  2519.87   68.480  346.977   4.0872  349.435   4.7515 -2.458344 6.267555 
1 1 1    8    6   15 o  394.860   3.6392  3216.76   59.239  3257.38   85.343  3179.00   82.292  397.261   5.2087  392.460   5.0839 4.800659 7.278492 
1 1 1    8    6   16 o  195.699   2.7813  789.938   22.444  770.332   31.406  810.403   32.087  193.217   3.9409  198.180   3.9256 -4.962067 5.562503 
1 1 1    8    6   17 o  145.253   3.6126  429.369   21.253  467.540   33.962  404.796   27.249  150.471   5.4723  140.035   4.7179 10.43629 7.225280 
1 1 1    8    6   18 o  102.080   3.1783  214.853   13.359  210.987   18.296  219.266   19.551  101.101   4.3877  103.060   4.5995 -1.959633 6.356640 
1 1 1    8    6   19 o   66.962   4.2919   92.520   11.827   84.103   16.401  101.639   17.070   63.790   6.2336   70.134   5.9012 -6.343952 8.583870 
1 1 1    8    6   20 o  153.501   2.9373  486.408   18.406  486.684   28.113  486.202   24.351  153.528   4.4396  153.475   3.8470 0.5236816E-01 5.874506 
1 1 1    8    6   21 o   51.556   7.1789   60.115   14.293   70.617   18.157   43.002   23.177   58.398   7.5384   44.713   12.220 13.68533 14.35773 
1 1 1    8    6   22 o  143.681   2.9015  426.340   17.194  429.265   24.247  423.382   24.384  144.178   4.0776  143.184   4.1291 0.9939117 5.803098 
1 1 1    8    6   23 o  152.479   3.2620  480.349   20.475  478.026   28.068  482.991   29.934  152.095   4.4744  152.863   4.7479 -0.7681274 6.524022 
1 1 1    8    6   24 o  137.570   3.0225  391.033   17.147  401.636   24.372  380.642   24.128  139.419   4.2384  135.722   4.3102 3.697266 6.045047 
1 1 1    8    6   25 o   59.100   5.7921   75.075   13.166  101.047   18.863   50.402   18.385   69.832   6.5493   48.368   9.5551 21.46459 11.58416 
1 1 1    8    6   26 o   52.513   6.3728   58.720   13.371   68.283   18.973   49.284   18.847   57.302   8.0279   47.723   9.8996 9.578735 12.74559 
1 1 1    8    6   27 o  109.961   5.0849  256.597   22.164  229.419   35.655  273.711   28.294  104.992   8.2338  114.929   5.9690 -9.937057 10.16978 
1 1 1    8    6   28 o  192.865   2.8364  768.944   22.563  769.229   31.900  768.659   31.917  192.901   4.0094  192.829   4.0132 0.7192993E-01 5.672863 
1 1 1    8    6   29 o  193.261   3.0495  770.463   24.173  753.917   32.366  791.333   36.350  190.947   4.1098  195.575   4.5063 -4.628067 6.098927 
1 1 1    8    6   30 o  151.132   3.4018  476.158   21.030  440.258   31.061  506.546   28.577  145.791   5.1655  156.473   4.4281 -10.68205 6.803694 
1 1 1    8    6   31 f   62.857   7.6103   90.567   17.698  103.217   22.047   67.646   29.678   70.378   7.5954   55.336   13.190 15.04206 15.22069 
1 1 1    8    6   32 o   62.938   6.9429   84.853   17.468   95.682   24.561   73.768   24.849   67.596   8.8099   58.280   10.733 9.315601 13.88588 
1 1 1    8    6   33 o   89.942   4.8284  168.682   17.911  168.889   25.448  168.479   25.213   89.992   6.8562   89.891   6.8006 0.1011887 9.656879 
1 1 1    8    6   34 o  120.486   3.9365  302.206   19.524  278.703   27.453  326.256   27.770  115.707   5.7527  125.264   5.3751 -9.557091 7.873076 
1 1 1    8    6   35 o  128.206   5.1318  347.041   26.871  401.385   37.975  292.543   38.029  138.499   6.6479  117.912   7.8196 20.58669 10.26358 
1 1 1    8    6   36 o  179.550   3.7134  672.394   27.442  679.116   40.216  666.537   37.538  180.325   5.4073  178.775   5.0910 1.550217 7.426777 
1 1 1    8    6   37 o   76.080   5.6377  123.355   17.681  129.025   25.323  117.963   24.699   77.810   7.8906   74.350   8.0543 3.460625 11.27531 
1 1 1    8    6   38 o   72.205   5.7681  111.615   17.162  118.484   24.693  105.196   23.869   74.388   8.0482   70.022   8.2649 4.365883 11.53614 
1 1 1    8    6   39 o   97.356   5.5231  209.331   21.183  224.028   26.942  185.536   34.280  102.663   6.3629   92.049   9.0295 10.61479 11.04616 
1 1 1    8    6   40 o   83.397   5.6715  150.608   19.468  138.590   26.698  164.255   28.449   79.809   8.1108   86.985   7.9297 -7.176453 11.34310 
1 1 1    8    6   41 o   99.199   4.5592  210.168   18.649  204.642   26.297  215.760   26.453   97.851   6.5159  100.547   6.3787 -2.696381 9.118350 
1 1 1    8    6   42 o   46.003   8.6374   52.620   17.291   35.789   24.735   68.707   24.182   38.470   13.061   53.536   11.306 -15.06603 17.27482 
1 1 1    8    6   43 o   35.474   8.5952   22.867   17.755  -5.1254   24.415   54.284   25.865   24.848   11.216   46.099   13.027 -21.25053 17.19032 
1 1 1    8    6   44 o   29.754   8.3463   12.047   16.596  -6.8441   23.386   31.212   23.554   23.750   10.822   35.758   12.709 -12.00809 16.69251 
1 1 1    8    6   45 o   54.613   7.8808   74.594   17.150   70.735   24.107   78.549   24.404   52.940   11.379   56.287   10.906 -3.346992 15.76163 
1 1 1    8    6   46 o   36.651   10.026   33.663   20.722   23.238   25.530   53.793   35.476   31.744   12.755   41.559   15.472 -9.814425 20.05111 
1 1 1    8    6   47 o   20.091   6.8533 -24.6488   17.015 -23.3841   23.658 -26.0042   24.491   20.080   9.6674   20.101   9.7165 -0.2019119E-01 13.70654 
1 1 1    8    6   48 o   26.494   8.1368   3.1460   19.003   27.382   24.215 -35.7152   30.663   31.826   12.541   21.163   10.371 10.66261 16.27352 
1 1 1    8    6   49 o   28.536   9.1507   2.5127   24.260 -27.6808   32.581   40.082   36.344   22.433   10.928   34.639   14.681 -12.20551 18.30133 
1 1 1    8    6   50 o   27.787   9.2658   7.5498   26.659   24.167   43.067  -2.7735   33.945   30.314   14.121   25.259   12.001 5.055258 18.53168 
1 1 1    8    7    0 o  646.529   5.2328  8634.23  197.276  8634.23  197.276  8634.23  197.276  646.529   7.4003  646.529   7.4003 0.000000 0.000000 
1 1 1    8    7    1 o  285.796   2.6453  1686.41   30.900  1678.37   46.902  1692.59   41.073  285.181   3.9875  286.411   3.4770 -1.230255 5.290541 
1 1 1    8    7    2 o  419.283   3.4235  3627.16   58.533  3642.01   89.873  3616.21   77.137  419.996   5.1882  418.570   4.4682 1.426361 6.847027 
1 1 1    8    7    3 o  537.390   4.1783  5960.63   91.525  5987.42  140.751  5940.99  120.473  538.376   6.3387  536.403   5.4454 1.973022 8.356550 
1 1 1    8    7    4 o  191.612   2.3807  757.414   18.813  763.999   26.771  750.989   26.444  192.434   3.3730  190.789   3.3605 1.645233 4.761318 
1 1 1    8    7    5 o  536.503   4.1825  5932.63   91.221  5881.54  119.077  6005.20  141.920  533.768   5.4089  539.240   6.3811 -5.472229 8.365081 
1 1 1    8    7    6 o  293.557   2.9027  1777.28   35.132  1751.82   48.896  1804.44   50.512  291.386   4.0685  295.728   4.1413 -4.341736 5.805471 
1 1 1    8    7    7 f  351.497   3.0501  2548.65   43.795  2552.43   66.729  2545.78   58.046  351.715   4.6000  351.279   4.0064 0.4353638 6.100147 
1 1 1    8    7    8 f  308.216   2.9987  1959.93   38.120  1956.60   53.886  1963.27   53.934  307.954   4.2425  308.478   4.2391 -0.5238953 5.997394 
1 1 1    8    7    9 o  299.833   2.7963  1857.88   34.423  1819.91   50.889  1889.91   46.738  296.998   4.1544  302.669   3.7440 -5.671387 5.592499 
1 1 1    8    7   10 o  540.128   4.8296  5977.09   99.641  6149.42  179.777  5900.68  119.711  545.569   7.9895  534.686   5.4284 10.88330 9.659132 
1 1 1    8    7   11 o   51.263   4.2880   53.529   8.9677   49.709   11.694   58.981   13.972   49.074   5.7778   53.451   6.3377 -4.376678 8.576064 
1 1 1    8    7   12 o   99.844   4.9851  205.727   20.529  205.727   20.529   0.0000   0.0000   99.844   4.9851  ?   ?       ?      ? 
1 1 1    8    7   13 o   95.421   2.6385  182.185   9.9266  169.800   12.169  206.813   17.161   90.725   3.2521  100.116   4.1559 -9.390556 5.277089 
1 1 1    8    7   14 o  378.761   3.1467  2956.15   47.402  2944.62   59.553  2976.09   78.308  377.786   3.8220  379.737   4.9999 -1.950806 6.293356 
1 1 1    8    7   15 o  299.384   2.7579  1856.95   33.170  1883.69   42.520  1815.37   53.019  302.167   3.4117  296.600   4.3341 5.567139 5.515815 
1 1 1    8    7   16 o  248.940   2.9348  1273.99   30.049  1342.22   44.563  1217.10   40.691  255.024   4.2367  242.855   4.0624 12.16914 5.869667 
1 1 1    8    7   17 f  139.068   3.1994  400.035   18.310  426.459   25.719  372.878   26.073  143.739   4.3382  134.396   4.7038 9.343399 6.398873 
1 1 1    8    7   18 o   93.561   3.4657  180.315   13.280  177.189   17.693  184.349   20.099   92.641   4.6305   94.481   5.1577 -1.840401 6.931342 
1 1 1    8    7   19 o  238.378   2.6208  1172.74   25.766  1165.81   36.196  1179.85   36.686  237.665   3.6925  239.091   3.7203 -1.425522 5.241672 
1 1 1    8    7   20 o  150.342   2.8113  466.606   17.432  469.109   24.686  464.116   24.619  150.745   3.9705  149.940   3.9810 0.8047333 5.622564 
1 1 1    8    7   21 o  231.487   3.4637  1109.51   32.293  1118.38   41.514  1095.93   51.390  232.708   4.3253  230.266   5.4110 2.441925 6.927317 
1 1 1    8    7   22 o   27.215   7.2447   7.5258   12.084   21.420   17.153  -6.1620   17.025   32.863   10.873   21.567   9.5767 11.29547 14.48931 
1 1 1    8    7   23 f  268.761   3.1776  1492.03   35.190  1474.25   48.592  1511.65   51.031  267.089   4.4110  270.434   4.5751 -3.345245 6.355247 
1 1 1    8    7   24 f   89.111   3.8838  164.336   14.270  162.137   20.339  166.468   20.027   88.519   5.5708   89.702   5.4131 -1.183022 7.767632 
1 1 1    8    7   25 o  157.004   2.9097  509.441   18.839  502.518   26.743  516.261   26.544  155.942   4.1579  158.067   4.0716 -2.124710 5.819456 
1 1 1    8    7   26 o  282.502   3.1238  1650.36   35.991  1647.96   55.149  1652.13   47.501  282.269   4.7370  282.735   4.0734 -0.4659119 6.247560 
1 1 1    8    7   27 o  248.525   2.9907  1276.05   30.350  1270.34   40.143  1283.66   46.370  247.921   3.9258  249.129   4.5128 -1.207611 5.981415 
1 1 1    8    7   28 f  274.039   3.0913  1551.49   34.618  1540.99   45.873  1565.40   52.759  273.014   4.0739  275.063   4.6505 -2.048981 6.182548 
1 1 1    8    7   29 o  106.176   3.7661  233.398   16.454  212.332   22.927  255.771   23.628  101.224   5.4916  111.128   5.1551 -9.904686 7.532159 
1 1 1    8    7   30 o  150.207   3.2126  466.912   19.902  467.065   28.295  466.762   27.998  150.229   4.5666  150.185   4.5199 0.4335022E-01 6.425179 
1 1 1    8    7   31 f  102.760   4.8995  220.301   19.781  221.727   24.548  217.661   33.405  103.375   5.7575  102.145   7.9292 1.230453 9.798992 
1 1 1    8    7   32 o   65.027   7.3060   93.487   18.270  125.258   25.736   61.204   25.942   77.404   8.0613   52.651   12.187 24.75325 14.61207 
1 1 1    8    7   33 o  202.228   3.2789  844.307   27.131  820.526   35.943  875.802   41.364  198.991   4.3794  205.465   4.8811 -6.473999 6.557819 
1 1 1    8    7   34 o   64.669   6.4371   88.323   17.137   95.662   24.508   81.303   23.971   67.344   8.8237   61.995   9.3749 5.348667 12.87427 
1 1 1    8    7   35 o   30.915   9.0540   6.3666   19.553 -14.4684   32.211   18.523   24.605   28.268   12.810   33.562   12.798 -5.293844 18.10802 
1 1 1    8    7   36 o   54.910   8.3345   67.980   18.230   71.556   27.346   65.119   24.458   56.092   12.170   53.728   11.390 2.363586 16.66892 
1 1 1    8    7   37 o   87.179   5.0414  161.890   18.049  150.243   26.071  172.611   25.012   84.017   7.5234   90.341   6.7127 -6.324196 10.08277 
1 1 1    8    7   38 o   55.997   7.6564   71.166   17.035   66.162   24.103   76.162   24.081   53.805   11.224   58.189   10.416 -4.383808 15.31279 
1 1 1    8    7   39 o   25.469   8.2671 -13.3523   19.245 -16.9758   24.680  -7.7305   30.740   23.050   10.721   27.888   12.587 -4.837790 16.53418 
1 1 1    8    7   40 o   28.030   8.2345   5.7643   16.247  -6.3637   22.657   18.603   23.311   24.129   10.856   31.931   12.384 -7.802448 16.46891 
1 1 1    8    7   41 o   21.490   7.0561 -22.1828   15.797 -43.4226   22.166  -0.2588   22.520   17.436   8.5983   25.543   11.190 -8.107109 14.11218 
1 1 1    8    7   42 o   60.600   8.5753   98.045   21.121   44.477   32.059  139.130   28.075   42.035   14.839   79.164   8.5987 -37.12842 17.15063 
1 1 1    8    7   43 o   73.791   5.9840  121.935   18.175  113.937   25.750  129.874   25.656   71.161   8.7736   76.420   8.1398 -5.259216 11.96797 
1 1 1    8    7   44 o   39.033   9.4058   39.567   18.045   40.575   27.414   38.797   23.971   39.309   13.734   38.757   12.855 0.5518265 18.81157 
1 1 1    8    7   45 o   28.109   8.0820   10.428   15.727  -5.8792   22.199   26.860   22.284   23.017   10.509   33.201   12.281 -10.18453 16.16408 
1 1 1    8    7   46 o   24.597   8.1247 -21.3344   22.374   10.957   29.228 -67.0459   34.775   28.907   12.704   20.287   10.131 8.620619 16.24934 
1 1 1    8    7   47 o   34.439   9.1726   32.515   17.733   32.368   24.564   32.674   25.628   34.390   12.860   34.488   13.083 -0.9823227E-01 18.34529 
1 1 1    8    7   48 o   27.857   8.6263  -3.7421   22.176 -52.4189   32.093   40.734   30.677   19.969   9.9339   35.745   14.106 -15.77598 17.25251 
1 1 1    8    7   49 o   35.439   10.178   43.046   23.582   33.756   33.797   51.861   32.921   32.920   14.061   37.958   14.718 -5.038433 20.35532 
1 1 1    8    7   50 o   30.591   9.9477   25.520   28.373   45.573   43.888   11.120   37.190   33.468   15.079   27.713   12.979 5.755512 19.89549 
1 1 1    8    8    0 o  546.635   4.5273  6169.23  144.306  6169.23  144.306  6169.23  144.306  546.635   6.4026  546.635   6.4026 0.000000 0.000000 
1 1 1    8    8    1 o  313.717   2.9962  2030.57   38.762  2012.93   54.246  2048.98   55.408  312.326   4.2110  315.108   4.2634 -2.781342 5.992420 
1 1 1    8    8    2 o  405.058   3.3410  3383.63   55.163  3402.57   84.860  3369.78   72.592  406.015   5.0675  404.101   4.3555 1.914398 6.682046 
1 1 1    8    8    3 o  347.047   2.9964  2486.54   42.501  2475.23   64.530  2495.20   56.481  346.336   4.5175  347.758   3.9379 -1.421844 5.992851 
1 1 1    8    8    4 o  295.758   3.0746  1811.62   35.534  1826.19   43.831  1783.68   60.693  297.526   3.5718  293.990   5.0054 3.535645 6.149137 
1 1 1    8    8    5 o  326.434   2.8884  2196.55   38.426  2186.29   50.536  2210.62   59.163  325.541   3.7638  327.326   4.3823 -1.784943 5.776774 
1 1 1    8    8    6 o  152.603   2.4956  481.844   14.999  475.485   25.212  485.327   18.661  151.814   4.0265  153.392   2.9496 -1.577438 4.991213 
1 1 1    8    8    7 o  186.669   2.8020  714.553   21.228  742.562   33.406  695.584   27.491  189.713   4.2694  183.626   3.6299 6.087189 5.603946 
1 1 1    8    8    8 o  184.692   2.6364  710.641   19.117  680.763   32.097  727.067   23.799  181.642   4.2843  187.742   3.0734 -6.099716 5.272723 
1 1 1    8    8    9 o  655.498   5.3289  8874.95  144.060  8849.97  202.415  8900.59  205.074  654.569   7.4976  656.427   7.5746 -1.858459 10.65777 
1 1 1    8    8   10 o  314.789   2.8995  2042.17   37.277  2060.32   56.953  2028.57   49.304  316.001   4.3698  313.576   3.8122 2.425079 5.798996 
1 1 1    8    8   11 o  358.626   3.4536  2661.34   46.361  2671.43   55.076  2636.80   85.877  359.848   3.7109  357.405   5.8257 2.442871 6.907210 
1 1 1    8    8   12 o  340.446   3.4665  2386.82   45.597  2377.28   55.449  2406.75   80.136  339.442   3.9606  341.451   5.6903 -2.008423 6.932924 
1 1 1    8    8   13 o  158.032   2.3835  516.375   14.894  519.355   18.615  511.071   24.832  158.675   2.8443  157.388   3.8253 1.286835 4.766903 
1 1 1    8    8   14 o  114.559   2.5479  275.891   11.593  291.857   14.790  250.454   18.668  118.946   3.0147  110.172   4.1084 8.773994 5.095769 
1 1 1    8    8   15 o  252.794   2.5627  1324.19   25.966  1343.09   33.156  1294.22   41.758  255.152   3.1506  250.436   4.0428 4.716202 5.125440 
1 1 1    8    8   16 o  142.705   3.1303  421.973   18.344  443.254   25.214  398.046   26.736  146.549   4.1716  138.861   4.6682 7.688477 6.260527 
1 1 1    8    8   17 o  313.312   3.0190  2032.38   38.835  2101.47   53.015  1952.37   57.049  319.091   4.0283  307.533   4.4977 11.55905 6.037930 
1 1 1    8    8   18 o  117.029   3.3673  282.400   16.232  290.556   23.686  275.177   22.290  118.618   4.8415  115.441   4.6814 3.176674 6.734676 
1 1 1    8    8   19 o  247.654   2.8370  1268.10   28.747  1282.50   38.429  1249.80   43.318  249.269   3.7379  246.038   4.2687 3.231232 5.673993 
1 1 1    8    8   20 o   98.340   3.4778  199.778   14.105  199.372   19.816  200.195   20.082   98.240   4.8906   98.440   4.9460 -0.2007294 6.955655 
1 1 1    8    8   21 o  114.888   3.3487  271.850   15.746  279.375   23.936  266.110   20.906  116.274   4.9911  113.503   4.4658 2.770828 6.697387 
1 1 1    8    8   22 o  139.938   3.8757  402.707   20.253  399.547   23.956  410.626   37.923  139.070   4.1765  140.806   6.5300 -1.735809 7.751404 
1 1 1    8    8   23 o  236.564   2.8763  1158.61   27.967  1122.93   40.923  1189.88   38.310  233.119   4.2562  240.009   3.8701 -6.889938 5.752616 
1 1 1    8    8   24 o  112.306   3.3191  260.526   15.366  266.934   22.174  254.606   21.313  113.631   4.7313  110.980   4.6563 2.650635 6.638231 
1 1 1    8    8   25 o   71.885   4.5832  107.150   13.582  111.272   19.268  103.079   19.149   73.265   6.3765   70.504   6.5851 2.760704 9.166409 
1 1 1    8    8   26 f  109.284   4.0708  248.796   18.230  231.270   26.736  264.024   24.922  105.634   6.1366  112.934   5.3505 -7.300377 8.141601 
1 1 1    8    8   27 f   97.556   3.9763  196.075   15.954  180.837   21.628  214.262   23.628   93.423   5.6131  101.690   5.6337 -8.266525 7.952644 
1 1 1    8    8   28 o  112.828   3.8341  261.811   17.665  276.833   27.259  250.934   23.196  115.569   5.7188  110.086   5.1086 5.482498 7.668296 
1 1 1    8    8   29 o  165.336   3.2239  564.047   21.872  550.562   29.326  580.949   32.833  163.140   4.3584  167.533   4.7517 -4.392654 6.447760 
1 1 1    8    8   30 f  126.787   3.5117  332.863   18.357  336.329   26.364  329.601   25.576  127.422   5.0164  126.152   4.9155 1.269867 7.023319 
1 1 1    8    8   31 o   38.830   9.6689   27.488   19.106   20.967   24.909   36.807   29.776   35.088   12.984   42.573   14.331 -7.484650 19.33782 
1 1 1    8    8   32 o  218.168   3.5593  987.932   31.949  976.216   46.694  998.244   43.808  216.904   5.2195  219.432   4.8405 -2.527893 7.118546 
1 1 1    8    8   33 o   80.352   5.2506  134.982   17.390  128.873   24.184  141.523   25.025   78.464   7.4729   82.241   7.3777 -3.776321 10.50117 
1 1 1    8    8   34 o  115.536   4.1904  278.279   19.962  274.201   28.450  282.233   28.015  114.684   6.0147  116.388   5.8361 -1.704544 8.380727 
1 1 1    8    8   35 o   39.952   8.0680   30.185   16.991  -3.2354   23.897   64.353   24.163   26.320   11.529   53.584   11.290 -27.26345 16.13605 
1 1 1    8    8   36 o  113.127   4.2864  267.837   19.909  260.405   26.750  277.066   29.808  111.452   5.8193  114.803   6.2953 -3.351051 8.572890 
1 1 1    8    8   37 o   64.283   6.3661   89.276   16.870   93.212   24.039   85.457   23.680   65.723   8.8682   62.844   9.1359 2.878567 12.73222 
1 1 1    8    8   38 o   46.177   8.1357   49.410   16.161   70.315   23.081   29.305   22.635   55.735   10.424   36.620   12.494 19.11580 16.27146 
1 1 1    8    8   39 o   27.014   8.4082  -4.0584   18.832 -19.8695   27.602   9.7107   25.758   24.057   11.239   29.971   12.509 -5.913759 16.81638 
1 1 1    8    8   40 f   27.324   8.2132   4.9287   16.203   1.3230   22.502   8.8114   23.350   26.026   11.297   28.623   11.925 -2.596722 16.42638 
1 1 1    8    8   41 o   34.410   8.8116   26.005   16.193   21.766   23.585   29.784   22.271   32.899   12.534   35.921   12.388 -3.022278 17.62310 
1 1 1    8    8   42 o   34.903   9.7665   23.948   20.641   28.968   31.752   20.273   27.163   36.758   14.399   33.047   13.199 3.711597 19.53305 
1 1 1    8    8   43 o   41.506   8.5440   42.598   16.559   24.142   23.300   61.431   23.538   33.140   12.498   49.872   11.653 -16.73177 17.08807 
1 1 1    8    8   44 f   30.683   8.8183   17.650   17.734   9.4039   27.159   23.781   23.416   28.929   12.484   32.438   12.458 -3.509418 17.63655 
1 1 1    8    8   45 o   25.600   7.8204   5.9088   15.109   7.0222   21.293   4.7797   21.443   25.896   11.113   25.304   11.006 0.5917606 15.64073 
1 1 1    8    8   46 o   40.270   9.3962   47.340   19.740   25.638   29.234   65.529   26.764   32.562   13.436   47.977   13.139 -15.41495 18.79241 
1 1 1    8    8   47 o   29.537   8.8133   17.716   18.444   20.725   25.516   14.424   26.691   30.312   12.534   28.761   12.394 1.551296 17.62670 
1 1 1    8    8   48 o   38.376   9.8287   44.801   23.023   10.801   32.584   78.695   32.534   28.350   12.862   48.402   14.866 -20.05197 19.65748 
1 1 1    8    8   49 o   25.758   8.4783  -5.8700   22.393   24.858   33.248 -31.3828   30.295   30.533   13.479   20.984   10.288 9.549124 16.95665 
1 1 1    8    8   50 o   34.379   10.408   48.522   27.139   35.736   44.092   56.321   34.436   31.690   14.595   37.069   14.842 -5.378946 20.81577 
1 1 1    8    9    0 o  153.510   2.2654  486.667   20.265  486.667   20.265  486.667   20.265  153.510   3.2038  153.510   3.2038 0.000000 0.000000 
1 1 1    8    9    1 o  103.125   3.0386  186.938   10.849  282.925   24.695  163.982   12.077  117.091   5.1135   89.160   3.2841 27.93068 6.077286 
1 1 1    8    9    2 o  270.669   3.0985  1510.05   33.814  1518.63   53.902  1504.48   43.420  271.289   4.8173  270.049   3.8984 1.239594 6.197090 
1 1 1    8    9    3 f  538.498   4.7113  6011.77   99.798  5902.46  167.960  6071.42  124.075  534.607   7.6174  542.389   5.5463 -7.781982 9.422654 
1 1 1    8    9    4 o  459.123   3.6854  4344.90   68.881  4318.60   90.285  4381.53  106.547  457.487   4.7849  460.759   5.6066 -3.271820 7.370861 
1 1 1    8    9    5 o  212.573   2.7644  938.852   24.047  1003.53   32.789  863.566   35.374  220.559   3.6044  204.588   4.1922 15.97101 5.528713 
1 1 1    8    9    6 o   74.416   2.5240  115.582   7.6527   98.023   11.062  131.700   10.598   68.929   3.8911   79.903   3.2158 -10.97363 5.047988 
1 1 1    8    9    7 o  306.354   2.8077  1940.32   35.324  1889.69   52.053  1983.54   48.092  302.635   4.1702  310.073   3.7605 -7.438263 5.615373 
1 1 1    8    9    8 o  113.081   2.7815  255.921   12.531  293.732   21.164  235.510   15.550  119.316   4.3007  106.847   3.5286 12.46870 5.563000 
1 1 1    8    9    9 o  508.762   4.0037  5350.75   83.563  5258.54  124.209  5427.00  112.944  504.727   5.9666  512.796   5.3401 -8.069397 8.007360 
1 1 1    8    9   10 o  339.841   2.9996  2375.66   41.391  2423.86   64.778  2342.41   53.807  342.730   4.5826  336.952   3.8717 5.778290 5.999191 
1 1 1    8    9   11 o  493.638   4.2605  5074.70   80.093  5146.98   96.641  4916.17  143.127  499.411   4.6918  487.866   7.1130 11.54489 8.521038 
1 1 1    8    9   12 o  333.563   3.0126  2299.92   41.082  2327.77   54.779  2264.11   62.107  335.888   3.9542  331.237   4.5460 4.651550 6.025108 
1 1 1    8    9   13 o  369.784   3.7227  2804.64   52.782  2774.51   63.646  2871.00   94.457  366.686   4.2084  372.882   6.1418 -6.195068 7.445312 
1 1 1    8    9   14 o  308.381   2.7898  1963.46   34.337  1966.81   43.417  1957.86   56.110  308.756   3.4094  308.005   4.4169 0.7510376 5.579658 
1 1 1    8    9   15 o  263.305   2.6189  1438.86   27.673  1467.59   35.461  1394.12   44.253  266.706   3.2237  259.904   4.1282 6.801208 5.237780 
1 1 1    8    9   16 o  124.509   3.3398  319.710   17.122  314.461   23.464  325.689   25.042  123.420   4.6094  125.598   4.8342 -2.177513 6.679535 
1 1 1    8    9   17 o   43.031   6.0385   40.326   10.817   14.259   14.977   68.744   15.638   28.397   10.130   57.666   6.5751 -29.26893 12.07694 
1 1 1    8    9   18 o   36.364   6.3963   26.356   9.2414   20.934   11.350   37.020   15.917   31.295   8.5507   41.433   9.5149 -10.13817 12.79253 
1 1 1    8    9   19 o  162.707   2.8717  544.914   19.120  533.903   25.379  559.368   29.077  160.822   3.8261  164.591   4.2834 -3.769531 5.743388 
1 1 1    8    9   20 o  411.444   3.5527  3497.35   59.696  3492.95   79.056  3503.19   91.056  411.201   4.6614  411.688   5.3626 -0.4875183 7.105343 
1 1 1    8    9   21 o   82.860   4.1445  142.701   14.038  136.534   21.050  147.641   18.840   81.221   6.2837   84.499   5.4058 -3.278633 8.288992 
1 1 1    8    9   22 o  116.137   4.5039  284.748   19.670  292.949   23.607  266.124   35.575  119.036   4.8084  113.239   7.6171 5.797211 9.007790 
1 1 1    8    9   23 o  227.607   2.8740  1064.74   26.705  1033.41   35.107  1107.77   41.139  223.679   3.8054  231.535   4.3080 -7.856171 5.748013 
1 1 1    8    9   24 f  134.993   3.0192  376.612   16.810  375.659   23.751  377.568   23.795  134.822   4.2712  135.164   4.2684 -0.3422241 6.038388 
1 1 1    8    9   25 o  217.194   2.7464  974.749   24.601  961.622   34.720  987.984   34.864  215.724   3.9023  218.665   3.8657 -2.941101 5.492852 
1 1 1    8    9   26 o  143.559   3.5405  428.404   20.858  383.899   29.761  471.363   29.240  136.169   5.2992  150.949   4.6965 -14.78081 7.080902 
1 1 1    8    9   27 o   87.596   4.1463  159.597   14.929  169.961   20.766  148.512   21.476   90.572   5.5590   84.620   6.1534 5.952103 8.292606 
1 1 1    8    9   28 o  133.328   3.5495  367.942   19.284  368.921   29.676  367.226   25.370  133.440   5.3920  133.216   4.6175 0.2242432 7.098909 
1 1 1    8    9   29 o  213.723   3.0794  938.101   26.824  902.689   35.044  988.211   41.686  208.931   4.0667  218.516   4.6253 -9.584869 6.158860 
1 1 1    8    9   30 o  109.004   3.8742  246.380   17.417  248.626   24.659  244.145   24.604  109.502   5.4600  108.507   5.4977 0.9953079 7.748332 
1 1 1    8    9   31 o   39.247   8.5645   24.933   17.799   59.051   26.499  -3.1111   24.025   51.693   12.554   26.802   11.653 24.89158 17.12898 
1 1 1    8    9   32 o  101.032   4.4019  212.423   18.340  209.534   25.690  215.424   26.191  100.334   6.2080  101.730   6.2423 -1.395309 8.803749 
1 1 1    8    9   33 o  110.416   4.2033  254.453   19.057  225.705   26.799  283.863   27.106  104.037   6.2456  116.795   5.6269 -12.75801 8.406508 
1 1 1    8    9   34 o   46.755   9.8384   47.888   20.100   55.617   31.708   42.695   25.988   49.610   14.550   43.900   13.246 5.710850 19.67687 
1 1 1    8    9   35 o   82.408   5.2126  143.493   17.692  135.450   25.085  151.453   24.957   80.048   7.5981   84.767   7.1383 -4.718330 10.42528 
1 1 1    8    9   36 o   41.710   8.9978   39.531   17.191   47.953   23.866   30.452   24.782   45.604   12.374   37.816   13.067 7.787636 17.99567 
1 1 1    8    9   37 o   83.418   5.4704  146.438   18.633  163.888   28.946  134.091   24.348   87.492   8.0216   79.344   7.4402 8.148102 10.94090 
1 1 1    8    9   38 o   29.533   8.4695   11.530   16.108   9.0772   22.739   14.000   22.821   28.687   11.844   30.379   12.110 -1.692244 16.93896 
1 1 1    8    9   39 o   35.482   9.0479   24.783   18.893  -1.1494   29.364   43.103   24.680   28.629   12.651   42.336   12.939 -13.70753 18.09579 
1 1 1    8    9   40 o   23.551   7.8360 -20.1011   18.731 -15.2739   23.004 -29.5987   32.267   22.371   10.387   24.730   11.735 -2.358747 15.67205 
1 1 1    8    9   41 o   37.494   8.0640   30.050   16.149   1.6165   22.975   57.812   22.703   26.042   11.359   48.945   11.450 -22.90255 16.12806 
1 1 1    8    9   42 o   81.465   5.4273  146.203   18.180  154.548   25.320  137.324   26.118   84.110   7.2989   78.819   8.0341 5.291039 10.85455 
1 1 1    8    9   43 o   32.788   8.7065   22.689   16.384   32.997   23.408   12.789   22.939   36.639   12.697   28.937   11.916 7.702259 17.41294 
1 1 1    8    9   44 o   38.902   9.4150   40.209   18.166   43.336   26.489   37.433   24.962   40.053   13.517   37.750   13.110 2.303398 18.82993 
1 1 1    8    9   45 o   27.168   8.2668   6.7504   17.257  -5.5840   24.413   19.069   24.398   23.922   10.959   30.415   12.379 -6.492714 16.53361 
1 1 1    8    9   46 o   27.334   8.5269   7.8936   18.765   5.7892   27.961   9.6181   25.312   27.267   12.179   27.400   11.937 -0.1325645 17.05388 
1 1 1    8    9   47 o   25.158   8.0625   1.5343   18.070   4.3267   24.518  -1.7862   26.736   25.446   11.382   24.871   11.422 0.5745163 16.12504 
1 1 1    8    9   48 o   30.754   9.4355   23.116   22.317   17.194   32.441   28.435   30.748   29.530   13.160   31.978   13.525 -2.447338 18.87094 
1 1 1    8    9   49 o   31.057   9.4759   26.699   22.355   44.550   33.359   12.149   30.117   34.885   14.368   27.229   12.358 7.655729 18.95176 
1 1 1    8    9   50 o   26.791   8.9719   5.2002   26.714  -8.2293   41.340   14.829   35.004   25.745   12.488   27.837   12.886 -2.092482 17.94375 
1 1 1    8   10    0 o  440.032   3.8037  3996.42   97.595  3996.42   97.595  3996.42   97.595  440.032   5.3793  440.032   5.3793 0.000000 0.000000 
1 1 1    8   10    1 o  173.706   2.5717  623.632   18.102  628.771   23.556  616.221   28.291  174.588   3.2713  172.825   3.9689 1.763092 5.143315 
1 1 1    8   10    2 o  413.818   4.0505  3536.68   67.867  3545.03   88.020  3524.44  106.578  414.458   5.1491  413.179   6.2541 1.278778 8.101054 
1 1 1    8   10    3 o  577.776   5.3390  6876.95  123.814  6815.92  157.544  6975.53  200.232  574.538   6.6484  581.013   8.3557 -6.475098 10.67795 
1 1 1    8   10    4 o  229.385   2.8908  1083.19   26.683  1074.68   34.105  1096.61   42.841  228.238   3.6230  230.532   4.5057 -2.293533 5.781642 
1 1 1    8   10    5 o  307.527   2.9945  1951.04   37.976  1935.69   53.197  1966.99   54.230  306.295   4.2110  308.760   4.2585 -2.465271 5.988913 
1 1 1    8   10    6 o  534.325   4.1615  5902.77   91.277  5790.13  135.135  5997.28  123.781  529.602   6.1866  539.047   5.5675 -9.444031 8.322941 
1 1 1    8   10    7 o  192.369   2.3371  764.284   18.472  752.455   27.233  774.363   25.139  190.986   3.4573  193.752   3.1458 -2.765778 4.674273 
1 1 1    8   10    8 o  366.858   3.0031  2782.58   44.312  2750.75   70.805  2803.07   56.813  365.108   4.7020  368.607   3.7370 -3.498566 6.006104 
1 1 1    8   10    9 o  488.270   3.8707  4929.97   77.722  4788.23  113.381  5055.61  106.751  481.618   5.7078  494.922   5.2296 -13.30414 7.741318 
1 1 1    8   10   10 o  603.141   4.6248  7514.60  114.006  7492.96  173.140  7531.17  151.480  602.319   6.9696  603.963   6.0811 -1.643921 9.249541 
1 1 1    8   10   11 o  114.945   3.0151  278.042   13.978  306.970   18.579  240.315   21.217  121.979   3.6930  107.911   4.7671 14.06851 6.030236 
1 1 1    8   10   12 o  420.219   3.5039  3650.70   60.368  3702.85   81.392  3586.93   90.004  423.581   4.6589  416.857   5.2349 6.724152 7.007790 
1 1 1    8   10   13 o  150.337   4.4427  466.448   27.547  466.448   27.547   0.0000   0.0000  150.337   4.4427  ?   ?       ?      ? 
1 1 1    8   10   14 o  257.011   2.9889  1384.52   30.972  1482.30   40.654  1249.26   47.815  268.020   3.6776  246.002   4.7126 22.01752 5.977764 
1 1 1    8   10   15 o  309.749   3.1794  1977.46   40.562  2036.42   59.265  1925.50   55.633  314.080   4.5750  305.418   4.4164 8.662323 6.358892 
1 1 1    8   10   16 o  325.600   3.2994  2184.94   40.042  2179.67   47.360  2198.16   74.982  324.995   3.5332  326.204   5.5731 -1.208527 6.598735 
1 1 1    8   10   17 o  190.930   2.6732  754.761   20.910  774.433   28.203  730.749   31.160  193.712   3.5300  188.148   4.0154 5.563934 5.346468 
1 1 1    8   10   18 o   92.745   3.4383  181.439   12.647  193.120   16.138  162.846   20.360   96.718   4.0454   88.771   5.5608 7.946854 6.876657 
1 1 1    8   10   19 o   85.693   3.8446  149.823   13.500  132.082   17.963  172.849   20.465   79.938   5.4482   91.448   5.4259 -11.50903 7.689156 
1 1 1    8   10   20 o  179.460   2.6771  665.686   18.992  667.464   23.708  662.501   31.728  179.827   3.1965  179.093   4.2953 0.7337036 5.354180 
1 1 1    8   10   21 o  166.497   3.0949  572.794   21.252  565.617   29.900  580.120   30.211  165.443   4.3819  167.551   4.3718 -2.108444 6.189771 
1 1 1    8   10   22 o   80.036   5.7357  132.028   17.468  130.422   20.930  135.713   31.707   79.349   6.3954   80.724   9.5232 -1.375206 11.47136 
1 1 1    8   10   23 o  150.570   2.8381  468.328   17.623  477.450   25.050  459.388   24.798  152.023   3.9952  149.117   4.0320 2.905640 5.676157 
1 1 1    8   10   24 o  229.464   2.8958  1086.88   27.179  1078.08   36.114  1098.38   41.276  228.425   3.8332  230.503   4.3417 -2.077911 5.791700 
1 1 1    8   10   25 o   74.688   5.0281  118.892   14.908  102.942   23.641  129.420   19.208   70.340   8.1490   79.036   5.8924 -8.695923 10.05616 
1 1 1    8   10   26 o   89.046   3.9873  163.812   14.584  185.818   21.215  144.095   20.081   94.715   5.4308   83.378   5.8396 11.33726 7.974610 
1 1 1    8   10   27 o  157.988   2.9974  516.092   19.529  520.946   27.894  511.424   27.350  158.715   4.2612  157.262   4.2166 1.452606 5.994815 
1 1 1    8   10   28 o   53.560   6.9533   61.693   14.781   42.722   20.437   82.499   21.403   44.220   11.195   62.900   8.2501 -18.68002 13.90654 
1 1 1    8   10   29 o  226.741   3.0977  1060.11   28.739  1035.67   38.108  1092.35   43.761  223.764   4.1292  229.719   4.6188 -5.955261 6.195434 
1 1 1    8   10   30 f  127.087   3.5630  335.061   18.651  324.506   26.808  344.963   25.965  125.126   5.1946  129.048   4.8783 -3.922073 7.126099 
1 1 1    8   10   31 o  133.223   4.2740  368.463   23.350  373.724   35.050  364.264   31.310  134.023   6.3408  132.423   5.7326 1.600128 8.548007 
1 1 1    8   10   32 o  185.537   3.6303  714.179   26.959  712.244   34.207  717.351   43.799  185.359   4.4744  185.716   5.7181 -0.3574066 7.260609 
1 1 1    8   10   33 o  158.161   3.4020  519.563   22.185  508.509   31.518  530.418   31.234  156.477   4.8836  159.845   4.7376 -3.368362 6.803969 
1 1 1    8   10   34 o   61.890   8.3296   84.203   20.341   86.306   32.530   82.853   26.066   61.627   13.196   62.153   10.168 -0.5259666 16.65912 
1 1 1    8   10   35 o   48.208   8.2646   53.523   16.466   41.187   23.912   64.647   22.706   42.645   12.670   53.770   10.615 -11.12439 16.52921 
1 1 1    8   10   36 f   80.687   5.2226  138.557   17.342  127.466   24.395  149.889   24.657   77.332   7.6485   84.042   7.1135 -6.710808 10.44520 
1 1 1    8   10   37 o   63.244   6.7914   87.157   17.563   86.314   26.514   87.816   23.444   62.741   10.246   63.747   8.9166 -1.005268 13.58274 
1 1 1    8   10   38 f   46.523   8.5406   51.617   16.538   53.357   23.388   49.877   23.388   47.351   11.969   45.695   12.186 1.656055 17.08112 
1 1 1    8   10   39 o   62.862   6.5899   87.734   17.031   81.609   24.364   93.586   23.815   60.500   9.7639   65.225   8.8528 -4.724503 13.17981 
1 1 1    8   10   40 o   52.616   8.8145   59.677   18.898   36.270   23.338  104.252   32.206   39.093   12.670   66.139   12.258 -27.04655 17.62908 
1 1 1    8   10   41 o   43.513   9.5218   42.104   20.135   76.732   31.700   18.686   26.069   54.726   13.991   32.299   12.920 22.42685 19.04370 
1 1 1    8   10   42 o   27.924   8.3357   8.4646   16.540   12.495   23.185   4.2879   23.602   29.062   11.975   26.787   11.599 2.274641 16.67132 
1 1 1    8   10   43 o   97.953   4.6756  209.620   18.853  223.681   26.646  195.525   26.678  101.441   6.3686   94.465   6.8472 6.976219 9.351110 
1 1 1    8   10   44 o   26.274   7.9084  -2.4807   16.673 -27.1596   22.804   25.863   24.439   19.451   9.3962   33.097   12.723 -13.64544 15.81670 
1 1 1    8   10   45 o   25.657   7.9808  -1.2433   17.313 -20.7446   23.965   20.047   25.040   20.763   9.9257   30.551   12.500 -9.787930 15.96152 
1 1 1    8   10   46 o   38.147   8.9970   40.118   17.603   23.522   24.625   57.462   25.173   31.311   12.545   44.983   12.899 -13.67218 17.99397 
1 1 1    8   10   47 o   24.961   8.5918 -26.1950   27.600 -13.9361   33.114 -54.0890   49.950   24.696   11.767   25.225   12.522 -0.5288963 17.18365 
1 1 1    8   10   48 o   37.615   10.319   49.058   22.794   54.903   34.000   44.285   30.721   38.943   14.997   36.287   14.177 2.656185 20.63757 
1 1 1    8   10   49 o   23.044   7.8305 -12.6079   21.447 -11.2211   32.935 -13.6289   28.260   23.879   11.473   22.209   10.660 1.669817 15.66107 
1 1 1    8   11    0 o  119.305   2.6842  294.480   18.636  294.480   18.636  294.480   18.636  119.305   3.7961  119.305   3.7961 0.000000 0.000000 
1 1 1    8   11    1 o  265.804   2.5761  1456.17   27.903  1448.81   36.682  1466.28   42.986  265.016   3.3559  266.593   3.9094 -1.577820 5.152292 
1 1 1    8   11    2 f  326.073   3.0901  2193.76   41.558  2195.81   58.884  2191.74   58.660  326.224   4.3764  325.922   4.3638 0.3020935 6.180264 
1 1 1    8   11    3 o  249.895   2.6766  1288.21   27.586  1280.15   38.753  1296.49   39.277  249.104   3.7719  250.687   3.7988 -1.583664 5.353292 
1 1 1    8   11    4 o  184.445   2.5459  704.762   18.538  691.546   30.953  712.154   23.149  183.082   4.0991  185.809   3.0206 -2.727051 5.091862 
1 1 1    8   11    5 o  378.047   3.5925  2968.35   53.791  2880.52   88.892  3019.09   67.566  373.568   5.7693  382.526   4.2825 -8.958313 7.185071 
1 1 1    8   11    6 f  423.778   3.7247  3704.40   65.050  3657.63   89.966  3755.64   94.167  420.982   5.1814  426.574   5.3523 -5.591736 7.449442 
1 1 1    8   11    7 o  272.834   3.2040  1547.51   35.454  1604.78   46.604  1468.83   54.627  278.888   4.0516  266.780   4.9646 12.10815 6.408029 
1 1 1    8   11    8 o  488.312   4.1428  4922.12   83.424  4890.82  116.864  4954.64  119.128  486.733   5.8214  489.892   5.8959 -3.158783 8.285522 
1 1 1    8   11    9 o  252.195   2.5836  1309.79   26.664  1330.96   40.454  1293.54   35.456  253.987   3.8618  250.404   3.4331 3.583527 5.167172 
1 1 1    8   11   10 o  261.746   3.4535  1264.48   34.182  1805.95   66.485  1069.93   39.852  295.783   5.4498  227.709   4.2433 68.07376 6.907002 
1 1 1    8   11   11 o  302.039   2.8403  1884.14   34.989  1894.20   46.229  1870.66   53.534  302.996   3.6993  301.081   4.3110 1.915558 5.680595 
1 1 1    8   11   12 o  273.351   2.6346  1539.26   28.704  1532.03   36.163  1551.57   47.190  272.505   3.2176  274.197   4.1727 -1.692413 5.269191 
1 1 1    8   11   13 o  450.849   3.5436  4188.64   63.481  4166.94   79.627  4226.49  105.160  449.319   4.2967  452.379   5.6362 -3.059418 7.087194 
1 1 1    8   11   14 o  377.043   3.1386  2937.23   47.250  2945.22   59.794  2923.94   77.100  377.773   3.8376  376.313   4.9675 1.460083 6.277241 
1 1 1    8   11   15 o  185.296   3.0390  712.268   23.060  743.281   31.233  675.099   34.192  189.765   3.9905  180.826   4.5846 8.938583 6.078048 
1 1 1    8   11   16 o   39.543   5.7488   39.468   8.5311   49.145   10.245   17.579   15.408   48.778   5.0922   30.308   10.308 18.46986 11.49755 
1 1 1    8   11   17 o  245.184   2.7772  1238.72   27.780  1225.92   36.596  1256.14   42.675  243.709   3.6408  246.660   4.1948 -2.950195 5.554453 
1 1 1    8   11   18 o  198.868   2.6014  823.685   20.741  849.195   26.620  784.268   33.089  202.847   3.1818  194.888   4.1166 7.959183 5.202876 
1 1 1    8   11   19 o  184.972   2.9945  702.620   22.759  752.170   34.037  662.550   30.608  190.830   4.3245  179.113   4.1432 11.71741 5.988989 
1 1 1    8   11   20 o  114.869   2.8817  266.835   12.997  254.724   15.920  291.034   22.504  111.070   3.4752  118.668   4.5979 -7.597443 5.763486 
1 1 1    8   11   21 o  130.869   3.1891  355.765   15.129  357.753   17.631  350.214   29.457  131.636   3.2475  130.102   5.4897 1.533737 6.378295 
1 1 1    8   11   22 o  154.115   3.3909  493.780   21.381  466.070   31.790  516.670   28.893  150.117   5.1345  158.114   4.4305 -7.997467 6.781799 
1 1 1    8   11   23 o  218.480   2.9666  987.424   26.269  991.357   34.161  981.734   41.093  219.058   3.7810  217.902   4.5724 1.155975 5.933173 
1 1 1    8   11   24 o   75.559   4.5111  117.661   14.016  108.365   18.979  128.812   20.787   72.297   6.3649   78.821   6.3943 -6.524170 9.022160 
1 1 1    8   11   25 f  164.756   3.2860  561.140   22.288  567.977   32.616  555.151   30.527  165.683   4.7730  163.830   4.5178 1.853210 6.572060 
1 1 1    8   11   26 o   31.835   7.6680   18.296   12.724   7.1187   18.159   29.078   17.836   26.739   10.752   36.931   10.936 -10.19258 15.33603 
1 1 1    8   11   27 o  147.816   3.0690  452.030   18.701  433.955   26.366  470.331   26.530  144.834   4.4137  150.798   4.2655 -5.963715 6.138015 
1 1 1    8   11   28 o   80.718   4.7440  135.499   15.773  138.150   21.889  132.635   22.748   81.558   6.5073   79.877   6.9048 1.680176 9.487939 
1 1 1    8   11   29 o   29.465   7.7385   4.9203   15.467 -29.1010   23.682   30.225   20.424   21.060   10.011   37.870   11.803 -16.81012 15.47692 
1 1 1    8   11   30 o   96.837   4.4692  194.378   17.817  185.834   24.309  204.294   26.189   94.555   6.2334   99.119   6.4062 -4.563438 8.938371 
1 1 1    8   11   31 o   77.061   5.4989  127.652   16.940   95.552   24.611  156.552   23.352   67.437   8.8483   86.685   6.5314 -19.24770 10.99783 
1 1 1    8   11   32 o  109.741   4.8102  251.806   21.155  252.390   26.938  250.867   34.171  110.078   5.9333  109.404   7.5729 0.6738510 9.620435 
1 1 1    8   11   33 o   43.765   7.7143   40.651   16.462   7.3433   23.716   71.617   22.867   29.450   12.121   58.079   9.5463 -28.62820 15.42869 
1 1 1    8   11   34 o   29.142   8.2949   8.0634   15.938  -4.4425   23.287   19.083   21.859   25.631   11.299   32.654   12.147 -7.022413 16.58981 
1 1 1    8   11   35 o   51.469   7.7167   59.840   15.868   60.939   22.779   58.804   22.118   51.913   10.982   51.025   10.844 0.8883858 15.43349 
1 1 1    8   11   36 o   76.907   5.3599  126.149   16.991  126.131   24.462  126.167   23.617   76.855   7.7172   76.959   7.4403 -0.1039276 10.71974 
1 1 1    8   11   37 o   22.749   7.3792 -14.0261   15.909 -23.0219   22.284  -4.6737   22.721   20.671   9.7927   24.826   11.042 -4.154190 14.75846 
1 1 1    8   11   38 o   28.561   8.4589   6.7822   16.918  -0.4894   23.351   14.815   24.544   26.024   11.398   31.098   12.502 -5.073570 16.91782 
1 1 1    8   11   39 o   47.929   8.2828   54.728   16.234   55.540   23.085   53.933   22.835   48.287   11.712   47.571   11.716 0.7158089 16.56565 
1 1 1    8   11   40 o   34.475   9.6083   22.787   20.466   30.492   26.670   11.753   31.918   36.707   13.460   32.244   13.715 4.463192 19.21653 
1 1 1    8   11   41 o   32.630   9.4308   17.315   19.970   23.041   30.490   13.013   26.428   34.682   13.937   30.579   12.709 4.103689 18.86152 
1 1 1    8   11   42 o   31.901   8.7894   20.626   16.695   18.244   23.849   22.915   23.380   31.116   12.387   32.687   12.473 -1.570372 17.57878 
1 1 1    8   11   43 o   19.856   6.7557 -26.0069   16.291 -28.5987   23.057 -23.4228   23.022   19.469   9.4152   20.243   9.6908 -0.7740879 13.51137 
1 1 1    8   11   44 o   30.577   8.4380   16.226   16.276   0.4249   21.845   35.942   24.402   24.308   10.818   36.846   12.953 -12.53855 16.87606 
1 1 1    8   11   45 o   25.444   8.1449   0.3178   18.411  -4.5626   27.327   4.3742   24.913   24.915   11.481   25.972   11.556 -1.057230 16.28977 
1 1 1    8   11   46 o   29.664   8.0069   6.3969   17.260   47.407   24.793 -32.1642   24.041   40.360   13.057   18.968   9.2715 21.39249 16.01387 
1 1 1    8   11   47 o   31.275   10.252   9.2533   28.634 -11.1885   34.424   55.161   51.588   25.250   12.022   37.300   16.611 -12.04950 20.50464 
1 1 1    8   11   48 f   30.285   10.018   11.780   28.108  -4.0473   33.604   48.642   51.285   25.548   12.080   35.022   15.984 -9.473606 20.03517 
1 1 1    8   11   49 o   26.045   11.964 -27.2722   24.536 -110.7620   44.661   8.8197   29.364  ?   ?    26.045   11.964      ?      ? 
1 1 1    8   12    0 o  152.977   2.2587  483.305   20.134  483.305   20.134  483.305   20.134  152.977   3.1942  152.977   3.1942 0.000000 0.000000 
1 1 1    8   12    1 o  295.667   2.7159  1801.00   32.702  1787.67   42.893  1819.50   50.536  294.373   3.5328  296.962   4.1260 -2.589203 5.431865 
1 1 1    8   12    2 o  367.723   3.3404  2785.53   50.575  2713.35   69.163  2868.48   74.143  362.617   4.6245  372.828   4.8217 -10.21136 6.680868 
1 1 1    8   12    3 o  107.669   2.4597  241.984   10.788  264.793   14.632  214.817   15.968  113.298   3.1312  102.040   3.7942 11.25733 4.919381 
1 1 1    8   12    4 o  285.503   2.6741  1685.47   31.347  1638.42   46.223  1725.55   42.654  281.798   3.9770  289.208   3.5759 -7.409760 5.348242 
1 1 1    8   12    5 o  367.398   3.1632  2772.98   47.229  2856.43   73.847  2715.21   61.437  372.037   4.8126  362.760   4.1062 9.277222 6.326325 
1 1 1    8   12    6 o  178.860   2.6056  665.339   19.065  724.223   26.171  598.766   27.828  187.366   3.3866  170.354   3.9606 17.01128 5.211102 
1 1 1    8   12    7 o  323.960   3.4055  2175.70   45.163  2257.54   60.963  2076.15   67.236  330.759   4.4688  317.160   5.1399 13.59894 6.810934 
1 1 1    8   12    8 o  151.814   3.3026  475.459   20.679  475.459   20.679   0.0000   0.0000  151.814   3.3026  ?   ?       ?      ? 
1 1 1    8   12    9 o  507.800   4.3799  5321.05   82.950  5334.02  155.029  5315.84   98.188  508.085   7.3979  507.514   4.6908 0.5708923 8.759719 
1 1 1    8   12   10 o  409.161   4.0342  3468.93   67.527  3354.75  101.265  3560.35   90.615  403.041   6.0918  415.281   5.2905 -12.24011 8.068397 
1 1 1    8   12   11 o  590.413   6.6401  7283.98  131.557  7333.52  148.239  7100.28  285.453  595.855   6.0319  584.971   11.831 10.88422 13.28027 
1 1 1    8   12   12 o  168.884   2.8236  589.802   18.618  592.290   22.921  584.978   31.917  169.429   3.2800  168.338   4.5970 1.090775 5.647220 
1 1 1    8   12   13 o  305.305   3.1209  1941.71   36.134  1969.64   43.457  1879.14   65.042  308.956   3.4103  301.653   5.2278 7.302643 6.241847 
1 1 1    8   12   14 o  239.242   2.9547  1183.69   27.650  1188.38   34.106  1174.71   47.226  239.972   3.4459  238.512   4.8007 1.459900 5.909391 
1 1 1    8   12   15 o  191.268   2.8138  751.664   20.765  745.343   25.191  765.065   36.676  190.051   3.2137  192.484   4.6198 -2.432327 5.627666 
1 1 1    8   12   16 o  149.002   2.6372  464.010   15.880  491.249   20.856  426.434   24.495  154.286   3.2774  143.718   4.1324 10.56851 5.274312 
1 1 1    8   12   17 o  163.065   2.7719  546.029   18.502  526.248   24.512  572.222   28.207  159.661   3.7224  166.470   4.1082 -6.809021 5.543759 
1 1 1    8   12   18 o  163.865   2.5735  550.395   16.720  540.307   20.846  568.588   27.995  161.799   3.1238  165.931   4.0907 -4.131897 5.147026 
1 1 1    8   12   19 o  192.485   3.0184  765.392   23.927  766.979   34.814  763.971   32.941  192.665   4.3811  192.305   4.1531 0.3592682 6.036762 
1 1 1    8   12   20 o  194.480   2.6135  782.809   20.230  787.536   25.508  774.795   33.215  195.312   3.1665  193.648   4.1586 1.663483 5.226933 
1 1 1    8   12   21 o  127.058   3.2200  325.057   15.263  314.091   17.934  353.872   29.070  123.329   3.5257  130.788   5.3891 -7.458618 6.439987 
1 1 1    8   12   22 o  283.564   2.9429  1661.05   33.971  1657.77   44.573  1665.58   52.472  283.278   3.8150  283.850   4.4820 -0.5717773 5.885829 
1 1 1    8   12   23 o  164.131   3.5651  549.287   22.046  537.844   26.158  577.337   40.956  161.331   3.9312  166.930   5.9486 -5.599304 7.130249 
1 1 1    8   12   24 o   99.641   3.7736  206.090   15.454  213.223   21.225  198.042   22.546  101.500   5.0701   97.782   5.5905 3.718002 7.547158 
1 1 1    8   12   25 o   91.270   5.8624  199.347   18.269  230.630   21.746  124.301   33.682  105.554   4.9951   76.986   10.608 28.56772 11.72481 
1 1 1    8   12   26 o  116.510   3.4416  280.069   16.493  311.066   24.024  252.438   22.683  122.598   4.7512  110.422   4.9805 12.17544 6.883283 
1 1 1    8   12   27 o  122.346   3.3869  309.749   17.082  312.976   24.594  306.740   23.745  122.955   4.8496  121.736   4.7292 1.219460 6.773774 
1 1 1    8   12   28 o  149.302   3.3188  459.557   20.359  440.501   27.408  483.017   30.411  145.881   4.5553  152.724   4.8279 -6.842987 6.637667 
1 1 1    8   12   29 o  165.414   3.7918  563.224   25.312  586.999   40.559  548.058   32.394  168.167   5.8477  162.661   4.8286 5.506042 7.583573 
1 1 1    8   12   30 o   31.487   8.7439   13.053   16.599   12.118   23.944   13.918   23.033   31.372   12.436   31.603   12.295 -0.2308331 17.48772 
1 1 1    8   12   31 o  162.963   3.4565  550.806   23.152  547.297   31.412  554.978   34.256  162.436   4.6886  163.490   5.0801 -1.053467 6.913074 
1 1 1    8   12   32 o   46.438   7.9127   42.490   16.919   80.996   25.942   13.990   22.319   61.724   10.190   31.152   12.108 30.57206 15.82536 
1 1 1    8   12   33 o   57.397   8.9546   72.650   20.396   88.028   32.155   62.298   26.383   62.348   12.929   52.446   12.393 9.902214 17.90925 
1 1 1    8   12   34 o   86.106   4.9348  157.040   17.436  141.221   24.907  172.245   24.418   81.719   7.3897   90.493   6.5423 -8.774086 9.869621 
1 1 1    8   12   35 o   81.405   5.0973  140.475   17.067  155.491   24.644  126.637   23.658   85.653   6.9759   77.157   7.4343 8.496040 10.19467 
1 1 1    8   12   36 o   30.282   8.3932   13.335   15.589   5.1755   22.373   21.034   21.734   27.557   11.590   33.007   12.143 -5.449892 16.78644 
1 1 1    8   12   37 o   27.506   8.1688   5.3713   15.966   13.309   22.381  -2.8530   22.782   29.850   11.960   25.161   11.130 4.689381 16.33768 
1 1 1    8   12   38 o   83.168   6.0865  149.451   20.731  172.541   31.587  131.980   27.477   88.718   8.6323   77.619   8.5829 11.09926 12.17305 
1 1 1    8   12   39 o   38.297   8.4384   31.584   16.604   55.540   23.689   8.4508   23.279   48.129   11.981   28.464   11.887 19.66595 16.87688 
1 1 1    8   12   40 o   46.126   8.7794   47.907   18.132   84.159   28.807   24.119   23.335   58.694   12.294   33.559   12.537 25.13540 17.55881 
1 1 1    8   12   41 o   22.269   7.3055 -15.3219   16.296  -3.8685   23.199 -26.4770   22.895   24.555   11.022   19.982   9.5917 4.573288 14.61104 
1 1 1    8   12   42 o   33.675   8.8693   25.037   16.842   15.848   23.532   34.687   24.115   30.065   12.187   37.285   12.889 -7.219940 17.73851 
1 1 1    8   12   43 o   24.869   7.8629  -0.5720   16.528  -0.4555   23.424  -0.6876   23.324   24.919   11.138   24.819   11.102 0.9978485E-01 15.72588 
1 1 1    8   12   44 o   38.829   9.3806   41.844   18.039   41.370   25.089   42.351   25.954   38.686   13.154   38.973   13.377 -0.2868309 18.76123 
1 1 1    8   12   45 o   34.461   9.3849   29.217   19.416   48.816   29.305   13.881   25.922   40.224   14.189   28.697   12.287 11.52684 18.76977 
1 1 1    8   12   46 o   29.205   8.9635   15.995   19.865   20.476   24.383   7.1488   34.258   29.795   12.279   28.614   13.061 1.180801 17.92701 
1 1 1    8   12   47 o   30.752   9.8252   20.094   26.565  -8.3571   54.185   29.096   30.479   29.373   14.259   32.131   13.521 -2.758224 19.65030 
1 1 1    8   12   48 o   26.261   8.7305  -1.2558   24.387 -19.7376   33.503   19.571   35.565   23.165   11.238   29.357   13.364 -6.191216 17.46109 
1 1 1    8   12   49 o   31.869   9.6999   35.200   22.852   39.683   35.298   31.965   29.985   32.638   14.158   31.100   13.263 1.538279 19.39988 
1 1 1    8   13    0 o  321.750   2.6464  2136.22   49.651  2136.22   49.651  2136.22   49.651  321.750   3.7426  321.750   3.7426 0.000000 0.000000 
1 1 1    8   13    1 o  593.613   4.5394  7281.54  110.220  7318.28  146.939  7234.27  166.669  595.377   5.9838  591.849   6.8277 3.527649 9.078787 
1 1 1    8   13    2 o  436.599   3.7821  3932.98   68.075  3885.23   94.652  3984.13   97.979  433.860   5.2895  439.338   5.4072 -5.478577 7.564157 
1 1 1    8   13    3 o  340.646   2.9760  2394.16   41.415  2395.64   63.074  2393.04   54.911  340.725   4.4883  340.566   3.9093 0.1585083 5.952055 
1 1 1    8   13    4 f  249.016   2.9303  1286.52   29.915  1366.31   40.978  1195.47   43.771  257.338   3.8609  240.694   4.4091 16.64374 5.860607 
1 1 1    8   13    5 o  212.073   2.7776  903.398   23.343  845.020   28.818  1014.78   39.807  202.386   3.4524  221.760   4.3523 -19.37431 5.555296 
1 1 1    8   13    6 o  399.025   3.8962  3292.13   63.983  3535.60   90.359  3047.30   90.612  413.861   5.2936  384.189   5.7184 29.67133 7.792445 
1 1 1    8   13    7 o  305.749   3.2787  1933.31   41.221  2105.50   58.274  1760.86   58.316  319.415   4.4234  292.084   4.8407 27.33041 6.557364 
1 1 1    8   13    8 o  211.423   2.3767  921.557   20.567  927.554   31.112  916.902   27.411  212.028   3.5577  210.818   3.1525 1.209610 4.753471 
1 1 1    8   13    9 o  136.730   2.2571  380.380   12.627  428.964   19.413  344.745   16.626  144.192   3.2642  129.267   3.1183 14.92471 4.514297 
1 1 1    8   13   10 o  464.129   3.9952  4445.01   76.396  4367.69  105.245  4531.13  111.071  459.879   5.5487  468.379   5.7496 -8.500244 7.990385 
1 1 1    8   13   11 f  381.502   3.6204  3017.48   51.524  3033.99   61.098  2976.83   95.872  383.423   3.8635  379.581   6.1238 3.842041 7.240712 
1 1 1    8   13   12 o  292.463   2.7067  1763.61   31.473  1758.94   39.534  1771.70   52.010  291.966   3.2830  292.961   4.3044 -0.9953613 5.413479 
1 1 1    8   13   13 o  532.896   4.0240  5872.64   85.750  5888.31  108.770  5846.91  139.382  533.963   4.9389  531.828   6.3543 2.134583 8.047993 
1 1 1    8   13   14 o  287.910   2.8517  1711.42   33.461  1712.75   44.065  1709.60   51.424  288.066   3.7088  287.755   4.3329 0.3105164 5.703459 
1 1 1    8   13   15 o  137.247   2.8843  389.380   15.537  390.476   19.231  387.322   26.362  137.549   3.3899  136.944   4.6674 0.6049194 5.768512 
1 1 1    8   13   16 o  226.665   2.5538  1065.10   23.074  1078.54   29.206  1042.77   37.640  228.607   3.0975  224.724   4.0610 3.882904 5.107520 
1 1 1    8   13   17 f  124.724   3.0358  324.490   14.149  328.960   16.834  313.733   26.115  126.244   3.2331  123.204   5.1392 3.039925 6.071604 
1 1 1    8   13   18 o   93.791   3.5374  183.456   13.561  199.264   18.539  165.267   19.887   98.194   4.5776   89.389   5.3942 8.805031 7.074734 
1 1 1    8   13   19 f   64.389   4.3100   84.372   10.696   81.827   12.900   89.970   19.131   62.906   4.9721   65.872   7.0416 -2.966362 8.620082 
1 1 1    8   13   20 o  217.735   2.6697  980.879   23.067  985.425   28.953  972.980   38.165  218.474   3.2132  216.997   4.2643 1.476959 5.339361 
1 1 1    8   13   21 f   33.728   6.5582   24.439   8.9061   25.106   10.604   22.842   16.408   34.102   7.7191   33.355   10.604 0.7471161 13.11630 
1 1 1    8   13   22 o   84.599   4.3857  147.697   15.117  152.401   23.426  144.340   19.788   85.718   6.6262   83.480   5.7472 2.238029 8.771359 
1 1 1    8   13   23 o   48.643   8.2677   51.580   15.266   52.183   18.075   50.078   28.515   49.238   9.2397   48.049   13.713 1.189816 16.53531 
1 1 1    8   13   24 o   68.719   5.5342   96.843   15.570  112.263   23.757   85.232   20.615   73.443   7.8429   63.995   7.8101 9.447205 11.06841 
1 1 1    8   13   25 o  100.640   3.8315  210.011   15.875  213.220   21.905  206.460   23.041  101.466   5.2342   99.814   5.5968 1.651711 7.662939 
1 1 1    8   13   26 o   49.823   6.7556   52.588   13.548   64.582   19.921   42.268   18.479   55.619   8.6839   44.026   10.351 11.59315 13.51129 
1 1 1    8   13   27 o  102.623   3.8183  218.718   16.085  192.893   22.598  245.236   22.900   96.443   5.6812  108.803   5.1030 -12.35984 7.636556 
1 1 1    8   13   28 o   47.978   7.4634   50.771   14.392   42.386   20.881   58.359   19.864   43.994   11.411   51.962   9.6228 -7.967850 14.92679 
1 1 1    8   13   29 o  174.351   3.2682  624.937   23.361  588.638   31.060  672.222   35.450  168.591   4.4668  180.110   4.7721 -11.51854 6.536444 
1 1 1    8   13   30 o  164.778   3.8299  551.136   25.504  504.198   32.429  627.242   41.293  155.870   5.0443  173.686   5.7644 -17.81508 7.659835 
1 1 1    8   13   31 o   93.314   4.4603  182.100   17.121  170.156   24.506  193.490   23.929   90.270   6.5820   96.359   6.0211 -6.088280 8.920573 
1 1 1    8   13   32 o   76.444   5.6674  122.053   17.690  130.546   27.352  115.947   23.193   78.623   8.4349   74.266   7.5718 4.356926 11.33489 
1 1 1    8   13   33 o   91.051   7.0445  176.359   25.895  169.067   33.104  187.855   41.566   88.991   9.0192   93.110   10.824 -4.119850 14.08892 
1 1 1    8   13   34 o   77.519   5.3421  127.200   16.925  151.818   24.714  105.456   23.227   84.699   7.0746   70.340   8.0063 14.35920 10.68411 
1 1 1    8   13   35 o   86.646   4.8196  159.376   17.181  147.136   24.348  171.516   24.246   83.230   7.0927   90.062   6.5274 -6.832047 9.639138 
1 1 1    8   13   36 o   28.478   7.9050   3.6010   15.443   28.616   22.413 -19.0070   21.307   36.150   12.430   20.806   9.7697 15.34315 15.80990 
1 1 1    8   13   37 o   39.092   8.3012   31.813   16.319   8.1821   22.153   59.849   24.130   27.983   11.633   50.200   11.845 -22.21715 16.60243 
1 1 1    8   13   38 o   37.925   8.9417   29.122   17.134   52.528   26.887   13.115   22.234   46.257   13.351   29.593   11.898 16.66370 17.88336 
1 1 1    8   13   39 o   41.196   8.7466   41.455   16.257   34.194   23.551   48.064   22.468   37.935   12.745   44.458   11.982 -6.522449 17.49327 
1 1 1    8   13   40 o   31.174   9.5887  -4.3573   21.086   36.075   40.377 -19.5177   24.725   40.083   16.063   22.264   10.476 17.81960 19.17746 
1 1 1    8   13   41 o   44.670   9.4589   53.176   19.109   60.102   24.084   41.406   31.398   49.090   11.997   40.249   14.627 8.841251 18.91770 
1 1 1    8   13   42 o   25.641   7.7460  -4.7638   16.296   23.248   23.494 -30.7354   22.622   32.331   12.462   18.952   9.2029 13.37943 15.49207 
1 1 1    8   13   43 o   43.524   9.5114   51.247   18.347   47.786   23.075   57.194   30.250   42.390   12.407   44.657   14.420 -2.267220 19.02271 
1 1 1    8   13   44 o   30.415   8.9450   19.034   18.802   11.132   27.815   25.684   25.514   28.552   12.474   32.278   12.824 -3.725576 17.89008 
1 1 1    8   13   45 o   41.678   10.371   41.213   23.795  101.732   40.393   9.0479   29.448   55.060   16.492   28.295   12.578 26.76500 20.74111 
1 1 1    8   13   46 o   30.239   9.3057   1.9578   24.454 -42.4586   33.198   54.647   36.157   21.312   10.512   39.166   15.359 -17.85421 18.61149 
1 1 1    8   13   47 o   32.565   10.163   31.297   26.262   19.190   51.949   35.454   30.438   31.590   14.961   33.539   13.759 -1.949215 20.32618 
1 1 1    8   13   48 o   22.865   7.8027 -24.5851   21.591   14.200   33.314 -52.6757   28.351   27.778   12.754   17.952   8.9925 9.825281 15.60539 
1 1 1    8   14    0 o  161.577   1.9655  538.936   18.512  538.936   18.512  538.936   18.512  161.577   2.7797  161.577   2.7797 0.000000 0.000000 
1 1 1    8   14    1 o   62.754   2.4896   81.157   6.4397   85.082   9.2721   77.500   8.9506   64.218   3.5007   61.289   3.5408 2.928543 4.979181 
1 1 1    8   14    2 o  290.108   2.8729  1735.03   34.348  1775.61   49.775  1698.14   47.459  293.342   4.1140  286.875   4.0111 6.466919 5.745804 
1 1 1    8   14    3 o  172.117   2.3218  611.031   16.480  618.832   23.542  603.535   23.078  173.193   3.2957  171.040   3.2714 2.153397 4.643606 
1 1 1    8   14    4 o  233.055   2.4229  1123.48   23.197  1083.74   34.006  1158.06   31.723  229.186   3.5975  236.925   3.2464 -7.738815 4.845758 
1 1 1    8   14    5 o   91.659   2.3372  172.807   8.7921  150.098   12.097  198.233   12.800   85.294   3.4387   98.024   3.1661 -12.73034 4.674324 
1 1 1    8   14    6 o   87.972   2.3477  159.277   8.4824  180.809   12.316  139.848   11.699   93.615   3.1898   82.328   3.4455 11.28694 4.695325 
1 1 1    8   14    7 o  195.602   2.6812  792.976   21.497  892.509   30.356  692.849   30.446  207.977   3.5389  183.228   4.0288 24.74908 5.362365 
1 1 1    8   14    8 o  168.244   2.5795  588.760   17.754  639.295   24.350  531.399   25.943  176.022   3.3540  160.466   3.9198 15.55554 5.158948 
1 1 1    8   14    9 o  323.598   3.0912  2122.45   40.544  2366.63   64.848  1965.75   51.948  338.582   4.6438  308.615   4.0812 29.96716 6.182304 
1 1 1    8   14   10 f  133.663   2.8475  368.480   15.562  370.796   23.650  366.712   20.666  134.025   4.2783  133.300   3.7589 0.7251587 5.695018 
1 1 1    8   14   11 o  150.566   3.0016  471.190   17.247  476.528   20.830  459.550   30.758  151.962   3.3234  149.170   4.9993 2.792435 6.003111 
1 1 1    8   14   12 o  134.085   3.0072  361.049   13.919  353.023   15.742  389.801   29.797  130.803   2.9180  137.367   5.2592 -6.563446 6.014440 
1 1 1    8   14   13 o  195.378   2.4157  786.800   18.790  783.984   23.642  791.628   30.961  194.923   2.9407  195.833   3.8333 -0.9094849 4.831339 
1 1 1    8   14   14 o  331.074   3.5895  2272.62   48.834  2399.12   67.534  2133.98   70.699  340.797   4.8046  321.352   5.3342 19.44516 7.178978 
1 1 1    8   14   15 o  207.839   2.6228  894.767   22.343  921.655   30.236  862.419   33.164  211.304   3.4693  204.373   3.9344 6.931168 5.245537 
1 1 1    8   14   16 o  114.212   2.6767  267.448   12.105  262.724   15.068  276.046   20.326  112.819   3.2383  115.605   4.2630 -2.785927 5.353484 
1 1 1    8   14   17 o   89.834   3.1298  172.808   10.936  187.732   13.742  147.029   18.061   95.350   3.4943   84.317   5.1936 11.03284 6.259695 
1 1 1    8   14   18 o  222.631   2.7354  1022.00   24.894  1010.55   32.989  1037.15   37.939  221.207   3.6158  224.054   4.1055 -2.846390 5.470789 
1 1 1    8   14   19 o  132.423   2.6687  369.210   14.036  391.220   17.919  334.265   22.579  137.659   3.1560  127.186   4.3042 10.47389 5.337334 
1 1 1    8   14   20 o  210.858   3.2410  920.307   27.760  925.785   36.303  912.594   43.077  211.661   4.1585  210.055   4.9722 1.606079 6.481957 
1 1 1    8   14   21 o  189.419   3.0348  741.179   23.658  749.681   34.707  733.800   32.334  190.419   4.4192  188.419   4.1607 2.000259 6.069634 
1 1 1    8   14   22 f  335.818   3.4851  2319.31   43.245  2301.95   50.804  2365.00   82.396  333.793   3.6903  337.844   5.9132 -4.050903 6.970221 
1 1 1    8   14   23 o   54.171   5.2974   57.708   10.675   53.751   12.437   68.784   20.806   50.920   5.9219   57.422   8.7852 -6.501949 10.59474 
1 1 1    8   14   24 o   83.768   8.1149  185.348   15.840  196.679   16.971  108.751   44.125   97.525   4.2191   70.010   15.672 27.51438 16.22975 
1 1 1    8   14   25 o   66.102   4.6547   89.564   11.180   88.274   12.986   93.256   21.974   65.302   4.8216   66.901   7.9635 -1.599358 9.309452 
1 1 1    8   14   26 o  110.313   3.4203  256.316   14.459  264.289   17.623  239.889   25.295  113.069   3.7789  107.557   5.7021 5.512375 6.840564 
1 1 1    8   14   27 o   82.599   4.9239  141.782   16.759  150.707   24.124  133.458   23.298   85.117   6.8718   80.080   7.0540 5.037575 9.847853 
1 1 1    8   14   28 o  115.919   3.7052  278.810   17.684  275.773   25.704  281.539   24.366  115.299   5.4052  116.539   5.0693 -1.240494 7.410395 
1 1 1    8   14   29 o  103.397   4.5638  219.140   19.273  198.548   25.198  248.167   29.918   97.668   6.2553  109.127   6.6471 -11.45900 9.127607 
1 1 1    8   14   30 o   67.336   6.3181   96.867   17.222   87.509   26.209  103.978   22.848   64.270   9.8874   70.401   7.8686 -6.130936 12.63626 
1 1 1    8   14   31 o   78.745   5.1775  129.851   16.797  132.998   24.436  127.032   23.128   79.627   7.4405   77.863   7.2018 1.764946 10.35506 
1 1 1    8   14   32 o   29.712   9.1241   2.1984   18.610  -9.4559   38.100   5.8505   21.328   31.839   14.220   27.585   11.437 4.253668 18.24820 
1 1 1    8   14   33 o   35.465   8.7753   22.832   18.642   43.066   22.863 -17.3081   32.202   43.470   12.235   27.461   12.583 16.00896 17.55058 
1 1 1    8   14   34 o   91.509   4.6169  176.852   17.393  191.813   24.952  162.713   24.258   95.332   6.3461   87.686   6.7075 7.646362 9.233807 
1 1 1    8   14   35 o   28.834   8.2472   10.349   15.160   11.132   22.409   9.6881   20.586   29.494   11.915   28.175   11.406 1.319706 16.49432 
1 1 1    8   14   36 o   24.084   7.5510  -4.7867   15.053   3.2847   21.934 -11.9722   20.695   26.401   11.303   21.767   10.016 4.634157 15.10206 
1 1 1    8   14   37 o   36.181   8.6640   26.659   16.916   47.228   24.082   6.6235   23.768   44.208   12.597   28.153   11.899 16.05480 17.32807 
1 1 1    8   14   38 o   62.711   6.8522   86.817   17.600   95.413   26.890   80.376   23.278   65.249   9.9918   60.173   9.3795 5.075989 13.70441 
1 1 1    8   14   39 o   57.961   7.1614   78.051   16.585   69.477   24.031   85.850   22.919   53.931   11.171   61.991   8.9641 -8.059414 14.32277 
1 1 1    8   14   40 o   29.943   8.6749   12.010   17.774   24.289   24.531  -1.5604   25.788   33.576   12.785   26.311   11.728 7.265017 17.34971 
1 1 1    8   14   41 o   29.694   8.9619   6.4326   18.632  -3.4768   22.954   25.573   31.902   24.355   10.946   35.033   14.194 -10.67805 17.92381 
1 1 1    8   14   42 o   58.408   7.7300   82.476   18.002  111.492   27.070   59.466   24.106   69.013   9.5102   47.804   12.189 21.20880 15.46000 
1 1 1    8   14   43 o   26.538   8.0772   7.9951   16.001   9.0432   22.776   6.9736   22.485   26.884   11.514   26.191   11.331 0.6937180 16.15433 
1 1 1    8   14   44 f   24.579   7.8750  -0.7687   17.221   0.9470   24.280  -2.5055   24.428   24.935   11.227   24.224   11.046 0.7108479 15.74998 
1 1 1    8   14   45 o   32.170   9.2379   26.752   19.139   26.869   26.054   26.614   28.208   32.126   12.893   32.213   13.234 -0.8742523E-01 18.47587 
1 1 1    8   14   46 o   23.487   8.0030 -20.1507   22.812 -12.7548   34.140 -26.1159   30.661   24.901   11.888   22.074   10.718 2.827591 16.00599 
1 1 1    8   14   47 o   28.050   9.4827  -1.5166   25.722   40.699   51.388 -15.6296   29.712   33.455   15.531   22.645   10.885 10.80997 18.96546 
1 1 1    8   14   48 o   24.432   8.5354 -22.9524   28.367 -24.6572   33.700 -18.8078   52.544   22.319   10.924   26.545   13.118 -4.226114 17.07074 
1 1 1    8   15    0 o  123.268   2.6774  314.341   19.209  314.341   19.209  314.341   19.209  123.268   3.7864  123.268   3.7864 0.000000 0.000000 
1 1 1    8   15    1 o  481.129   4.0812  4780.86   80.985  4788.48  114.822  4773.32  114.241  481.510   5.7817  480.749   5.7615 0.7603149 8.162303 
1 1 1    8   15    2 o  444.078   3.8322  4072.25   70.190  4067.79   99.172  4076.73   99.355  443.835   5.4175  444.322   5.4216 -0.4868469 7.664407 
1 1 1    8   15    3 o  183.697   2.5995  701.420   19.551  763.163   26.923  632.537   28.437  192.320   3.3942  175.073   3.9382 17.24715 5.199058 
1 1 1    8   15    4 o  151.461   2.2654  473.287   14.151  477.324   20.102  469.322   19.925  152.101   3.2044  150.821   3.2031 1.280304 4.530781 
1 1 1    8   15    5 o  296.076   2.9130  1807.58   35.546  1850.54   51.477  1768.42   49.142  299.432   4.1682  292.719   4.0704 6.713470 5.825997 
1 1 1    8   15    6 o  197.653   2.3085  808.035   18.770  769.548   27.117  843.436   26.007  193.119   3.4044  202.187   3.1186 -9.068130 4.616932 
1 1 1    8   15    7 o  235.318   2.4738  1143.74   23.889  1131.75   35.513  1153.64   32.286  234.183   3.6768  236.452   3.3106 -2.269836 4.947599 
1 1 1    8   15    8 o  281.214   2.6861  1634.44   31.007  1607.32   45.941  1657.14   42.022  279.056   3.9915  283.372   3.5955 -4.315277 5.372155 
1 1 1    8   15    9 o  398.116   3.3281  3269.29   53.980  3295.59   83.244  3250.20   70.909  399.457   5.0527  396.776   4.3330 2.681061 6.656157 
1 1 1    8   15   10 o   44.178   6.6359   47.251   11.361   58.633   13.892   24.259   19.744   53.256   6.3245   35.101   11.668 18.15489 13.27175 
1 1 1    8   15   11 o   80.739   2.9316  135.611   9.5470  139.832   12.384  129.429   14.988   82.309   3.6480   79.169   4.5901 3.140770 5.863242 
1 1 1    8   15   12 o  222.848   2.9333  1012.80   23.425  1000.26   27.014  1050.80   47.033  220.168   2.9748  225.529   5.0564 -5.360352 5.866572 
1 1 1    8   15   13 o  377.482   3.2734  2944.19   50.433  2948.99   66.717  2937.80   77.037  377.886   4.2806  377.078   4.9534 0.8085022 6.546744 
1 1 1    8   15   14 o  233.180   2.8297  1117.82   24.746  1110.94   29.365  1134.69   45.963  232.010   3.0687  234.350   4.7553 -2.338989 5.659492 
1 1 1    8   15   15 f  219.187   2.5076  988.031   21.754  978.221   27.114  1005.76   36.445  217.702   3.0197  220.672   4.0042 -2.970123 5.015215 
1 1 1    8   15   16 o   63.803   4.1253   84.003   10.738   68.107   14.712  102.123   15.708   57.347   6.2201   70.259   5.4207 -12.91108 8.250675 
1 1 1    8   15   17 o  163.717   2.5148  561.423   16.408  586.816   20.953  521.165   26.382  168.604   3.0130  158.831   4.0273 9.772995 5.029631 
1 1 1    8   15   18 o  220.210   2.7145  1000.29   24.453  991.199   32.499  1012.15   37.126  219.081   3.5967  221.340   4.0667 -2.259369 5.429037 
1 1 1    8   15   19 o  350.753   3.0358  2559.74   43.130  2639.13   56.429  2448.21   66.885  357.418   3.8279  344.089   4.7129 13.32910 6.071636 
1 1 1    8   15   20 o   68.530   4.2830   98.961   11.443  102.656   14.199   92.115   19.329   70.443   4.8871   66.616   7.0351 3.826820 8.566031 
1 1 1    8   15   21 o   35.877   5.9149   31.658   8.8875   41.126   10.753   11.245   15.788   44.553   5.8518   27.201   10.281 17.35183 11.82974 
1 1 1    8   15   22 o   95.124   3.1739  186.537   11.886  185.072   14.728  189.274   20.130   94.632   3.7735   95.616   5.1045 -0.9838257 6.347821 
1 1 1    8   15   23 o  214.871   3.4690  959.700   29.967  937.119   47.776  974.347   38.478  212.686   5.4463  217.056   4.2981 -4.369629 6.937967 
1 1 1    8   15   24 o  146.752   4.6322  438.669   18.905  435.678   20.250  458.963   52.754  145.215   3.3810  148.289   8.6254 -3.073608 9.264402 
1 1 1    8   15   25 o   36.134   6.7565   23.853   9.3962   17.962   10.916   40.702   18.461   29.086   8.5392   43.183   10.473 -14.09741 13.51295 
1 1 1    8   15   26 o  123.040   4.0283  317.220   20.179  290.348   30.291  338.660   27.056  118.240   6.2112  127.841   5.1313 -9.601120 8.056674 
1 1 1    8   15   27 o  204.240   3.2051  862.671   26.928  849.965   36.652  877.574   39.694  202.635   4.3855  205.846   4.6754 -3.211807 6.410293 
1 1 1    8   15   28 o   37.101   6.9478   33.378   10.625   39.284   11.992   11.829   22.908   43.421   6.6964   30.781   12.176 12.64003 13.89565 
1 1 1    8   15   29 o  160.008   4.9792  531.503   32.860  531.503   32.860   0.0000   0.0000  160.008   4.9792  ?   ?       ?      ? 
1 1 1    8   15   30 o   72.912   5.9775  107.781   17.561  147.023   27.767   81.619   22.672   83.632   8.0499   62.192   8.8387 21.44052 11.95503 
1 1 1    8   15   31 o   73.842   5.6926  115.184   17.298  105.153   24.154  125.746   24.784   70.484   8.3086   77.199   7.7839 -6.714676 11.38516 
1 1 1    8   15   32 o   74.075   7.5698  128.629   20.564   94.416   33.653  149.016   25.978   64.213   13.149   83.937   7.5038 -19.72347 15.13959 
1 1 1    8   15   33 o   19.049   6.5147 -32.7488   15.545 -34.1352   23.092 -31.6000   21.021   19.514   9.4335   18.583   8.9874 0.9313259 13.02935 
1 1 1    8   15   34 o   50.795   8.2218   59.060   16.784   63.388   25.145   55.582   22.541   52.383   11.908   49.206   11.340 3.177284 16.44370 
1 1 1    8   15   35 o   82.990   5.1794  148.697   17.542  125.424   24.901  171.623   24.715   76.229   7.9202   89.751   6.6765 -13.52161 10.35885 
1 1 1    8   15   36 o   90.773   4.7475  176.183   17.767  182.906   25.382  169.724   24.880   92.499   6.6530   89.046   6.7743 3.453239 9.494908 
1 1 1    8   15   37 o   35.702   8.9453   28.083   16.668   22.119   24.190   33.476   23.000   33.477   12.708   37.927   12.593 -4.450584 17.89066 
1 1 1    8   15   38 o   32.136   9.3232   16.621   19.205   22.375   22.562   1.4848   36.594   32.809   12.314   31.463   14.002 1.345663 18.64637 
1 1 1    8   15   39 o   30.375   9.0377 -12.7385   18.727   45.508   36.472 -33.5919   21.823   42.376   15.705   18.374   8.9490 24.00172 18.07542 
1 1 1    8   15   40 o   43.479   9.1582   47.840   17.637   55.993   26.422   41.287   23.686   46.561   13.169   40.397   12.730 6.163834 18.31641 
1 1 1    8   15   41 o   26.941   8.3325   4.6923   17.541   5.0916   23.738   4.2120   26.033   26.614   11.578   27.268   11.987 -0.6547737 16.66507 
1 1 1    8   15   42 o   66.171   6.1619  101.265   16.761   94.116   23.929  108.150   23.485   63.526   9.1330   68.816   8.2743 -5.289101 12.32376 
1 1 1    8   15   43 o   24.918   7.8731   1.7320   16.561   5.9560   23.829  -2.2142   23.032   26.058   11.461   23.778   10.798 2.280392 15.74629 
1 1 1    8   15   44 o   24.198   7.7171  -3.7343   16.944   12.172   23.914 -19.7688   24.010   27.618   11.813   20.779   9.9336 6.838833 15.43412 
1 1 1    8   15   45 o   26.630   8.6319   1.3253   21.096   16.319   32.941  -9.0999   27.467   29.740   13.256   23.520   11.059 6.220404 17.26387 
1 1 1    8   15   46 o   32.901   9.6524   32.043   24.411 -11.5093   45.811   49.314   28.848   27.481   13.285   38.321   14.006 -10.84005 19.30484 
1 1 1    8   15   47 o   19.345   6.8069 -44.6962   21.318 -60.2929   33.712 -34.3043   27.518   19.299   9.6867   19.391   9.5657 -0.9184456E-01 13.61380 
1 1 1    8   16    0 o  394.672   3.5175  3215.83   80.947  3215.83   80.947  3215.83   80.947  394.672   4.9746  394.672   4.9746 0.000000 0.000000 
1 1 1    8   16    1 o  459.658   3.9443  4329.17   74.091  4613.53  114.109  4121.92   97.420  472.565   5.8546  446.752   5.2871 25.81345 7.888542 
1 1 1    8   16    2 f  208.941   2.4574  900.865   21.177  897.092   29.928  904.650   29.970  208.503   3.4801  209.380   3.4704 -0.8769073 4.914788 
1 1 1    8   16    3 f  636.483   4.8509  8364.50  125.793  8445.15  194.023  8306.01  165.223  639.004   7.3618  633.961   6.3189 5.043579 9.701799 
1 1 1    8   16    4 o  186.551   2.6206  721.787   20.039  807.740   28.187  633.955   28.493  197.845   3.4543  175.257   3.9419 22.58795 5.241218 
1 1 1    8   16    5 o  335.145   2.9472  2322.51   40.530  2278.74   60.141  2358.93   54.859  332.229   4.3890  338.061   3.9345 -5.832031 5.894382 
1 1 1    8   16    6 o  541.097   4.2248  6045.73   93.210  6084.55  143.244  6017.21  122.753  542.517   6.4017  539.677   5.5148 2.839722 8.449581 
1 1 1    8   16    7 o  231.825   2.5980  1108.03   24.825  1141.51   35.910  1077.39   34.356  235.174   3.7022  228.476   3.6458 6.698349 5.196002 
1 1 1    8   16    8 o  376.256   3.4194  2919.87   52.983  2857.65   72.631  2990.65   77.460  371.988   4.7340  380.523   4.9355 -8.534607 6.838865 
1 1 1    8   16    9 f  273.581   2.8975  1541.83   32.659  1630.23   47.486  1462.49   44.988  281.006   4.0972  266.157   4.0982 14.84882 5.795000 
1 1 1    8   16   10 o  114.260   2.2941  269.995   10.763  262.993   15.877  275.949   14.640  112.882   3.4102  115.638   3.0696 -2.756287 4.588216 
1 1 1    8   16   11 o  191.945   2.3536  764.528   18.065  777.627   22.999  743.430   29.188  194.124   2.8725  189.766   3.7293 4.357925 4.707291 
1 1 1    8   16   12 o  227.046   2.9292  1067.42   24.154  1070.61   28.159  1058.54   46.986  227.766   2.9975  226.327   5.0334 1.438858 5.858390 
1 1 1    8   16   13 o   58.121   5.2157   67.662   9.6761   66.356   10.661   73.766   23.050   56.671   4.5611   59.571   9.3815 -2.900040 10.43145 
1 1 1    8   16   14 o  243.934   2.8778  1221.15   26.256  1210.21   31.080  1248.41   49.072  242.127   3.1122  245.741   4.8416 -3.614563 5.755593 
1 1 1    8   16   15 o   99.664   2.7399  207.204   10.801  212.638   13.578  197.842   17.823  101.485   3.2439   97.842   4.4165 3.642700 5.479778 
1 1 1    8   16   16 o  180.365   2.6134  674.070   19.342  697.035   26.334  647.168   28.502  183.727   3.4752  177.003   3.9042 6.724564 5.226860 
1 1 1    8   16   17 o   40.342   5.2709   44.516   8.2461   64.579   10.285   8.4127   13.797   55.898   4.4612   24.786   9.5513 31.11193 10.54184 
1 1 1    8   16   18 o  101.382   3.1159  213.491   12.910  248.661   18.365  179.134   18.151  109.694   4.0592   93.070   4.7285 16.62460 6.231844 
1 1 1    8   16   19 o   85.792   3.7533  152.963   13.130  156.721   17.431  148.034   19.962   87.040   4.8555   84.543   5.7249 2.497734 7.506655 
1 1 1    8   16   20 o   75.626   3.6212  123.600   10.688  138.684   13.644   99.649   17.193   81.913   4.0385   69.339   6.0118 12.57345 7.242343 
1 1 1    8   16   21 o  233.697   2.7687  1127.21   26.341  1118.71   34.519  1139.06   40.756  232.685   3.5968  234.708   4.2101 -2.022690 5.537367 
1 1 1    8   16   22 o   48.302   5.2073   50.363   9.2896   52.280   11.286   46.337   16.358   50.235   5.4472   46.369   8.8766 3.865723 10.41465 
1 1 1    8   16   23 o   51.652   6.2271   64.960   11.405   79.176   14.047   37.458   19.537   61.810   5.5099   41.495   11.169 20.31500 12.45416 
1 1 1    8   16   24 o   51.489   6.5762   56.875   13.551   48.115   19.327   65.345   19.005   47.006   10.257   55.973   8.2324 -8.966522 13.15235 
1 1 1    8   16   25 o  214.287   3.3918  934.494   25.239  920.809   28.672  981.598   53.195  211.100   3.2931  217.475   5.9305 -6.375443 6.783511 
1 1 1    8   16   26 o   96.135   3.7457  187.857   13.398  183.085   15.746  200.375   25.503   94.074   4.0583   98.196   6.2969 -4.122406 7.491423 
1 1 1    8   16   27 o  118.237   3.2236  283.973   14.815  273.295   17.984  306.517   26.131  114.932   3.7939  121.541   5.2128 -6.609688 6.447272 
1 1 1    8   16   28 o   64.631   5.0931   90.196   11.975   93.792   14.126   81.017   22.572   67.212   5.0959   62.051   8.8199 5.161076 10.18622 
1 1 1    8   16   29 o  188.852   3.3566  740.422   26.141  724.216   36.931  756.693   37.006  186.768   4.7943  190.935   4.6992 -4.166977 6.713245 
1 1 1    8   16   30 o  177.514   3.2749  653.898   23.923  641.500   32.623  668.323   35.187  175.734   4.5009  179.295   4.7583 -3.560272 6.549777 
1 1 1    8   16   31 o  102.595   4.6837  222.526   19.664  208.573   29.109  234.238   26.669   99.476   7.0949  105.713   6.1166 -6.236359 9.367470 
1 1 1    8   16   32 o   20.602   6.8847 -27.7455   15.988 -47.4921   23.313 -10.2098   21.969   17.917   8.8320   23.288   10.564 -5.370258 13.76934 
1 1 1    8   16   33 o   98.087   6.1580  206.479   21.620  209.022   42.886  205.612   25.034   97.426   10.673   98.747   6.1466 -1.320900 12.31605 
1 1 1    8   16   34 o   72.286   8.2658  120.524   23.595  138.309   32.446  100.561   34.375   79.329   9.9166   65.244   13.227 14.08462 16.53152 
1 1 1    8   16   35 o   40.473   8.8406   36.850   16.950   21.691   22.897   55.225   25.210   33.076   12.407   47.870   12.598 -14.79474 17.68118 
1 1 1    8   16   36 o   45.248   8.5440   47.359   17.173   26.627   23.156   72.701   25.601   35.000   12.584   55.497   11.560 -20.49741 17.08799 
1 1 1    8   16   37 o   59.729   7.6929   81.149   18.131   88.949   29.191   76.251   23.134   61.050   12.021   58.408   9.6031 2.641598 15.38574 
1 1 1    8   16   38 o   30.163   8.7612   12.318   17.974   21.552   23.901   0.2952   27.270   32.717   12.581   27.609   12.196 5.108234 17.52249 
1 1 1    8   16   39 o   41.994   11.063   19.851   30.899   99.706   47.906 -37.0339   40.433   57.502   18.102   26.485   12.722 31.01725 22.12542 
1 1 1    8   16   40 o   48.442   8.7372   61.265   17.838   47.577   26.664   72.355   24.000   42.474   13.520   54.410   11.071 -11.93570 17.47443 
1 1 1    8   16   41 o   53.797   8.6450   80.163   18.757   56.246   31.965   92.723   23.165   44.191   14.849   63.403   8.8583 -19.21275 17.29010 
1 1 1    8   16   42 o   35.810   9.2660   33.543   17.488   30.444   22.251   38.550   28.282   34.295   12.335   37.326   13.830 -3.031136 18.53204 
1 1 1    8   16   43 o   37.920   8.5706   37.221   16.813   62.063   24.514   15.157   23.103   47.464   12.390   28.376   11.845 19.08766 17.14114 
1 1 1    8   16   44 o   26.204   7.9303   3.2666   17.082 -23.4063   24.943   26.826   23.442   20.487   9.8790   31.921   12.408 -11.43427 15.86060 
1 1 1    8   16   45 o   30.412   9.3768   21.497   21.899   25.298   33.743   18.731   28.784   31.457   13.741   29.366   12.762 2.090757 18.75367 
1 1 1    8   16   46 o   26.817   8.6878   0.1601   24.482 -53.9275   41.173   29.742   30.449   22.221   11.086   31.412   13.380 -9.190756 17.37560 
1 1 1    8   16   47 o   23.723   8.0568 -11.9053   22.186   7.4617   34.824 -25.1367   28.783   26.690   12.519   20.756   10.145 5.934271 16.11367 
1 1 1    8   17    0 o  141.748   2.7324  415.464   22.553  415.464   22.553  415.464   22.553  141.748   3.8642  141.748   3.8642 0.000000 0.000000 
1 1 1    8   17    1 o   62.970   2.5622   81.422   6.6281   71.943   9.0534   92.372   9.7303   59.039   3.7180   66.901   3.5264 -7.862103 5.124307 
1 1 1    8   17    2 o  325.195   2.8935  2184.82   38.534  2168.55   57.942  2197.72   51.598  324.088   4.3348  326.302   3.8339 -2.213867 5.786990 
1 1 1    8   17    3 o  185.160   2.2553  708.547   17.138  696.161   25.419  718.870   23.206  183.668   3.3556  186.652   3.0143 -2.984421 4.510669 
1 1 1    8   17    4 o  261.605   2.5669  1412.14   27.464  1415.34   41.647  1409.68   36.533  261.853   3.8562  261.357   3.3891 0.4961548 5.133848 
1 1 1    8   17    5 o  162.673   2.2222  546.980   14.861  533.529   21.758  558.743   20.347  160.790   3.2809  164.555   2.9980 -3.764999 4.444359 
1 1 1    8   17    6 f  145.124   2.2016  434.216   13.119  438.698   19.544  430.541   17.700  145.801   3.2500  144.448   2.9709 1.353455 4.403294 
1 1 1    8   17    7 o  352.290   3.3063  2562.65   48.033  2615.66   68.585  2511.61   67.293  355.865   4.6728  348.715   4.6788 7.150604 6.612557 
1 1 1    8   17    8 o   86.693   2.5182  154.741   8.9756  138.217   12.383  173.034   13.029   81.826   3.6690   91.559   3.4502 -9.733009 5.036405 
1 1 1    8   17    9 o  162.529   2.4741  545.163   16.532  543.769   22.489  546.802   24.386  162.310   3.3595  162.749   3.6329 -0.4397430 4.948107 
1 1 1    8   17   10 o  358.617   2.9774  2645.59   42.409  2694.73   70.484  2617.71   53.094  361.147   4.7320  356.087   3.6152 5.060028 5.954895 
1 1 1    8   17   11 o  255.682   2.5688  1350.28   26.138  1351.69   32.906  1347.87   43.026  255.904   3.1177  255.460   4.0836 0.4440460 5.137698 
1 1 1    8   17   12 o  310.314   2.9151  1991.70   36.976  2007.44   49.217  1971.31   56.026  311.761   3.8276  308.868   4.3979 2.893311 5.830301 
1 1 1    8   17   13 o  157.278   3.7704  528.208   17.755  536.054   19.406  487.887   43.990  161.151   2.9197  153.405   6.9527 7.746002 7.540812 
1 1 1    8   17   14 o   70.655   3.1204  103.606   8.7140  104.724   10.899  101.624   14.508   71.208   3.7111   70.103   5.0176 1.105377 6.240849 
1 1 1    8   17   15 o  147.017   2.8665  428.344   16.655  387.749   20.400  509.492   28.843  137.024   3.6097  157.010   4.4539 -19.98636 5.732958 
1 1 1    8   17   16 o  117.419   2.6151  286.137   12.191  289.890   15.348  279.719   20.070  118.493   3.1404  116.344   4.1824 2.149727 5.230197 
1 1 1    8   17   17 o  165.952   2.4662  573.489   16.352  588.423   20.843  549.586   26.369  168.819   2.9934  163.085   3.9203 5.734711 4.932499 
1 1 1    8   17   18 o   88.176   3.3651  160.800   12.222  172.013   17.448  149.999   17.125   91.200   4.6387   85.151   4.8762 6.048492 6.730157 
1 1 1    8   17   19 o  197.859   3.0231  814.744   23.874  831.227   30.338  787.937   38.691  200.573   3.6673  195.145   4.8071 5.427811 6.046275 
1 1 1    8   17   20 o  204.932   2.9122  868.285   24.614  878.784   34.865  857.853   34.753  206.169   4.1002  203.694   4.1366 2.474747 5.824396 
1 1 1    8   17   21 o   40.069   5.9113   36.977   9.2081   43.860   11.518   24.783   15.329   45.986   6.0726   34.153   10.144 11.83317 11.82259 
1 1 1    8   17   22 o  107.414   3.4261  238.853   15.133  214.959   21.137  263.982   21.676  101.886   5.0299  112.941   4.6533 -11.05507 6.852198 
1 1 1    8   17   23 o  138.899   3.3887  397.748   19.171  389.215   25.077  409.748   29.738  137.153   4.4330  140.646   5.1265 -3.492630 6.777341 
1 1 1    8   17   24 o  136.527   3.4726  387.410   19.479  352.619   27.780  421.057   27.320  130.446   5.1635  142.609   4.6448 -12.16377 6.945217 
1 1 1    8   17   25 o  110.511   4.1803  228.190   15.129  213.644   16.651  297.041   36.226  101.629   3.9724  119.393   7.3566 -17.76450 8.360563 
1 1 1    8   17   26 o  221.814   3.0399  1014.91   27.581  989.425   36.518  1048.76   42.082  218.636   4.0496  224.991   4.5348 -6.354553 6.079817 
1 1 1    8   17   27 o   82.741   3.8924  140.699   12.554  137.531   15.336  147.132   21.856   81.446   4.5653   84.037   6.3056 -2.590897 7.784801 
1 1 1    8   17   28 o   79.003   5.5006  131.032   17.910  124.883   25.270  137.238   25.386   77.110   7.9458   80.895   7.6085 -3.785225 11.00117 
1 1 1    8   17   29 o   83.112   4.8873  145.607   16.617  125.128   23.580  165.811   23.421   77.174   7.4082   89.051   6.3768 -11.87708 9.774679 
1 1 1    8   17   30 o   54.498   5.5550   57.502   11.240   51.343   13.007   75.672   22.340   49.468   6.3751   59.529   9.0989 -10.06110 11.11001 
1 1 1    8   17   31 o  128.505   3.6368  341.741   18.961  327.372   24.469  363.334   29.996  125.286   4.7353  131.723   5.5212 -6.436882 7.273685 
1 1 1    8   17   32 o   97.223   3.8387  194.522   13.905  189.599   16.367  207.294   26.361   95.398   4.1597   99.048   6.4528 -3.650009 7.677340 
1 1 1    8   17   33 o   44.507   9.6010   48.633   20.925   64.745   25.822   17.813   35.713   52.757   12.122   36.258   14.892 16.49817 19.20204 
1 1 1    8   17   34 o  152.695   4.9894  509.511   30.516  452.049   47.504  549.885   39.819  144.409   7.9757  160.982   5.9972 -16.57344 9.978892 
1 1 1    8   17   35 o   34.735   8.9223   23.784   16.565   36.571   25.880   14.911   21.559   39.468   13.360   30.002   11.830 9.466452 17.84468 
1 1 1    8   17   36 o   28.835   8.5857   7.5298   17.461   3.3452   24.637   11.753   24.750   27.584   11.897   30.085   12.382 -2.500336 17.17132 
1 1 1    8   17   37 o   61.118   6.9657   87.191   16.465   59.413   23.114  115.804   23.460   49.567   11.525   72.670   7.8272 -23.10288 13.93141 
1 1 1    8   17   38 o   24.441   7.6952  -2.4895   15.680  -5.2438   22.594   0.0698   21.779   23.976   10.809   24.906   10.956 -0.9298573 15.39040 
1 1 1    8   17   39 o   42.582   8.3157   38.337   17.664   83.035   27.496   6.9295   23.049   57.953   11.902   27.211   11.617 30.74182 16.63149 
1 1 1    8   17   40 o   33.318   9.2621   25.197   18.537   18.925   31.063   28.667   23.101   32.398   13.643   34.237   12.531 -1.839165 18.52422 
1 1 1    8   17   41 o   30.701   9.3740   14.133   20.246   17.308   37.186   12.796   24.137   32.826   14.380   28.575   12.029 4.251089 18.74809 
1 1 1    8   17   42 o   41.856   9.1162   33.284   18.882   4.7066   22.514  101.063   34.672   25.213   11.113   58.499   14.454 -33.28591 18.23234 
1 1 1    8   17   43 o   27.691   8.2858   9.0515   17.175   27.718   25.020  -7.5833   23.619   32.647   12.783   22.735   10.545 9.911707 16.57168 
1 1 1    8   17   44 o   29.013   8.5743   19.314   17.157   17.608   25.312   20.765   23.335   28.687   12.208   29.339   12.043 -0.6522369 17.14860 
1 1 1    8   17   45 o   33.945   9.4402   33.029   21.831   3.2240   32.141   58.555   29.745   26.558   12.312   41.333   14.313 -14.77553 18.88035 
1 1 1    8   17   46 o   25.140   8.4941 -12.0417   25.245 -41.5133   35.144   19.380   36.288   21.244   10.539   29.035   13.324 -7.791107 16.98815 
1 1 1    8   18    0 o   62.307   2.5984   80.930   9.3683   80.930   9.3683   80.930   9.3683   62.307   3.6748   62.307   3.6748 0.000000 0.000000 
1 1 1    8   18    1 o  115.939   2.5074  277.400   11.817  277.773   18.341  277.136   15.451  115.996   3.8338  115.881   3.2327 0.1151733 5.014807 
1 1 1    8   18    2 o  150.513   2.5934  462.760   15.630  448.101   19.708  487.606   25.658  147.351   3.2429  153.676   4.0482 -6.324799 5.186874 
1 1 1    8   18    3 f  155.874   2.2940  499.088   14.713  539.859   21.709  464.452   20.009  161.733   3.2544  150.014   3.2339 11.71928 4.587923 
1 1 1    8   18    4 o  194.062   2.3028  778.333   18.364  764.202   27.024  790.458   25.032  192.416   3.4052  195.709   3.1011 -3.292389 4.605647 
1 1 1    8   18    5 o  221.212   2.3967  1011.02   21.743  1000.79   32.439  1019.37   29.299  220.184   3.5721  222.240   3.1964 -2.056229 4.793391 
1 1 1    8   18    6 o   79.763   2.3937  131.697   7.8347  127.229   11.568  135.483   10.649   78.506   3.5727   81.021   3.1867 -2.515007 4.787384 
1 1 1    8   18    7 o  239.488   2.6623  1173.40   26.104  1100.89   34.498  1270.54   39.927  230.921   3.6221  248.054   3.9026 -17.13280 5.324507 
1 1 1    8   18    8 o  113.967   2.3787  266.631   11.150  244.245   15.146  293.116   16.474  108.773   3.3760  119.160   3.3520 -10.38729 4.757450 
1 1 1    8   18    9 o  226.162   2.6578  1056.86   24.775  1075.31   34.598  1037.44   35.494  228.196   3.6760  224.128   3.8397 4.068237 5.315669 
1 1 1    8   18   10 o  289.021   2.9613  1725.99   35.296  1759.42   49.963  1692.69   49.870  291.819   4.1511  286.222   4.2244 5.596313 5.922644 
1 1 1    8   18   11 f  129.535   2.4099  346.939   12.596  348.756   16.235  344.190   19.964  129.979   3.0283  129.091   3.7496 0.8881683 4.819779 
1 1 1    8   18   12 o  252.976   3.2964  1332.60   33.773  1378.37   44.220  1268.53   52.319  258.290   4.1510  247.663   5.1219 10.62677 6.592762 
1 1 1    8   18   13 o  106.600   2.7060  237.316   11.064  241.970   13.450  227.574   19.459  108.267   3.0120  104.933   4.4963 3.334045 5.411921 
1 1 1    8   18   14 o   77.967   4.6375  138.401   10.793  144.877   11.899  108.348   25.635   83.759   3.4445   72.175   8.6116 11.58440 9.274956 
1 1 1    8   18   15 o  201.112   2.4669  830.710   19.623  819.161   24.414  851.786   32.981  199.192   2.9716  203.033   3.9385 -3.841080 4.933812 
1 1 1    8   18   16 o  220.981   2.5285  1007.14   22.180  1002.87   27.791  1014.62   36.811  220.387   3.0574  221.574   4.0280 -1.186676 5.056909 
1 1 1    8   18   17 f   76.902   3.1636  124.443   9.6359  130.714   12.222  114.142   15.664   79.539   3.7256   74.264   5.1141 5.274895 6.327216 
1 1 1    8   18   18 o  117.054   2.7470  288.040   12.597  299.697   15.723  267.143   21.051  120.462   3.1645  113.646   4.4911 6.815956 5.494004 
1 1 1    8   18   19 o   38.262   6.8039   30.519   10.645   40.022   16.887   24.251   13.713   42.911   9.7615   33.613   9.4808 9.297482 13.60779 
1 1 1    8   18   20 o  131.028   2.7104  355.876   14.146  358.784   17.866  350.989   23.160  131.788   3.2869  130.268   4.3105 1.519989 5.420699 
1 1 1    8   18   21 o  120.132   3.1802  297.461   15.716  269.459   21.557  329.230   22.961  114.113   4.5802  126.151   4.4130 -12.03835 6.360312 
1 1 1    8   18   22 o   47.925   5.5416   45.355   10.275   30.119   12.935   71.411   16.915   37.251   8.5940   58.599   6.9988 -21.34861 11.08328 
1 1 1    8   18   23 o  109.887   3.7628  248.496   16.917  236.877   22.337  264.123   25.906  106.923   5.0652  112.850   5.5659 -5.926964 7.525597 
1 1 1    8   18   24 o  214.733   3.1755  955.023   28.100  907.313   39.643  1003.20   39.836  209.322   4.5919  220.144   4.3874 -10.82231 6.350932 
1 1 1    8   18   25 o   96.265   4.2221  191.712   16.598  156.987   22.658  231.932   24.384   86.856   6.3249  105.675   5.5946 -18.81958 8.444121 
1 1 1    8   18   26 o  131.866   3.4993  359.259   18.988  330.340   25.922  392.739   27.891  126.160   4.9817  137.572   4.9155 -11.41201 6.998554 
1 1 1    8   18   27 o  100.560   3.5672  214.677   13.930  224.777   17.268  195.857   23.572  104.156   4.0197   96.964   5.8942 7.192612 7.134429 
1 1 1    8   18   28 o  139.822   3.2346  406.493   17.899  407.783   22.386  404.207   29.802  140.268   3.8695  139.376   5.1844 0.8927002 6.469224 
1 1 1    8   18   29 o   77.805   5.2770  127.944   16.713  102.615   23.133  155.607   24.175   69.587   8.0599   86.022   6.8137 -16.43464 10.55405 
1 1 1    8   18   30 o   44.227   9.8162   37.721   18.471   27.425   21.658   65.187   35.375   35.999   12.222   52.455   15.364 -16.45543 19.63236 
1 1 1    8   18   31 o   59.891   5.6422   72.196   12.754   66.086   14.983   88.271   24.302   55.925   6.4957   63.857   9.2272 -7.932266 11.28434 
1 1 1    8   18   32 o   38.194   8.7636   32.741   16.071   24.607   24.108   39.246   21.560   35.090   12.807   41.297   11.966 -6.206402 17.52730 
1 1 1    8   18   33 o   63.615   5.6841   96.440   12.304  106.776   14.636   71.534   22.720   71.266   4.9794   55.963   10.220 15.30243 11.36822 
1 1 1    8   18   34 o   36.484   5.9693   39.992   11.251   55.725   12.468 -29.0304   26.114   51.242   5.8992   21.727   10.379 29.51542 11.93857 
1 1 1    8   18   35 o   55.710   7.3978   72.300   16.429   35.625   22.461  114.500   24.094   38.880   12.412   72.540   8.0531 -33.65993 14.79557 
1 1 1    8   18   36 o   45.466   8.3723   49.055   16.605   72.515   24.653   29.572   22.466   55.188   11.213   35.743   12.436 19.44508 16.74470 
1 1 1    8   18   37 o   27.563   7.8137   4.8396   15.156   26.602   21.603 -16.2544   21.268   34.205   12.170   20.921   9.8036 13.28345 15.62744 
1 1 1    8   18   38 o   85.120   5.9818  163.314   20.735  153.054   31.178  171.451   27.766   82.085   9.2092   88.156   7.6366 -6.071411 11.96356 
1 1 1    8   18   39 o   44.913   8.7586   52.131   17.005   41.429   23.628   63.631   24.493   39.882   12.730   49.943   12.033 -10.06114 17.51713 
1 1 1    8   18   40 o   41.784   8.6981   46.271   16.022   43.791   23.583   48.397   21.834   40.475   12.694   43.092   11.895 -2.617371 17.39616 
1 1 1    8   18   41 o   29.365   8.0584   14.130   15.239   35.903   22.639  -3.9067   20.606   36.350   12.493   22.380   10.182 13.97029 16.11671 
1 1 1    8   18   42 o   24.791   8.1579  -7.7664   19.296 -12.8937   24.137   1.3123   32.119   22.037   10.364   27.545   12.601 -5.508038 16.31577 
1 1 1    8   18   43 o   28.279   7.9149   9.8594   16.418 -21.4661   23.784   38.375   22.692   20.161   9.7028   36.397   12.508 -16.23688 15.82985 
1 1 1    8   18   44 o   30.572   9.2861   22.768   21.579   10.718   33.071   31.703   28.477   28.336   12.895   32.808   13.366 -4.472345 18.57227 
1 1 1    8   18   45 o   30.528   9.1064   25.005   21.288   0.7895   32.672   42.870   28.062   25.757   12.095   35.300   13.616 -9.542698 18.21272 
1 1 1    8   18   46 o   25.787   8.5750  -3.2983   24.228 -33.0550   34.130   26.927   34.398   21.577   10.646   29.997   13.446 -8.419600 17.14999 
1 1 1    8   19    0 o  207.630   2.1903  889.995   26.513  889.995   26.513  889.995   26.513  207.630   3.0976  207.630   3.0976 0.000000 0.000000 
1 1 1    8   19    1 o   67.651   2.4687   94.826   6.8631  101.088   9.5362   88.097   9.8850   69.980   3.3040   65.321   3.6690 4.658630 4.937421 
1 1 1    8   19    2 f  206.973   2.1971  884.203   18.755  892.108   26.493  876.261   26.553  207.901   3.0896  206.044   3.1245 1.856781 4.394156 
1 1 1    8   19    3 o  225.132   2.4537  1043.89   22.415  1032.77   29.117  1060.08   35.118  223.684   3.1560  226.580   3.7579 -2.895920 4.907400 
1 1 1    8   19    4 o   91.395   2.2678  173.343   8.5020  159.750   12.351  185.583   11.721   87.966   3.4043   94.824   2.9969 -6.857796 4.535507 
1 1 1    8   19    5 o  277.712   2.8285  1590.42   32.349  1548.87   44.319  1637.79   47.324  273.845   3.9239  281.579   4.0749 -7.734100 5.657018 
1 1 1    8   19    6 o  175.723   2.2463  637.506   16.197  637.073   24.152  637.860   21.835  175.660   3.3337  175.787   3.0116 -0.1273804 4.492526 
1 1 1    8   19    7 o   97.884   2.3953  197.016   9.6484  180.672   13.198  215.776   14.140   93.540   3.4210  102.227   3.3537 -8.686760 4.790676 
1 1 1    8   19    8 o  138.661   2.3133  395.882   13.210  425.927   19.229  369.031   18.178  143.631   3.2460  133.692   3.2967 9.939255 4.626507 
1 1 1    8   19    9 f  137.402   2.9791  353.876   14.910  318.223   17.058  469.324   30.695  124.147   3.3314  150.658   4.9398 -26.51087 5.958122 
1 1 1    8   19   10 o  290.183   2.7516  1736.68   32.615  1758.70   49.841  1720.19   43.132  291.757   4.1419  288.609   3.6235 3.148407 5.503164 
1 1 1    8   19   11 o   66.172   2.7645   90.835   7.5098   81.916   10.726   99.411   10.518   62.966   4.1302   69.378   3.6756 -6.412354 5.528949 
1 1 1    8   19   12 o  107.811   2.6264  240.674   11.535  243.960   15.224  236.246   17.674  108.692   3.3961  106.931   4.0074 1.760796 5.252861 
1 1 1    8   19   13 o  245.160   2.8469  1244.50   26.302  1248.12   31.392  1235.98   48.180  245.863   3.0957  244.457   4.7786 1.406311 5.693703 
1 1 1    8   19   14 o  149.322   3.8341  461.466   23.545  415.718   32.838  509.868   33.778  141.686   5.6194  156.958   5.2178 -15.27103 7.668273 
1 1 1    8   19   15 o   81.023   4.1106  127.955   10.754  123.413   11.847  149.225   25.636   77.287   3.7164   84.759   7.3332 -7.471436 8.221148 
1 1 1    8   19   16 f  146.729   2.4801  444.038   14.416  442.130   18.014  447.435   24.041  146.327   2.9849  147.130   3.9617 -0.8026733 4.960298 
1 1 1    8   19   17 o  142.695   2.4816  416.634   14.104  405.598   17.662  436.052   23.430  140.144   3.0557  145.245   3.9111 -5.100815 4.963263 
1 1 1    8   19   18 o   42.730   5.0791   40.195   8.0123   43.025   9.7888   34.451   13.947   45.581   5.2069   39.880   8.7222 5.700729 10.15820 
1 1 1    8   19   19 o   63.665   3.8606   84.959   9.8469   88.408   12.662   79.682   15.663   65.359   4.6972   61.972   6.1279 3.386852 7.721106 
1 1 1    8   19   20 o  130.844   2.9854  353.739   16.093  347.047   22.154  361.214   23.416  129.542   4.1464  132.146   4.2963 -2.603943 5.970830 
1 1 1    8   19   21 o   49.746   4.6439   51.922   8.9692   52.953   11.030   49.910   15.410   50.548   5.2906   48.944   7.6337 1.604355 9.287859 
1 1 1    8   19   22 o   98.794   3.7744  206.729   15.013  229.890   19.954  176.514   22.790  105.377   4.5910   92.211   5.9923 13.16582 7.548843 
1 1 1    8   19   23 o  142.503   2.8764  420.762   16.185  422.213   20.181  418.146   27.094  142.917   3.4236  142.089   4.6232 0.8280334 5.752840 
1 1 1    8   19   24 o  170.838   2.8556  597.431   19.727  571.855   25.268  637.355   31.570  166.262   3.6847  175.415   4.3635 -9.153076 5.711173 
1 1 1    8   19   25 o   33.000   6.9463   21.949   9.3498   20.106   10.971   26.841   17.871   30.477   8.4393   35.523   11.036 -5.045521 13.89270 
1 1 1    8   19   26 f  135.963   4.1803  377.687   21.919  364.764   26.435  406.115   39.209  132.542   4.8357  139.384   6.8203 -6.842300 8.360661 
1 1 1    8   19   27 o   64.230   5.5706   92.533   12.178   97.694   14.005   76.530   24.661   68.544   4.9539   59.916   9.9793 8.628193 11.14122 
1 1 1    8   19   28 o   41.364   6.8834   36.363   10.858   33.517   13.009   42.898   19.712   39.044   8.3321   43.684   10.959 -4.639252 13.76675 
1 1 1    8   19   29 o   72.502   5.8997  118.761   16.530   84.051   25.561  143.713   21.671   62.343   9.9407   82.661   6.3565 -20.31845 11.79930 
1 1 1    8   19   30 o   75.391   6.2908  126.079   18.304  111.442   30.863  134.020   22.733   71.268   10.500   79.514   6.9318 -8.246437 12.58150 
1 1 1    8   19   31 o   67.609   4.6673   95.742   11.961   94.262   14.293   99.203   21.850   67.077   5.1664   68.141   7.7745 -1.064217 9.334587 
1 1 1    8   19   32 o   24.899   7.0474   6.2387   9.3947   3.4838   10.643   15.959   19.991   19.791   8.1294   30.008   11.514 -10.21761 14.09473 
1 1 1    8   19   33 o   29.650   7.4015   13.798   9.8134   9.2213   11.106   30.104   20.962   23.016   8.6391   36.283   12.021 -13.26692 14.80296 
1 1 1    8   19   34 o   39.164   6.8488   39.027   10.819   45.277   12.566   21.123   21.268   46.004   6.6229   32.323   11.990 13.68015 13.69754 
1 1 1    8   19   35 o   56.077   9.2882   93.606   13.639   97.310   14.168   46.807   50.364   67.856   5.0624   44.297   17.873 23.55919 18.57646 
1 1 1    8   19   36 o   34.774   7.5484   24.657   10.282   21.134   11.618   37.379   22.079   30.387   8.7778   39.162   12.283 -8.775463 15.09682 
1 1 1    8   19   37 o   57.801   6.3947   81.754   12.233   87.465   14.201   65.332   24.082   64.040   5.3767   51.561   11.604 12.47827 12.78934 
1 1 1    8   19   38 o   43.128   7.3462   52.529   12.621   60.861   14.355   24.167   26.486   52.835   6.5877   33.421   13.133 19.41341 14.69231 
1 1 1    8   19   39 o   31.806   8.6523   22.801   16.066   26.371   22.596   19.152   22.846   33.137   12.345   30.475   12.126 2.661377 17.30469 
1 1 1    8   19   40 o   44.470   8.7422   53.247   16.606   55.246   23.987   51.407   23.011   45.204   12.464   43.736   12.262 1.468105 17.48431 
1 1 1    8   19   41 o   29.312   8.1379   18.832   14.723   10.596   20.975   26.832   20.672   26.353   11.160   32.271   11.847 -5.918627 16.27589 
1 1 1    8   19   42 o   26.346   8.2422  -2.6878   17.648   29.138   29.353 -20.7062   22.086   33.121   13.541   19.572   9.4016 13.54933 16.48449 
1 1 1    8   19   43 o   31.896   8.7138   27.095   16.831   40.442   24.365   14.913   23.277   36.374   12.926   27.419   11.689 8.955198 17.42768 
1 1 1    8   19   44 o   25.690   8.3207   0.2945   21.186 -27.2839   32.650   20.351   27.844   22.282   10.873   29.097   12.598 -6.815659 16.64134 
1 1 1    8   19   45 o   30.345   8.7777   19.853   21.176 -24.4081   31.885   54.783   28.325   21.889   10.695   38.801   13.922 -16.91147 17.55531 
1 1 1    8   20    0 o   61.986   2.5407   80.088   9.1155   80.088   9.1155   80.088   9.1155   61.986   3.5931   61.986   3.5931 0.000000 0.000000 
1 1 1    8   20    1 o  125.820   2.3656  318.057   11.799  297.003   14.571  358.163   20.110  119.951   2.9452  131.688   3.7026 -11.73629 4.731152 
1 1 1    8   20    2 o  137.438   2.6975  374.836   13.516  358.619   15.624  423.054   26.941  131.811   2.8740  143.065   4.5658 -11.25403 5.395013 
1 1 1    8   20    3 o  217.933   2.4287  980.179   21.485  977.681   27.988  983.762   33.524  217.620   3.1182  218.247   3.7243 -0.6262054 4.857347 
1 1 1    8   20    4 o  325.773   2.9298  2194.97   38.944  2208.41   51.532  2177.07   59.466  326.983   3.8211  324.564   4.4422 2.418884 5.859529 
1 1 1    8   20    5 f  153.195   2.1988  485.730   13.848  443.380   19.662  527.420   19.508  146.544   3.2531  159.846   2.9590 -13.30205 4.397544 
1 1 1    8   20    6 o  400.296   3.3480  3305.82   54.560  3353.89   84.495  3271.44   71.453  402.711   5.0871  397.881   4.3541 4.830566 6.696048 
1 1 1    8   20    7 o  258.199   3.0803  1368.35   31.909  1417.31   51.913  1338.61   40.453  261.828   4.8072  254.570   3.8528 7.258194 6.160642 
1 1 1    8   20    8 o  148.993   2.3532  458.161   14.457  450.602   20.155  466.171   20.747  147.729   3.3079  150.257   3.3478 -2.528198 4.706365 
1 1 1    8   20    9 o  250.518   2.7593  1296.85   28.503  1324.55   40.189  1268.82   40.430  253.216   3.8481  247.820   3.9555 5.395950 5.518507 
1 1 1    8   20   10 o   86.557   2.4211  153.579   8.6087  168.211   12.895  141.816   11.563   90.247   3.4644   82.867   3.3830 7.379723 4.842211 
1 1 1    8   20   11 o   79.258   2.7147  133.746   8.5913  109.311   13.133  152.028   11.359   72.714   4.3789   85.802   3.2099 -13.08870 5.429408 
1 1 1    8   20   12 o  163.782   2.5992  549.855   16.112  543.438   19.223  565.009   29.542  162.245   2.8726  165.319   4.3326 -3.074066 5.198380 
1 1 1    8   20   13 o  174.450   2.5110  628.103   17.718  625.783   22.898  631.565   27.971  174.078   3.1892  174.823   3.8793 -0.7445068 5.021946 
1 1 1    8   20   14 o  146.586   2.5453  446.240   15.115  456.762   19.739  431.328   23.500  148.713   3.2182  144.459   3.9441 4.254456 5.090512 
1 1 1    8   20   15 o   72.498   4.8129  114.669   10.649  117.584   11.729  100.983   25.412   75.430   3.7700   69.567   8.8568 5.862587 9.625790 
1 1 1    8   20   16 f  214.828   2.5138  954.032   21.483  955.284   27.032  951.885   35.391  215.075   3.0474  214.582   3.9989 0.4931030 5.027698 
1 1 1    8   20   17 o   85.492   2.9943  152.155   10.195  155.119   12.912  147.247   16.614   86.639   3.6134   84.346   4.7757 2.292519 5.988633 
1 1 1    8   20   18 o  190.112   2.8547  736.529   20.369  721.773   24.106  773.360   38.085  186.933   3.1267  193.292   4.7772 -6.358963 5.709436 
1 1 1    8   20   19 o  243.764   2.8546  1218.33   28.292  1169.96   36.711  1289.09   44.399  237.903   3.7414  249.624   4.3124 -11.72107 5.709195 
1 1 1    8   20   20 o  129.466   3.0266  347.267   16.128  373.237   22.819  321.348   22.797  134.325   4.1189  124.608   4.4357 9.717140 6.053140 
1 1 1    8   20   21 o  158.797   3.2951  525.741   21.413  485.085   31.528  560.555   29.175  153.011   4.9959  164.583   4.2979 -11.57289 6.590201 
1 1 1    8   20   22 o  154.596   2.9973  488.237   17.652  478.099   21.125  511.695   32.134  152.079   3.3679  157.112   4.9590 -5.032791 5.994514 
1 1 1    8   20   23 f  163.625   3.9931  556.784   26.189  558.280   33.354  554.378   42.292  164.059   4.9292  163.191   6.2835 0.8683624 7.986184 
1 1 1    8   20   24 o   59.122   5.4763   82.876   11.400  101.240   14.333   51.250   18.809   69.831   4.9764   48.413   9.7568 21.41852 10.95266 
1 1 1    8   20   25 o  106.704   3.4587  237.056   15.029  240.378   19.826  232.567   23.045  107.647   4.4655  105.760   5.2830 1.887253 6.917431 
1 1 1    8   20   26 o  168.224   4.0674  595.452   27.212  610.383   34.467  570.744   44.337  171.321   4.8779  165.127   6.5100 6.194550 8.134750 
1 1 1    8   20   27 o   89.268   4.1163  167.583   13.951  168.983   16.781  164.451   25.103   90.129   4.5142   88.407   6.8845 1.722717 8.232528 
1 1 1    8   20   28 o   60.059   4.9400   78.159   11.176   81.404   13.498   71.084   19.932   62.403   5.2444   57.714   8.3733 4.688965 9.880076 
1 1 1    8   20   29 f   51.500   5.9367   60.502   10.898   64.394   13.027   51.431   19.890   55.359   5.7054   47.642   10.413 7.716862 11.87349 
1 1 1    8   20   30 o   41.632   9.0146   40.441   16.868   33.382   27.967   44.478   21.148   39.333   13.863   43.932   11.527 -4.598965 18.02926 
1 1 1    8   20   31 f   27.159   7.0905   13.574   9.5242   13.703   10.968   13.176   19.203   25.705   8.6975   28.614   11.201 -2.908422 14.18098 
1 1 1    8   20   32 o   41.642   6.7521   43.068   10.680   48.310   12.497   28.871   20.566   47.612   6.3641   35.672   11.911 11.94019 13.50424 
1 1 1    8   20   33 o   36.606   6.8427   23.456   9.4408   15.761   10.715   50.162   19.962   26.892   8.5715   46.320   10.669 -19.42780 13.68538 
1 1 1    8   20   34 o   74.842   4.4720  116.828   12.817  111.898   15.355  128.155   23.273   72.773   5.1157   76.912   7.3366 -4.138565 8.944026 
1 1 1    8   20   35 o   59.064   8.6423   98.231   13.583  102.786   14.457   63.968   39.653   69.692   5.0296   48.436   16.537 21.25593 17.28453 
1 1 1    8   20   36 o   36.555   6.8741   35.419   10.719   41.478   12.121   13.679   22.961   43.713   6.7231   29.396   11.992 14.31683 13.74817 
1 1 1    8   20   37 o   25.715   7.2277   11.370   10.322   12.935   11.638   5.6022   22.339   24.972   8.9276   26.457   11.369 -1.484972 14.45546 
1 1 1    8   20   38 o   34.393   7.5415   28.844   10.779   29.330   12.202   27.119   23.002   35.244   8.4941   33.541   12.464 1.703312 15.08298 
1 1 1    8   20   39 o   25.084   7.6896   4.4263   14.839  -1.4872   20.860   10.485   21.115   23.322   10.461   26.845   11.273 -3.522917 15.37918 
1 1 1    8   20   40 o   61.414   6.2446   96.767   12.994  107.173   15.523   72.404   23.752   70.189   5.3620   52.639   11.279 17.55023 12.48913 
1 1 1    8   20   41 o   46.556   7.4250   52.246   11.702   50.070   13.044   61.219   26.491   47.217   6.6979   45.896   13.254 1.320053 14.85003 
1 1 1    8   20   42 f   42.885   7.7972   45.803   12.137   41.762   13.745   60.103   25.856   41.299   8.3564   44.471   13.166 -3.171822 15.59432 
1 1 1    8   20   43 o   27.047   9.0697  -3.1520   25.523 -11.1720   31.507   12.157   43.530   24.166   11.505   29.928   14.024 -5.762226 18.13941 
1 1 1    8   20   44 o   21.941   7.5557 -23.2528   22.046 -30.6812   31.584 -16.1944   30.788   21.222   10.425   22.660   10.939 -1.438370 15.11142 
1 1 1    8   21    0 o  233.723   2.2890  1127.83   31.192  1127.83   31.192  1127.83   31.192  233.723   3.2371  233.723   3.2371 0.000000 0.000000 
1 1 1    8   21    1 o  178.627   2.2298  659.773   16.337  669.104   22.064  648.448   24.306  180.039   2.9713  177.216   3.3255 2.822708 4.459513 
1 1 1    8   21    2 o  228.319   2.2640  1075.24   21.303  1051.90   29.435  1100.91   30.870  225.723   3.1617  230.915   3.2413 -5.191925 4.527958 
1 1 1    8   21    3 o  231.943   2.4819  1115.50   23.523  1147.23   31.468  1075.30   35.415  235.722   3.2367  228.165   3.7634 7.557861 4.963780 
1 1 1    8   21    4 o  142.201   2.7162  391.964   13.860  368.008   15.831  470.615   28.684  133.522   2.8747  150.880   4.6094 -17.35793 5.432378 
1 1 1    8   21    5 o  119.535   2.5186  293.200   12.370  273.767   16.633  317.251   18.504  115.134   3.5027  123.935   3.6200 -8.800629 5.037180 
1 1 1    8   21    6 o  237.751   2.9582  1170.69   28.574  1153.71   44.244  1182.84   37.426  236.223   4.5412  239.279   3.7923 -3.056183 5.916418 
1 1 1    8   21    7 f  173.688   2.6310  634.367   18.496  545.921   27.689  705.632   24.854  162.524   4.1306  184.852   3.2600 -22.32726 5.262083 
1 1 1    8   21    8 o  120.763   2.5369  304.159   12.064  291.303   20.121  311.375   15.075  118.719   4.1092  122.806   2.9762 -4.086754 5.073802 
1 1 1    8   21    9 o   76.576   2.7262  115.223   8.2426  141.716   14.369  102.229   10.063   82.801   4.2074   70.352   3.4680 12.44901 5.452495 
1 1 1    8   21   10 o  294.701   3.1537  1792.53   36.314  1806.01   62.385  1785.61   44.661  295.413   5.1202  293.989   3.6832 1.424133 6.307337 
1 1 1    8   21   11 o  125.747   2.5116  328.835   12.641  317.463   20.331  336.003   16.141  123.935   3.9774  127.560   3.0680 -3.625114 5.023124 
1 1 1    8   21   12 o  211.831   2.7733  932.814   23.149  945.929   28.872  909.208   38.736  214.001   3.2711  209.661   4.4795 4.340424 5.546683 
1 1 1    8   21   13 o   80.328   2.8052  132.797   9.0352  130.929   11.463  135.862   14.681   79.607   3.4914   81.049   4.3917 -1.442574 5.610417 
1 1 1    8   21   14 o  234.995   2.5481  1141.32   23.799  1141.94   29.907  1140.24   39.299  235.145   3.0837  234.845   4.0573 0.2999115 5.096115 
1 1 1    8   21   15 o  149.731   2.4403  465.014   14.569  470.378   18.444  456.114   23.759  150.921   2.9630  148.541   3.8781 2.380142 4.880519 
1 1 1    8   21   16 o  135.158   3.3463  372.628   15.106  368.841   16.921  387.490   33.525  133.634   3.0701  136.681   5.9470 -3.047287 6.692675 
1 1 1    8   21   17 o  139.099   2.8590  399.514   15.012  398.643   17.917  401.566   27.499  138.921   3.1271  139.277   4.7871 -0.3554382 5.717922 
1 1 1    8   21   18 o  383.736   4.1060  3065.50   63.620  3108.22   82.319  3002.16  100.254  387.310   5.1532  380.161   6.3939 7.149780 8.212057 
1 1 1    8   21   19 o   72.208   3.5038  106.362   10.102  101.741   12.654  114.481   16.773   70.115   4.3759   74.302   5.4734 -4.186577 7.007572 
1 1 1    8   21   20 o   88.728   5.2325  153.157   18.050  133.826   21.624  197.576   32.779   80.218   6.5358   97.239   8.1732 -17.02133 10.46507 
1 1 1    8   21   21 o   94.450   6.0389  222.494   18.351  127.709   35.668  256.618   21.401   77.619   11.142  111.280   4.6629 -33.66085 12.07790 
1 1 1    8   21   22 f   77.436   4.7514  127.060   14.658  116.684   23.482  133.685   18.763   74.680   7.6237   80.192   5.6729 -5.512566 9.502793 
1 1 1    8   21   23 o  177.844   3.2504  654.947   23.705  667.132   35.622  645.262   31.757  179.274   4.8176  176.414   4.3646 2.859848 6.500721 
1 1 1    8   21   24 o   93.415   4.0516  182.586   15.533  169.925   22.585  193.948   21.396   90.273   6.0661   96.557   5.3725 -6.284798 8.103125 
1 1 1    8   21   25 o  136.776   3.0737  389.887   16.976  395.419   21.969  381.689   26.743  138.087   3.8573  135.465   4.7865 2.621399 6.147359 
1 1 1    8   21   26 o  108.543   3.5462  250.815   14.435  258.679   17.311  232.868   26.152  111.654   3.7592  105.432   6.0141 6.221336 7.092326 
1 1 1    8   21   27 o   79.756   5.9862  141.699   14.256  144.611   15.626  127.246   34.811   83.303   4.5480   76.209   11.075 7.093811 11.97239 
1 1 1    8   21   28 o   27.425   6.8451   14.396   8.9257   14.196   10.461   14.932   17.116   26.028   8.4853   28.822   10.743 -2.794466 13.69015 
1 1 1    8   21   29 o   49.765   5.8858   55.965   10.360   58.486   12.250   49.633   19.413   52.757   5.6296   46.773   10.338 5.983639 11.77170 
1 1 1    8   21   30 o   32.833   6.9796   14.840   9.5489   6.0990   10.796   46.251   20.466   21.202   8.3675   44.464   11.173 -23.26200 13.95919 
1 1 1    8   21   31 o   58.254   6.5712   77.042   15.086   66.151   22.450   86.009   20.371   53.504   10.549   63.004   7.8392 -9.499641 13.14246 
1 1 1    8   21   32 o   24.304   6.3017   10.659   9.1369   17.879   10.354 -14.7576   19.425   28.299   8.3187   20.309   9.4682 7.990099 12.60345 
1 1 1    8   21   33 o   44.483   6.5694   49.675   10.708   56.093   12.658   33.525   20.081   51.313   5.9812   37.653   11.698 13.65982 13.13872 
1 1 1    8   21   34 o   21.124   6.6432  -2.1483   9.1902  -3.7267   10.215   4.5571   21.054   16.281   7.3103   25.967   11.094 -9.686052 13.28639 
1 1 1    8   21   35 o   62.304   5.2343   87.580   11.949   91.149   14.211   78.963   22.079   65.449   5.2643   59.160   9.0486 6.289581 10.46851 
1 1 1    8   21   36 o   51.838   8.6012   65.795   12.432   65.654   13.153   66.981   38.080   55.294   5.7673   48.383   16.207 6.911518 17.20241 
1 1 1    8   21   37 o   29.277   7.3280   3.0818   10.050  -6.5034   11.068   48.138   23.996   15.904   7.3202   42.651   12.697 -26.74773 14.65602 
1 1 1    8   21   38 o   42.461   7.0640   46.049   11.165   48.556   12.844   38.296   22.582   46.907   6.6390   38.014   12.471 8.893429 14.12807 
1 1 1    8   21   39 o   25.432   7.7560   7.3298   14.836   9.9449   20.974   4.7109   20.989   26.197   11.130   24.667   10.805 1.529873 15.51203 
1 1 1    8   21   40 o   22.803   6.8806   6.5757   9.8444   7.7750   10.953   1.5368   22.452   21.285   8.4193   24.322   10.885 -3.036945 13.76121 
1 1 1    8   21   41 o   41.658   7.1590   51.501   12.060   58.449   13.816   29.256   24.720   50.825   6.5909   32.491   12.711 18.33345 14.31795 
1 1 1    8   21   42 o   34.138   7.6215   33.998   12.067   37.437   13.650   21.699   25.815   38.594   8.7739   29.682   12.465 8.912260 15.24308 
1 1 1    8   21   43 o   15.623   7.3514  -8.4450   12.176  -8.4450   12.176   0.0000   0.0000   15.623   7.3514  ?   ?       ?      ? 
1 1 1    8   21   44 o   25.863   8.0076   1.4621   11.966  -6.7194   12.998   46.968   30.653   16.507   7.7120   35.220   14.036 -18.71317 16.01513 
1 1 1    8   22    0 o   93.692   2.1678  181.719   11.818  181.719   11.818  181.719   11.818   93.692   3.0657   93.692   3.0657 0.000000 0.000000 
1 1 1    8   22    1 o  165.899   2.2050  569.223   15.008  577.781   20.297  558.900   22.292  167.288   2.9417  164.509   3.2854 2.779327 4.409910 
1 1 1    8   22    2 o  202.453   2.1705  846.318   18.124  849.967   25.578  842.639   25.684  202.892   3.0565  202.014   3.0826 0.8786469 4.341079 
1 1 1    8   22    3 o  240.544   2.9828  1194.53   28.809  1189.47   36.720  1202.63   46.460  239.946   3.7104  241.143   4.6714 -1.196198 5.965626 
1 1 1    8   22    4 f  294.484   2.7785  1791.56   33.288  1789.25   43.617  1794.79   51.517  294.305   3.5933  294.662   4.2389 -0.3568726 5.556987 
1 1 1    8   22    5 o  112.711   2.5431  260.188   11.764  240.395   15.713  285.427   17.744  107.879   3.5316  117.542   3.6601 -9.663475 5.086138 
1 1 1    8   22    6 o  190.018   2.4749  745.608   19.393  759.641   27.718  732.152   27.143  191.768   3.5044  188.268   3.4956 3.500992 4.949776 
1 1 1    8   22    7 o   90.088   2.4568  165.076   8.2194  173.560   15.650  161.845   9.6586   91.630   4.1411   88.546   2.6447 3.084015 4.913602 
1 1 1    8   22    8 o  162.271   2.5305  547.755   16.203  531.023   26.992  557.180   20.259  160.275   4.0832  164.266   2.9903 -3.991791 5.061069 
1 1 1    8   22    9 o  216.754   2.6396  963.643   21.275  987.657   40.174  954.285   25.080  218.521   4.4575  214.987   2.8284 3.533737 5.279147 
1 1 1    8   22   10 o  102.967   2.4525  218.893   10.263  219.901   15.951  218.181   13.407  103.154   3.7492  102.781   3.1626 0.3727036 4.904960 
1 1 1    8   22   11 o  144.147   3.1135  422.011   15.740  444.575   32.737  415.227   17.951  146.499   5.4181  141.796   3.0694 4.703278 6.227090 
1 1 1    8   22   12 o  252.450   3.8811  1317.38   40.411  1317.38   40.411   0.0000   0.0000  252.450   3.8811  ?   ?       ?      ? 
1 1 1    8   22   13 o  133.703   2.4397  367.533   12.971  362.585   16.256  376.204   21.521  132.503   2.9746  134.902   3.8679 -2.398972 4.879412 
1 1 1    8   22   14 o  160.222   2.6723  517.331   16.122  499.104   19.060  563.164   30.224  155.458   2.9726  164.987   4.4416 -9.528564 5.344522 
1 1 1    8   22   15 o  173.143   2.9129  615.275   20.703  539.915   28.041  705.585   30.696  161.566   4.2080  184.720   4.0291 -23.15466 5.825825 
1 1 1    8   22   16 o   57.115   6.4425   64.884   10.002   63.285   10.698   75.984   28.182   55.288   4.6916   58.941   12.001 -3.653435 12.88499 
1 1 1    8   22   17 o   94.477   5.8203  150.789   13.803  142.879   14.429  236.089   47.382   83.101   4.2097  105.853   10.853 -22.75168 11.64063 
1 1 1    8   22   18 o  204.242   2.8085  858.357   23.483  827.846   31.133  898.633   35.769  200.084   3.7726  208.400   4.1614 -8.316986 5.616924 
1 1 1    8   22   19 o  103.454   3.5447  223.199   14.952  212.570   22.621  231.445   19.926  101.207   5.4193  105.701   4.5705 -4.494034 7.089320 
1 1 1    8   22   20 o  122.253   2.8418  308.752   13.864  306.839   17.494  311.983   22.732  121.803   3.4823  122.702   4.4919 -0.8991241 5.683605 
1 1 1    8   22   21 o  109.327   3.5570  248.113   16.035  255.569   22.821  240.841   22.536  110.955   4.9867  107.698   5.0735 3.256935 7.113922 
1 1 1    8   22   22 o  215.712   2.7076  964.091   23.354  965.289   29.613  962.120   37.984  216.003   3.3240  215.421   4.2751 0.5817413 5.415299 
1 1 1    8   22   23 o  108.082   3.0280  240.414   13.158  234.035   16.726  250.773   21.314  106.281   3.8156  109.883   4.7029 -3.602074 6.056050 
1 1 1    8   22   24 o  120.817   3.1204  305.724   15.240  316.151   19.881  290.866   23.732  123.437   3.9051  118.198   4.8681 5.239204 6.240800 
1 1 1    8   22   25 o   56.134   4.6310   68.466   9.9850   73.109   12.342   59.670   16.988   59.199   5.0549   53.069   7.7610 6.129055 9.262036 
1 1 1    8   22   26 o  127.154   3.2511  326.038   15.814  308.722   18.866  366.954   29.000  121.899   3.7524  132.408   5.3102 -10.50910 6.502225 
1 1 1    8   22   27 o   65.525   6.1832   79.753   11.816   74.960   12.652  112.480   33.058   59.825   5.1274   71.224   11.253 -11.39931 12.36650 
1 1 1    8   22   28 o   48.891   5.8960   57.878   10.180   66.636   12.333   39.159   18.031   56.361   5.3055   41.420   10.531 14.94069 11.79199 
1 1 1    8   22   29 o   38.593   6.6200   34.526   9.9691   35.978   12.064   31.400   17.701   40.308   7.5337   36.877   10.888 3.431244 13.23990 
1 1 1    8   22   30 f   19.396   6.1625  -6.0768   8.5156  -9.0139   9.6521   4.2385   18.089   14.116   6.6114   24.675   10.402 -10.55878 12.32507 
1 1 1    8   22   31 o   99.783   4.2168  211.135   17.303  189.663   23.936  234.635   25.041   94.388   6.1485  105.179   5.7724 -10.79125 8.433577 
1 1 1    8   22   32 o   59.818   5.6712   84.326   11.656   91.295   13.820   67.151   21.695   65.748   5.0962   53.887   10.133 11.86113 11.34248 
1 1 1    8   22   33 o   19.144   6.0079  -2.2925   9.2880   4.1614   10.519 -25.1321   19.788   19.855   8.1101   18.433   8.8658 1.422085 12.01571 
1 1 1    8   22   34 o   72.934   5.8393  118.356   17.457  103.015   24.424  134.378   24.960   67.782   8.7366   78.086   7.7500 -10.30443 11.67865 
1 1 1    8   22   35 o   30.915   7.1228   22.983   10.161   26.067   11.623   12.985   20.930   33.500   8.4212   28.329   11.490 5.171234 14.24557 
1 1 1    8   22   36 o   78.072   8.3328  182.355   15.932  196.404   17.325  105.335   40.564   96.272   4.3632   59.873   16.084 36.39898 16.66558 
1 1 1    8   22   37 o   26.822   6.9784   2.6571   9.2873  -5.8560   10.340   38.182   21.123   15.438   7.0948   38.206   12.019 -22.76760 13.95681 
1 1 1    8   22   38 o   31.698   7.5538   22.682   10.354   19.704   11.831   32.431   21.403   28.566   8.9962   34.830   12.137 -6.264280 15.10754 
1 1 1    8   22   39 o   18.185   6.1149 -10.5589   9.5939 -12.1600   10.753  -4.3091   21.245   13.929   6.6559   22.442   10.260 -8.512345 12.22972 
1 1 1    8   22   40 o   29.551   7.6206   19.993   10.374   18.264   11.599   26.906   23.193   27.312   8.9365   31.791   12.346 -4.479103 15.24118 
1 1 1    8   22   41 o   55.653   6.9784   78.554   13.400   78.182   15.545   79.628   26.435   58.739   6.4164   52.568   12.394 6.170460 13.95681 
1 1 1    8   22   42 o   23.397   7.2106   0.4608   10.507  -6.0193   11.688   27.766   23.992   15.957   7.4073   30.836   12.373 -14.87926 14.42111 
1 1 1    8   22   43 o   25.876   6.7759   15.416   12.768   29.977   14.271 -42.9746   28.579   32.917   9.7900   18.835   9.3705 14.08235 13.55182 
1 1 1    8   23    0 o  578.395   4.1427  6918.41  139.731  6918.41  139.731  6918.41  139.731  578.395   5.8587  578.395   5.8587 0.000000 0.000000 
1 1 1    8   23    1 f  154.839   2.1920  492.940   13.892  478.374   18.422  512.144   21.152  152.210   2.9345  157.467   3.2569 -5.257965 4.383928 
1 1 1    8   23    2 f  143.683   2.0571  426.209   12.187  440.077   17.345  412.685   17.128  145.993   2.8806  141.373   2.9375 4.620102 4.114180 
1 1 1    8   23    3 o  101.121   2.3651  210.353   9.6046  207.485   12.218  214.991   15.538  100.241   2.9553  102.001   3.6935 -1.759727 4.730291 
1 1 1    8   23    4 o   17.386   5.0580   1.8760   5.8393   2.7545   8.4402   1.0695   8.0871   18.003   7.2983   16.769   7.0049 1.233959 10.11601 
1 1 1    8   23    5 o   58.942   2.9405   71.404   7.0530   74.380   11.001   69.327   9.1903   59.967   4.4479   57.916   3.8474 2.050945 5.880966 
1 1 1    8   23    6 o  128.188   2.4573  329.805   12.728  294.513   16.150  387.662   20.679  119.408   3.2794  136.968   3.6605 -17.56059 4.914643 
1 1 1    8   23    7 o  216.930   2.2435  971.156   20.065  1008.71   28.824  935.852   27.948  220.996   3.1623  212.863   3.1833 8.132599 4.487082 
1 1 1    8   23    8 o  168.023   2.5850  531.720   16.861  441.543   20.111  745.059   30.932  146.199   3.3352  189.847   3.9504 -43.64798 5.170008 
1 1 1    8   23    9 o  210.880   2.4902  896.864   21.381  781.795   27.681  1067.04   33.664  194.523   3.4502  227.238   3.5918 -32.71498 4.980497 
1 1 1    8   23   10 o   80.679   2.6032  136.539   8.5105  121.289   12.853  148.443   11.356   76.588   4.0690   84.770   3.2481 -8.181511 5.206457 
1 1 1    8   23   11 o  253.891   2.4421  1329.60   25.522  1297.31   34.847  1366.97   37.485  250.583   3.3717  257.199   3.5337 -6.616013 4.884160 
1 1 1    8   23   12 o   57.562   3.9944   70.528   9.2092   79.383   12.190   58.755   14.056   61.927   4.7726   53.197   6.4064 8.730156 7.988712 
1 1 1    8   23   13 o  182.867   2.6809  690.916   20.207  680.482   28.003  702.253   29.189  181.434   3.7421  184.301   3.8400 -2.867676 5.361811 
1 1 1    8   23   14 f   65.409   3.1673   88.303   8.4488   86.947   11.106   90.165   13.017   64.831   4.1536   65.987   4.7827 -1.155251 6.334543 
1 1 1    8   23   15 o  250.295   3.4668  1302.21   34.618  1315.94   43.852  1279.52   56.396  252.195   4.2158  248.395   5.5048 3.800476 6.933664 
1 1 1    8   23   16 o   62.969   3.3491   82.260   8.5204   82.809   11.015   81.443   13.443   63.259   4.2219   62.680   5.2002 0.5794716 6.698246 
1 1 1    8   23   17 o  165.358   2.6254  562.447   17.435  552.262   22.160  578.996   28.247  163.457   3.2870  167.260   4.0946 -3.802994 5.250714 
1 1 1    8   23   18 o   90.531   4.7860  169.712   12.656  169.242   13.702  172.440   33.036   90.448   3.6729   90.614   8.8394 -0.1660309 9.572097 
1 1 1    8   23   19 o  132.276   2.6868  362.160   14.113  362.116   17.713  362.238   23.356  132.332   3.2454  132.221   4.2828 0.1110382 5.373563 
1 1 1    8   23   20 o  198.153   2.7793  813.038   22.419  811.624   29.421  814.996   34.622  198.017   3.6023  198.288   4.2334 -0.2709961 5.558609 
1 1 1    8   23   21 o  105.031   3.6503  228.083   15.754  202.605   21.487  257.701   23.167   98.704   5.2780  111.358   5.0440 -12.65493 7.300632 
1 1 1    8   23   22 o  186.665   2.9456  721.960   22.594  710.198   30.550  736.161   33.568  185.035   4.0030  188.296   4.3224 -3.260971 5.891250 
1 1 1    8   23   23 o   53.735   4.3996   60.087   9.5008   58.607   12.077   62.490   15.389   52.965   5.5286   54.505   6.8454 -1.539818 8.799115 
1 1 1    8   23   24 f   49.770   4.6386   48.942   9.2246   38.324   11.502   68.089   15.444   42.671   6.5352   56.868   6.5847 -14.19728 9.277243 
1 1 1    8   23   25 o   39.883   5.8253   34.808   8.9488   35.115   10.985   34.202   15.429   40.781   6.5311   38.984   9.6478 1.796959 11.65060 
1 1 1    8   23   26 o   62.645   4.3419   81.535   10.904   77.813   13.745   87.852   17.908   60.887   5.4735   64.404   6.7416 -3.517368 8.683764 
1 1 1    8   23   27 o   45.861   5.4483   43.846   9.4998   40.344   11.500   51.368   16.856   43.660   6.3862   48.061   8.8290 -4.400558 10.89657 
1 1 1    8   23   28 o   41.394   7.9453   41.392   10.814   42.960   11.467   28.788   32.509   44.958   6.1842   37.831   14.638 7.127594 15.89069 
1 1 1    8   23   29 o   21.737   6.5379   2.6367   8.7588   2.2646   9.9259   3.9458   18.618   18.626   7.7686   24.848   10.518 -6.222401 13.07585 
1 1 1    8   23   30 o   97.298   3.5091  192.621   13.314  179.814   16.134  219.954   23.570   92.677   4.2209  101.919   5.6071 -9.242287 7.018214 
1 1 1    8   23   31 o   34.078   6.9853   27.126   9.7690   28.325   11.366   23.737   19.114   35.373   7.9802   32.783   11.467 2.590126 13.97052 
1 1 1    8   23   32 o   41.932   6.7006   37.838   10.395   33.638   12.190   49.034   19.904   38.546   7.9318   45.318   10.802 -6.771935 13.40115 
1 1 1    8   23   33 o   22.242   6.7002   3.8832   9.2753   4.2132   10.472   2.6820   19.981   19.774   8.0864   24.709   10.685 -4.935053 13.40036 
1 1 1    8   23   34 o   38.196   6.6495   38.877   11.116   49.169   13.315   15.205   20.193   47.497   6.7969   28.896   11.431 18.60155 13.29909 
1 1 1    8   23   35 o   41.470   7.0250   42.173   11.128   43.593   13.008   38.300   21.486   44.387   7.1056   38.553   12.121 5.833275 14.04998 
1 1 1    8   23   36 o   29.465   7.5850   19.431   10.784   19.934   12.170   17.591   23.269   29.017   9.1220   29.913   12.121 -0.8957863 15.16999 
1 1 1    8   23   37 f   52.877   6.5565   72.638   11.838   79.325   13.932   55.266   22.455   60.323   5.5997   45.432   11.857 14.89044 13.11301 
1 1 1    8   23   38 o   25.283   6.7073   14.022   9.8429   19.132   11.280  -2.2944   20.155   28.144   8.7713   22.422   10.150 5.721811 13.41457 
1 1 1    8   23   39 o   28.974   7.2012   10.524   10.179   0.4226   11.607   44.175   21.184   18.304   8.0258   39.644   11.959 -21.34086 14.40241 
1 1 1    8   23   40 o   31.066   8.5802   24.822   16.594   38.326   23.709   11.855   23.233   35.610   12.741   26.522   11.496 9.088039 17.16042 
1 1 1    8   23   41 o   32.119   7.4895   29.499   11.400   31.825   13.145   22.446   22.895   35.058   9.0347   29.181   11.948 5.876835 14.97893 
1 1 1    8   23   42 o   31.395   8.4615   25.039   12.526   20.635   13.840   44.986   29.454   27.697   9.7530   35.093   13.830 -7.396652 16.92309 
1 1 1    8   24    0 o  115.492   2.0843  275.790   14.020  275.790   14.020  275.790   14.020  115.492   2.9476  115.492   2.9476 0.000000 0.000000 
1 1 1    8   24    1 o  152.148   2.3158  477.965   14.529  468.498   20.265  487.977   20.840  150.600   3.2626  153.697   3.2875 -3.096832 4.631644 
1 1 1    8   24    2 o   85.757   2.2262  151.923   7.8708  152.814   10.990  150.985   11.278   86.017   3.0978   85.497   3.1982 0.5205154 4.452469 
1 1 1    8   24    3 o  134.647   2.3142  373.811   12.541  371.327   16.043  377.714   20.112  134.098   2.9006  135.197   3.6068 -1.099380 4.628435 
1 1 1    8   24    4 o   71.912   3.0102  106.374   8.8978   95.200   12.130  119.388   13.091   67.842   4.3352   75.982   4.1774 -8.139656 6.020343 
1 1 1    8   24    5 o  138.942   2.2183  398.460   12.562  396.918   16.529  400.570   19.329  138.641   2.8907  139.244   3.3656 -0.6031494 4.436623 
1 1 1    8   24    6 o  225.895   2.2830  1051.24   21.212  1017.83   28.774  1091.02   31.395  221.984   3.1428  229.806   3.3123 -7.822281 4.565996 
1 1 1    8   24    7 o  191.085   2.3348  745.073   18.011  711.620   22.985  798.298   28.992  185.625   3.0022  196.544   3.5765 -10.91951 4.669506 
1 1 1    8   24    8 o  317.929   2.9295  2087.09   37.731  2073.13   48.885  2107.66   59.342  316.698   3.7425  319.159   4.5081 -2.461578 5.859097 
1 1 1    8   24    9 o   77.749   3.2727  125.333   10.457  112.584   14.731  138.283   14.846   73.743   4.8432   81.755   4.4029 -8.012146 6.545412 
1 1 1    8   24   10 o  173.555   2.5994  614.490   17.726  649.091   30.433  596.727   21.806  177.146   4.1654  169.964   3.1107 7.182892 5.198728 
1 1 1    8   24   11 o  166.426   2.7577  575.903   18.545  556.448   29.059  589.271   24.087  163.993   4.2962  168.858   3.4586 -4.865814 5.515380 
1 1 1    8   24   12 o  103.495   2.3215  221.390   9.9048  213.202   13.998  229.601   14.017  101.574   3.3413  105.415   3.2240 -3.841629 4.643060 
1 1 1    8   24   13 o  200.505   2.5676  834.052   20.930  849.315   27.520  813.111   32.235  202.733   3.2912  198.277   3.9418 4.455551 5.135173 
1 1 1    8   24   14 o  127.005   2.7997  333.256   14.654  322.814   20.248  344.742   21.236  124.921   3.9299  129.089   3.9885 -4.167061 5.599325 
1 1 1    8   24   15 o  123.929   2.5498  317.140   12.625  315.662   15.964  319.609   20.628  123.588   3.1319  124.271   4.0246 -0.6833572 5.099644 
1 1 1    8   24   16 o  196.577   3.2982  798.956   26.741  798.956   26.741   0.0000   0.0000  196.577   3.2982  ?   ?       ?      ? 
1 1 1    8   24   17 o   53.306   3.7478   58.245   8.1818   52.387   10.821   66.063   12.501   50.224   5.2240   56.389   5.3753 -6.164120 7.495580 
1 1 1    8   24   18 o   75.244   5.4159  117.095   11.612  116.479   12.505  120.959   31.295   74.980   4.0436   75.508   10.049 -0.5282059 10.83182 
1 1 1    8   24   19 o   60.765   7.4098   92.080   11.409   96.159   12.227   64.614   31.727   68.093   4.3535   53.437   14.166 14.65584 14.81961 
1 1 1    8   24   20 o  110.392   3.0583  255.144   13.710  267.357   18.139  238.872   20.937  113.570   3.8724  107.214   4.7348 6.356064 6.116698 
1 1 1    8   24   21 o   89.069   3.2001  167.731   11.368  177.069   14.589  153.297   18.139   92.383   3.8290   85.754   5.1285 6.629295 6.400185 
1 1 1    8   24   22 o  132.146   3.1069  363.684   16.907  386.362   23.882  340.899   23.938  136.318   4.2477  127.974   4.5353 8.344170 6.213868 
1 1 1    8   24   23 o  159.783   2.9955  530.198   19.689  515.454   26.741  547.654   29.096  157.403   4.1191  162.163   4.3502 -4.759903 5.990902 
1 1 1    8   24   24 o  122.645   3.3483  314.098   16.930  327.020   24.230  301.771   23.666  125.121   4.6951  120.168   4.7749 4.953690 6.696573 
1 1 1    8   24   25 o  162.832   3.1902  557.371   20.945  573.756   27.153  533.299   32.912  166.029   3.9652  159.635   4.9987 6.393753 6.380394 
1 1 1    8   24   26 o   52.485   4.8017   59.721   9.8695   62.371   12.354   55.047   16.409   54.409   5.5052   50.560   7.8688 3.849880 9.603379 
1 1 1    8   24   27 o   76.674   3.7256  121.784   11.361  116.070   14.148  132.158   19.061   74.384   4.6115   78.964   5.8527 -4.580269 7.451206 
1 1 1    8   24   28 o   96.978   3.4810  195.100   13.700  183.025   17.637  213.469   21.753   93.381   4.5792  100.576   5.2440 -7.194420 6.961937 
1 1 1    8   24   29 o   70.755   8.9589  119.979   13.687  120.342   14.289  115.930   47.657   75.719   4.5754   65.792   17.324 9.927086 17.91790 
1 1 1    8   24   30 o   74.662   4.1601  123.510   11.757  132.214   14.388  106.028   20.392   79.318   4.3982   70.005   7.0626 9.313072 8.320129 
1 1 1    8   24   31 o   51.350   5.9220   62.943   10.589   68.106   12.581   50.395   19.614   56.621   5.3872   46.080   10.548 10.54108 11.84393 
1 1 1    8   24   32 o   28.613   7.8449   14.399   13.742   4.4231   20.329   22.793   18.647   25.384   10.875   31.842   11.309 -6.457802 15.68976 
1 1 1    8   24   33 o   66.865   5.0759   99.929   12.567  102.687   14.982   93.383   23.081   69.394   5.2346   64.337   8.6982 5.056992 10.15185 
1 1 1    8   24   34 o   33.142   7.0359   28.016   10.431   32.034   12.259   17.480   19.854   37.023   8.2402   29.261   11.407 7.761765 14.07176 
1 1 1    8   24   35 o   19.688   6.3478  -3.0356   9.6062  -2.4476   10.865  -5.1417   20.562   17.025   7.5993   22.351   10.170 -5.325882 12.69557 
1 1 1    8   24   36 o   58.737   7.4664   84.334   17.320   58.462   22.968  118.439   26.370   46.761   11.884   70.712   9.0419 -23.95074 14.93281 
1 1 1    8   24   37 o   45.677   8.3505   45.017   11.821   40.237   12.677   76.866   32.720   41.413   7.7056   49.941   14.817 -8.527939 16.70109 
1 1 1    8   24   38 o   47.078   7.4185   58.106   15.157   30.502   20.943   88.467   21.964   33.393   11.972   60.764   8.7639 -27.37129 14.83694 
1 1 1    8   24   39 o   48.122   6.7897   52.477   11.604   45.834   13.274   74.010   23.898   44.450   7.2407   51.795   11.488 -7.345406 13.57940 
1 1 1    8   24   40 o   23.045   7.3826  -0.4827   15.669 -14.2711   23.116   11.238   21.312   20.565   9.8079   25.526   11.037 -4.960577 14.76516 
1 1 1    8   24   41 o   25.795   7.3398   15.249   10.731   14.137   12.258   18.899   22.201   24.178   9.0759   27.411   11.538 -3.233328 14.67963 
1 1 1    8   25    0 o   64.177   2.5573   85.835   9.5035   85.835   9.5035   85.835   9.5035   64.177   3.6166   64.177   3.6166 0.000000 0.000000 
1 1 1    8   25    1 o   42.604   3.2434   37.500   5.6944   35.949   7.8638   39.210   8.2569   41.679   4.5745   43.528   4.5992 -1.848568 6.486804 
1 1 1    8   25    2 o   52.628   2.7689   57.337   5.9817   50.376   8.3744   64.589   8.5471   49.355   4.1139   55.900   3.7071 -6.545326 5.537800 
1 1 1    8   25    3 o   65.477   4.0276   79.603   9.9325  148.604   17.087   44.391   12.206   84.718   4.8903   46.237   6.4008 38.48098 8.055192 
1 1 1    8   25    4 f   95.750   2.9154  190.334   11.453  181.359   16.845  198.051   15.619   93.626   4.3621   97.874   3.8692 -4.247749 5.830840 
1 1 1    8   25    5 o   58.148   2.8302   69.761   6.7763   72.609   9.9391   67.286   9.2628   59.252   4.0670   57.044   3.9370 2.208199 5.660450 
1 1 1    8   25    6 o  166.515   2.3032  574.302   15.778  536.909   22.575  610.004   22.059  161.190   3.3957  171.840   3.1124 -10.65016 4.606304 
1 1 1    8   25    7 o  189.848   2.4430  739.205   18.493  723.315   23.221  766.760   30.577  187.129   3.0086  192.566   3.8499 -5.437576 4.886091 
1 1 1    8   25    8 o  208.672   2.7685  882.427   21.804  856.903   25.859  945.226   40.561  203.667   3.0784  213.677   4.6024 -10.00986 5.536977 
1 1 1    8   25    9 o  114.877   2.4704  280.063   10.937  294.892   13.478  251.479   18.712  119.499   2.7347  110.256   4.1149 9.242516 4.940715 
1 1 1    8   25   10 o   73.978   3.1567  120.594   8.9651  140.333   11.434   89.095   14.444   82.403   3.3642   65.552   5.3425 16.85166 6.313497 
1 1 1    8   25   11 o  257.452   3.0746  1328.25   31.084  1237.71   37.927  1513.47   54.247  244.640   3.7589  270.265   4.8666 -25.62509 6.149203 
1 1 1    8   25   12 o  117.952   2.2443  286.449   10.886  319.505   15.895  257.246   14.939  124.343   3.0993  111.561   3.2468 12.78165 4.488576 
1 1 1    8   25   13 o   22.077   4.7406   7.3380   4.8490   18.057   8.5957   2.3350   5.8726   28.858   7.2353   15.295   6.1272 13.56279 9.481189 
1 1 1    8   25   14 o   70.044   3.0955  100.489   8.8861   87.091   11.905  117.344   13.353   64.827   4.4525   75.262   4.3016 -10.43411 6.191043 
1 1 1    8   25   15 o   79.515   5.8502  155.574   14.211  171.174   16.045   98.812   30.606   90.884   4.2805   68.146   10.889 22.73788 11.70044 
1 1 1    8   25   16 o   78.340   3.2542  126.696   10.406  123.070   13.681  131.674   16.031   77.046   4.3052   79.633   4.8810 -2.587219 6.508341 
1 1 1    8   25   17 o  118.507   2.7555  287.724   13.105  277.589   16.577  304.615   21.400  115.811   3.4704  121.204   4.2810 -5.392998 5.510950 
1 1 1    8   25   18 o   70.836   3.3033  106.538   9.4075  117.866   12.446   91.442   14.368   75.395   4.0025   66.277   5.2563 9.117470 6.606660 
1 1 1    8   25   19 o   53.621   7.3035   58.822   11.249   57.159   12.113   69.248   30.325   52.313   5.6140   54.929   13.485 -2.616528 14.60695 
1 1 1    8   25   20 o  113.824   5.8772  271.475   15.182  270.703   15.855  279.988   52.661  114.285   3.3638  113.363   11.263 0.9216843 11.75445 
1 1 1    8   25   21 o   38.166   5.2568   32.239   7.9180   35.631   10.336   27.420   12.318   41.186   6.0846   35.146   8.5740 6.040039 10.51365 
1 1 1    8   25   22 o   22.158   5.8461   6.9227   7.2588   2.4978   9.4185   13.396   11.392   18.481   7.6260   25.834   8.8629 -7.352291 11.69218 
1 1 1    8   25   23 o   41.319   6.6395   37.871   10.771   40.340   17.725   36.425   13.563   42.131   10.289   40.506   8.3942 1.625168 13.27893 
1 1 1    8   25   24 o   39.327   5.6010   35.043   8.6616   39.545   11.157   28.214   13.741   43.261   6.2531   35.393   9.2942 7.867790 11.20194 
1 1 1    8   25   25 o   63.628   4.0882   83.384   10.385   77.102   12.943   94.741   17.402   60.512   5.1859   66.744   6.3214 -6.232380 8.176420 
1 1 1    8   25   26 o   18.841   5.6183   0.8846   7.7832   6.5293   9.4273 -11.2005   13.794   20.529   7.8996   17.154   7.9910 3.374407 11.23652 
1 1 1    8   25   27 o   78.676   3.6811  129.953   11.718  127.277   15.105  133.998   18.572   77.827   4.7056   79.525   5.6621 -1.697914 7.362190 
1 1 1    8   25   28 o   75.293   4.1229  119.998   12.249  119.118   15.239  121.605   20.588   75.217   4.9122   75.369   6.6229 -0.1514969 8.245729 
1 1 1    8   25   29 o   57.798   7.5479   73.831   11.824   72.398   12.654   83.696   33.191   58.434   5.2503   57.161   14.153 1.272968 15.09582 
1 1 1    8   25   30 o   32.306   6.7230   24.183   9.0345   24.942   10.614   22.187   17.212   33.097   7.8875   31.515   10.890 1.582293 13.44603 
1 1 1    8   25   31 f   63.147   4.8814   92.341   11.226  100.822   13.517   73.485   20.154   69.009   4.7490   57.286   8.5299 11.72337 9.762809 
1 1 1    8   25   32 o   42.750   7.8012   44.838   13.831   48.108   20.293   42.001   18.900   44.156   11.143   41.343   10.921 2.812946 15.60232 
1 1 1    8   25   33 o   78.549   4.2499  133.460   12.996  132.392   15.949  135.568   22.420   78.742   4.9110   78.357   6.9374 0.3843765 8.499721 
1 1 1    8   25   34 o   32.897   7.2113   25.354   9.9021   24.019   11.494   29.197   19.500   31.754   8.5752   34.040   11.597 -2.285805 14.42266 
1 1 1    8   25   35 o   28.860   7.0807   11.541   9.9848   1.9426   11.549   39.951   19.869   19.035   8.1772   38.685   11.562 -19.64920 14.16140 
1 1 1    8   25   36 o   24.198   6.8485   4.1504   9.6416  -3.1760   11.187   25.314   19.013   16.847   7.5996   31.549   11.395 -14.70210 13.69701 
1 1 1    8   25   37 o   20.051   6.4244  -1.0443   9.6610  -1.2666   10.942  -0.2577   20.579   17.228   7.6624   22.874   10.314 -5.646006 12.84870 
1 1 1    8   25   38 o   26.344   7.2048   14.724   9.9740   12.572   11.514   21.194   19.963   23.697   8.8157   28.990   11.398 -5.292492 14.40960 
1 1 1    8   25   39 o   16.464   5.7207 -15.7652   9.3638 -16.8767   10.389 -10.9511   21.620   12.415   6.0741   20.512   9.6958 -8.096707 11.44134 
1 1 1    8   25   40 o   39.933   7.2468   47.462   12.007   51.617   13.993   35.862   23.383   46.562   7.2865   33.305   12.529 13.25603 14.49366 
1 1 1    8   26    0 o   44.340   3.2261   41.893   8.1414   41.893   8.1414   41.893   8.1414   44.340   4.5624   44.340   4.5624 0.000000 0.000000 
1 1 1    8   26    1 o  149.844   2.6671  464.722   16.097  466.437   20.673  462.082   25.656  150.239   3.3362  149.450   4.1622 0.7884827 5.334203 
1 1 1    8   26    2 o  122.789   3.0349  314.383   13.126  316.638   15.086  307.358   26.629  123.812   2.9543  121.766   5.3023 2.046310 6.069824 
1 1 1    8   26    3 o  144.293   2.5616  430.586   15.222  461.317   21.656  400.576   21.400  149.394   3.5146  139.192   3.7277 10.20209 5.123292 
1 1 1    8   26    4 o  309.097   2.6450  1972.80   33.664  1932.11   46.100  2019.29   49.275  305.704   3.6562  312.489   3.8232 -6.784363 5.290056 
1 1 1    8   26    5 o  140.544   2.5137  388.379   14.126  331.936   17.537  492.645   23.835  126.734   3.3550  154.354   3.7440 -27.62006 5.027334 
1 1 1    8   26    6 o  198.983   2.2019  817.849   18.063  851.569   25.764  785.256   25.331  203.019   3.0769  194.946   3.1504 8.073639 4.403703 
1 1 1    8   26    7 o  190.561   3.0996  768.695   22.957  806.199   28.489  699.248   38.768  197.474   3.4979  183.648   5.1182 13.82625 6.199293 
1 1 1    8   26    8 o   67.477   3.0583   88.638   8.0184   78.771   9.6140  111.186   14.534   61.709   3.7773   73.245   4.8109 -11.53590 6.116637 
1 1 1    8   26    9 o   57.001   3.6447   70.822   7.8961   77.620   9.7527   57.886   13.453   61.248   3.8607   52.754   6.1830 8.494221 7.289385 
1 1 1    8   26   10 o   66.718   3.0551   89.823   7.8292   85.938   9.3888   98.691   14.185   64.459   3.5315   68.976   4.9862 -4.516891 6.110128 
1 1 1    8   26   11 o   74.514   3.0472  104.035   8.4721   91.211   9.8105  141.653   16.803   66.399   3.5823   82.629   4.9303 -16.22989 6.094342 
1 1 1    8   26   12 f  175.597   2.4813  634.013   17.908  591.299   24.130  686.387   26.720  169.062   3.4605  182.133   3.5570 -13.07060 4.962608 
1 1 1    8   26   13 o  138.005   2.2260  393.707   12.662  413.589   18.092  374.618   17.728  141.424   3.1018  134.586   3.1937 6.838669 4.452048 
1 1 1    8   26   14 o   99.884   2.5890  208.255   10.431  215.322   13.547  197.961   16.349  102.027   3.2193   97.740   4.0557 4.286789 5.178046 
1 1 1    8   26   15 o   73.622   3.1503  111.127   9.4760  103.312   12.418  122.020   14.662   70.580   4.2658   76.665   4.6369 -6.085434 6.300659 
1 1 1    8   26   16 o  102.891   5.1399  221.704   21.501  217.858   28.033  227.199   33.509  101.965   6.6659  103.817   7.8257 -1.852219 10.27986 
1 1 1    8   26   17 o   74.930   3.2165  116.685   9.9159  115.501   13.526  118.059   14.579   74.540   4.3997   75.319   4.6932 -0.7795258 6.432972 
1 1 1    8   26   18 o   76.802   3.0930  125.161   9.5521  136.857   12.583  109.253   14.675   81.208   3.7567   72.396   4.9147 8.811928 6.185996 
1 1 1    8   26   19 o   93.941   3.8186  190.978   14.191  157.122   22.244  214.216   18.429   86.452   6.2385  101.430   4.4053 -14.97818 7.637120 
1 1 1    8   26   20 o   32.389   5.6729   23.426   7.4272   24.351   9.4946   21.967   11.923   33.292   7.1295   31.486   8.8259 1.806793 11.34577 
1 1 1    8   26   21 o   26.315   7.6726   8.4729   8.6027   8.8552   8.9809   4.2187   29.960   21.866   7.8397   30.763   13.192 -8.897287 15.34527 
1 1 1    8   26   22 o   23.010   5.6191   9.5514   7.0744   16.197   9.4442   1.0554   10.679   27.212   7.9295   18.807   7.9635 8.405199 11.23811 
1 1 1    8   26   23 o   70.049   4.2141  102.430   12.038  113.090   18.785   95.000   15.682   73.015   6.2379   67.084   5.6677 5.930801 8.428160 
1 1 1    8   26   24 o   82.671   4.1155  146.078   13.803  116.033   19.445  176.591   19.596   73.799   6.3884   91.543   5.1902 -17.74345 8.231037 
1 1 1    8   26   25 o   45.276   4.8978   42.176   8.7209   33.191   10.992   57.442   14.327   38.750   7.1406   51.803   6.7058 -13.05268 9.795683 
1 1 1    8   26   26 o   74.705   4.5225  123.088   13.353   86.866   19.364  155.927   18.438   63.439   7.4008   85.971   5.1999 -22.53117 9.044917 
1 1 1    8   26   27 o   29.918   6.5260   19.022   8.5899   15.649   10.685   25.183   14.443   26.743   8.5634   33.093   9.8501 -6.350353 13.05203 
1 1 1    8   26   28 o   85.605   4.9779  164.305   16.891  128.287   25.590  192.114   22.486   76.301   8.1316   94.910   5.7443 -18.60877 9.955883 
1 1 1    8   26   29 o   62.385   4.2359   83.981   10.244   85.204   12.586   81.580   17.634   63.482   4.8069   61.288   6.9760 2.193581 8.471792 
1 1 1    8   26   30 o   30.896   8.4422   8.2622   9.0933   4.9853   9.4667   47.360   32.700   19.461   7.7853   42.331   14.982 -22.86994 16.88437 
1 1 1    8   26   31 o   45.668   5.9143   47.829   9.7999   48.122   11.626   47.111   18.217   47.205   5.9712   44.131   10.211 3.073547 11.82854 
1 1 1    8   26   32 o   41.693   7.0183   42.982   14.064   11.987   20.259   71.814   19.540   27.283   11.213   56.103   8.4442 -28.82058 14.03659 
1 1 1    8   26   33 o   18.215   6.1325 -18.5102   12.873 -28.7406   19.229 -10.2022   17.328   17.111   8.3484   19.319   8.9852 -2.207869 12.26500 
1 1 1    8   26   34 o   30.352   7.2047   19.123   9.7492   13.660   11.372   34.277   18.939   24.755   8.8273   35.949   11.389 -11.19424 14.40949 
1 1 1    8   26   35 o   27.545   7.3413   13.218   9.7399   8.8540   10.998   29.081   20.969   21.884   8.5012   33.205   11.971 -11.32142 14.68258 
1 1 1    8   26   36 o   21.861   6.5904   5.8427   9.5827   7.0985   11.048   2.0276   19.256   20.848   8.3855   22.873   10.169 -2.024736 13.18075 
1 1 1    8   26   37 o   26.578   6.7177   17.894   9.8427   22.825   11.405   3.5074   19.481   30.101   8.6976   23.054   10.240 7.047098 13.43549 
1 1 1    8   26   38 o   30.398   8.4017   9.0902   10.874   1.7123   11.582   63.912   31.573   18.494   8.0656   42.302   14.741 -23.80821 16.80337 
1 1 1    8   26   39 o   21.643   6.7726   2.5101   10.214  -1.3293   11.703   14.780   20.921   17.298   7.7906   25.989   11.081 -8.691055 13.54522 
1 1 1    8   27    0 o   19.194   5.8378   10.889   6.7038   10.889   6.7038   10.889   6.7038   19.194   8.2559   19.194   8.2559 0.000000 0.000000 
1 1 1    8   27    1 o   70.182   2.5026  101.319   7.2225   91.765   9.8384  112.486   10.637   66.610   3.5811   73.753   3.4967 -7.142982 5.005126 
1 1 1    8   27    2 o   49.298   3.3319   48.038   6.4903   58.505   11.278   42.855   7.9361   53.103   5.1495   45.493   4.2295 7.609253 6.663825 
1 1 1    8   27    3 o   88.789   2.7913  162.754   10.164  159.489   13.606  166.877   15.289   87.799   3.7573   89.779   4.1289 -1.980148 5.582610 
1 1 1    8   27    4 o   83.459   2.4558  139.853   8.3221  178.710   13.035  113.117   10.813   92.965   3.3996   73.953   3.5449 19.01185 4.911591 
1 1 1    8   27    5 o  174.514   2.2888  629.259   16.241  627.419   21.240  631.850   25.199  174.243   2.9556  174.785   3.4956 -0.5412292 4.577622 
1 1 1    8   27    6 o  130.782   2.1355  354.974   11.465  389.097   16.074  319.634   16.358  137.224   2.8401  124.341   3.1898 12.88274 4.270926 
1 1 1    8   27    7 o  183.154   2.6335  714.089   18.909  766.799   23.865  625.187   30.994  192.607   3.0042  173.701   4.3262 18.90691 5.266961 
1 1 1    8   27    8 o  190.384   3.9478  717.286   21.010  704.726   22.471  804.581   59.239  184.645   2.9506  196.123   7.3235 -11.47772 7.895525 
1 1 1    8   27    9 o  108.189   4.6838  242.862   20.900  242.862   20.900   0.0000   0.0000  108.189   4.6838  ?   ?       ?      ? 
1 1 1    8   27   10 o  126.211   2.7796  331.760   14.349  346.176   19.348  314.140   21.389  129.316   3.6276  123.106   4.2126 6.210411 5.559273 
1 1 1    8   27   11 o  133.641   3.6828  369.792   20.300  369.792   20.300   0.0000   0.0000  133.641   3.6828  ?   ?       ?      ? 
1 1 1    8   27   12 o   90.240   3.0528  167.853   11.267  161.217   14.875  176.783   17.256   88.187   4.0898   92.292   4.5334 -4.104721 6.105530 
1 1 1    8   27   13 o   54.083   3.4172   57.742   7.0581   53.181   8.3687   68.981   13.136   50.639   4.0069   57.526   5.5366 -6.886696 6.834427 
1 1 1    8   27   14 o  107.370   2.2664  237.030   10.001  215.891   13.507  262.680   14.879  102.108   3.2073  112.631   3.2029 -10.52300 4.532721 
1 1 1    8   27   15 o  121.806   3.5789  307.654   17.980  307.654   17.980   0.0000   0.0000  121.806   3.5789  ?   ?       ?      ? 
1 1 1    8   27   16 o  149.749   2.5383  458.659   15.289  437.124   19.371  494.234   24.898  145.238   3.2338  154.261   3.9132 -9.022934 5.076520 
1 1 1    8   27   17 o  119.415   2.6718  296.397   13.004  297.338   17.142  295.121   19.957  119.706   3.4720  119.124   4.0619 0.5822830 5.343562 
1 1 1    8   27   18 o   61.287   3.3820   78.389   8.5252   70.699   11.854   86.629   12.270   58.149   4.9425   64.424   4.6177 -6.274719 6.764006 
1 1 1    8   27   19 o   74.701   3.1171  114.415   9.4726  105.117   12.241  128.291   14.955   71.027   4.1787   78.375   4.6264 -7.348511 6.234153 
1 1 1    8   27   20 o   22.699   5.4943   10.010   6.2456   7.5726   8.6102   12.717   9.0732   20.811   7.6452   24.586   7.8930 -3.775049 10.98851 
1 1 1    8   27   21 f   65.460   3.3194   90.475   8.8178   94.290   11.634   85.325   13.518   67.196   4.1977   63.724   5.1432 3.472591 6.638781 
1 1 1    8   27   22 o   71.447   6.3938  118.644   11.798  120.708   12.678  105.295   32.234   76.007   4.0441   66.887   12.131 9.120659 12.78756 
1 1 1    8   27   23 o   55.149   3.8517   63.773   8.6009   61.733   11.076   66.872   13.650   54.161   4.9584   56.138   5.8954 -1.976711 7.703341 
1 1 1    8   27   24 o   24.778   6.5450   10.375   9.6663  -2.7738   16.360   17.427   11.981   21.344   9.4369   28.212   9.0715 -6.868107 13.08996 
1 1 1    8   27   25 o   27.485   5.9058   17.195   7.5359   21.398   9.5401   10.221   12.289   30.869   7.5547   24.101   9.0796 6.767437 11.81156 
1 1 1    8   27   26 o   50.026   4.4157   53.477   8.7981   53.000   11.081   54.290   14.471   49.970   5.3766   50.081   7.0061 -0.1103668 8.831385 
1 1 1    8   27   27 o   79.652   3.7660  135.754   12.229  143.354   16.414  126.272   18.335   82.380   4.8309   76.924   5.7788 5.455994 7.532076 
1 1 1    8   27   28 o   14.099   4.7633 -11.9057   7.4229  -7.9572   8.9096 -20.8653   13.421   13.598   6.3633   14.601   7.0899 -1.003373 9.526691 
1 1 1    8   27   29 o   23.465   6.3341   9.4420   8.0174   8.4234   9.6384   11.730   14.445   21.517   8.0537   25.413   9.7785 -3.895807 12.66811 
1 1 1    8   27   30 o   85.723   3.5634  156.207   12.011  154.578   14.875  159.259   20.360   85.523   4.2171   85.923   5.7452 -0.3993530 7.126838 
1 1 1    8   27   31 o   30.112   6.9743   24.071   10.087   28.904   10.633 -19.4062   31.890   35.390   7.5166   24.834   11.750 10.55627 13.94866 
1 1 1    8   27   32 o   24.209   6.2201   12.481   8.5161   17.580   10.033  -0.6644   16.110   27.364   8.2243   21.054   9.3337 6.310745 12.44018 
1 1 1    8   27   33 o   44.608   7.0216   51.847   13.426   27.989   19.438   73.610   18.566   32.790   11.557   56.427   7.9774 -23.63705 14.04314 
1 1 1    8   27   34 o   28.232   6.6962   9.0295   9.7257  -3.1969   11.432   41.068   18.505   17.012   7.6775   39.452   10.973 -22.43986 13.39248 
1 1 1    8   27   35 o   26.585   6.7066   17.400   9.7355   22.202   11.369   4.1922   18.853   29.911   8.6954   23.260   10.213 6.651058 13.41330 
1 1 1    8   27   36 o   16.318   5.3808  -7.2448   8.7913  -0.5464   10.141 -27.5112   17.639   16.771   7.4216   15.865   7.7931 0.9059420 10.76160 
1 1 1    8   27   37 o   29.985   7.2377   20.128   10.003   13.417   11.770   37.585   18.983   24.004   8.9164   35.967   11.403 -11.96254 14.47531 
1 1 1    8   27   38 o   38.588   7.2980   40.094   10.711   38.407   12.251   45.569   22.065   39.365   7.8211   37.811   12.324 1.554768 14.59597 
1 1 1    8   28    0 o   55.864   2.6404   65.341   8.5154   65.341   8.5154   65.341   8.5154   55.864   3.7340   55.864   3.7340 0.000000 0.000000 
1 1 1    8   28    1 o  125.355   2.1957  326.418   11.287  342.171   15.403  308.147   16.589  128.658   2.9027  122.052   3.2953 6.605927 4.391429 
1 1 1    8   28    2 o   92.604   2.6995  177.720   10.302  184.067   14.475  171.205   14.665   94.290   3.7222   90.917   3.9109 3.372604 5.399078 
1 1 1    8   28    3 o   96.572   2.4862  195.729   9.5501  204.124   12.156  182.193   15.436   99.364   2.9662   93.779   3.9907 5.585098 4.972326 
1 1 1    8   28    4 o   48.306   2.9497   48.864   5.6526   66.916   8.2375   32.799   7.7710   56.862   3.5124   39.751   4.7398 17.11082 5.899395 
1 1 1    8   28    5 o  222.865   2.4274  1023.28   21.923  1004.11   28.347  1051.81   34.583  220.346   3.1192  225.383   3.7203 -5.037552 4.854848 
1 1 1    8   28    6 o  183.016   3.1016  703.152   21.666  717.728   26.243  671.951   38.395  186.236   3.4165  179.798   5.1775 6.438080 6.203193 
1 1 1    8   28    7 o   98.157   2.9435  196.634   11.804  222.588   18.294  178.121   15.451  103.605   4.2812   92.708   4.0407 10.89666 5.886973 
1 1 1    8   28    8 o   85.156   4.6218  167.632   13.102  181.821   15.076  123.832   26.488   93.671   3.9023   76.641   8.3794 17.03041 9.243514 
1 1 1    8   28    9 o   48.906   4.6890   50.114   9.3625   49.778   14.259   50.369   12.413   48.708   7.0979   49.104   6.1291 -0.3954811 9.377990 
1 1 1    8   28   10 o   28.528   6.2891   17.186   8.5177   10.328   12.744   22.722   11.451   24.877   9.2707   32.180   8.5008 -7.302048 12.57817 
1 1 1    8   28   11 f   91.850   5.1478  189.535   16.426  201.628   19.095  155.129   32.209   98.432   4.7036   85.269   9.1583 13.16286 10.29556 
1 1 1    8   28   12 o   33.108   5.8996   23.748   8.0637   19.539   10.792   29.068   12.132   29.898   8.4030   36.318   8.2831 -6.419886 11.79912 
1 1 1    8   28   13 o   63.471   3.8322   84.116   9.7731   83.808   12.480   84.604   15.716   63.417   4.7713   63.526   5.9982 -0.1087418 7.664435 
1 1 1    8   28   14 o   58.183   3.9445   73.782   9.0724   87.412   12.063   56.038   13.765   64.776   4.5154   51.590   6.4689 13.18510 7.888962 
1 1 1    8   28   15 o   58.521   4.8237   71.522   11.643   71.522   11.643   0.0000   0.0000   58.521   4.8237  ?   ?       ?      ? 
1 1 1    8   28   16 o   28.391   4.2681   19.312   5.6693   0.9846   8.6942   32.869   7.4777   17.102   7.2104   39.681   4.5690 -22.57929 8.536173 
1 1 1    8   28   17 o   33.835   6.2146   33.951   9.0875   40.604   9.5258 -33.3892   30.307   44.015   5.2473   23.654   11.267 20.36043 12.42911 
1 1 1    8   28   18 o  117.595   2.9412  288.323   14.259  279.886   20.229  296.653   20.102  115.863   4.2332  119.328   4.0845 -3.464912 5.882446 
1 1 1    8   28   19 o   48.708   3.7857   49.313   7.5061   39.290   10.068   61.854   11.263   43.148   5.6574   54.268   5.0319 -11.11969 7.571429 
1 1 1    8   28   20 o   60.188   3.4387   75.774   8.5136   68.950   11.626   83.663   12.501   57.266   4.9225   63.110   4.8028 -5.843662 6.877328 
1 1 1    8   28   21 o   53.449   3.5618   59.195   7.7883   51.203   10.309   69.823   11.888   49.306   5.0692   57.592   5.0048 -8.286098 7.123543 
1 1 1    8   28   22 o   17.387   5.0678   2.1261   5.9688   4.7259   8.2327  -0.7549   8.6664   18.631   7.3214   16.143   7.0090 2.487972 10.13553 
1 1 1    8   28   23 o   54.403   9.0866   74.799   10.822   75.575   11.144   61.944   45.376   60.019   4.5016   48.788   17.607 11.23040 18.17324 
1 1 1    8   28   24 o   26.161   5.9351   14.965   7.2186   15.207   9.5621   14.644   11.007   26.209   8.0608   26.114   8.7134 0.9574890E-01 11.87013 
1 1 1    8   28   25 o   34.186   6.8768   26.878   9.8696   28.440   16.553   26.017   12.294   34.783   10.589   33.589   8.7770 1.194080 13.75358 
1 1 1    8   28   26 o   74.507   3.4942  117.790   10.412  118.611   13.239  116.459   16.856   75.092   4.2746   73.921   5.5286 1.170456 6.988405 
1 1 1    8   28   27 f   73.651   3.6982  107.868   10.726   91.507   13.018  142.455   18.927   65.715   4.8029   81.588   5.6247 -15.87298 7.396304 
1 1 1    8   28   28 o   47.579   4.7012   46.975   8.9075   40.827   10.995   58.716   15.194   43.457   6.1343   51.701   7.1256 -8.243736 9.402320 
1 1 1    8   28   29 o   43.863   5.3813   38.484   9.0447   18.932   11.121   76.694   15.546   28.471   8.6818   59.256   6.3609 -30.78561 10.76265 
1 1 1    8   28   30 o   52.396   4.5770   60.034   9.3298   59.465   11.444   61.161   16.110   52.567   5.2786   52.226   7.4788 0.3413086 9.154000 
1 1 1    8   28   31 o   16.124   5.1381  -5.4266   7.8039   3.1644   9.0200 -30.9981   15.562   17.903   7.4313   14.344   7.0976 3.559221 10.27618 
1 1 1    8   28   32 o   21.522   6.1969   7.0740   8.5650   9.8796   10.355   0.9958   15.241   22.196   8.3398   20.849   9.1680 1.346600 12.39375 
1 1 1    8   28   33 o   32.637   6.0637   28.878   9.4349   38.018   11.350   8.4320   16.975   41.153   6.6868   24.121   10.117 17.03183 12.12740 
1 1 1    8   28   34 o   24.269   7.5006   3.2367   14.144   17.729   22.531  -6.1886   18.170   28.383   11.760   20.154   9.3133 8.228607 15.00117 
1 1 1    8   28   35 o   27.310   6.9981   17.217   9.2932   15.112   10.865   22.955   17.937   25.070   8.6526   29.550   11.001 -4.480497 13.99612 
1 1 1    8   28   36 o   31.265   6.4978   28.192   9.9129   35.399   11.808   10.985   18.245   38.005   7.7945   24.526   10.399 13.47862 12.99555 
1 1 1    8   28   37 o   39.113   8.0065   45.156   12.054   44.792   13.155   47.065   30.108   42.605   7.7725   35.620   14.000 6.984844 16.01308 
1 1 1    8   29    0 o   14.718   5.4986   6.5225   6.3097   6.5225   6.3097   6.5225   6.3097   14.718   7.7763   14.718   7.7763 0.000000 0.000000 
1 1 1    8   29    1 o   25.182   4.4435   13.701   4.6536   17.076   6.7091   10.572   6.4604   28.076   5.9772   22.289   6.5766 5.786659 8.886956 
1 1 1    8   29    2 o  147.565   2.3381  453.423   13.899  463.393   17.944  438.470   21.976  149.671   2.9068  145.459   3.6631 4.212143 4.676250 
1 1 1    8   29    3 o  152.872   2.2182  483.296   13.818  481.040   18.167  486.392   21.284  152.492   2.8885  153.252   3.3673 -0.7603760 4.436488 
1 1 1    8   29    4 o  103.251   2.2196  220.828   9.3485  221.669   12.354  219.702   14.300  103.510   2.8937  102.991   3.3665 0.5191269 4.439226 
1 1 1    8   29    5 o   89.509   2.1654  167.790   7.8997  186.378   10.811  146.492   11.572   94.922   2.7613   84.095   3.3364 10.82650 4.330840 
1 1 1    8   29    6 o   75.667   2.9746  118.274   8.8503  121.148   15.058  116.758   10.939   76.284   4.7858   75.050   3.5341 1.233864 5.949280 
1 1 1    8   29    7 o   56.712   5.5773   61.100   11.632   53.719   13.354   84.297   23.675   50.598   6.3992   62.826   9.1366 -12.22749 11.15468 
1 1 1    8   29    8 o  100.830   2.8486  209.636   11.778  197.854   15.676  224.907   17.847   97.624   3.8933  104.036   4.1593 -6.411652 5.697115 
1 1 1    8   29    9 o  119.520   3.0151  298.573   14.779  277.952   21.582  316.783   20.281  115.551   4.5285  123.490   3.9819 -7.938972 6.030199 
1 1 1    8   29   10 o   60.558   4.3308   75.940   10.733   86.014   16.476   68.513   14.147   63.977   6.2442   57.139   6.0029 6.837791 8.661679 
1 1 1    8   29   11 o   73.343   3.8196  111.032   11.372  121.358   18.038  104.221   14.650   76.060   5.7500   70.626   5.0292 5.433846 7.639107 
1 1 1    8   29   12 o   26.326   6.6649   12.637   8.6519   15.129   15.553   11.520   10.412   28.360   10.297   24.291   8.4651 4.068810 13.32971 
1 1 1    8   29   13 o   81.383   3.1720  140.137   10.481  153.574   14.110  123.595   15.656   85.897   3.9828   76.868   4.9381 9.028885 6.344089 
1 1 1    8   29   14 f   25.755   5.0429   8.3123   7.4531  -9.7698   10.054   30.369   11.104   14.369   6.7355   37.140   7.5072 -22.77147 10.08588 
1 1 1    8   29   15 o   37.839   5.3433   31.688   8.0052   33.232   10.798   29.805   11.928   39.043   6.9607   36.636   8.1087 2.407578 10.68658 
1 1 1    8   29   16 o   32.954   7.9901   11.322   9.0990   7.0674   9.6164   47.705   28.120   21.065   8.0088   44.843   13.828 -23.77849 15.98014 
1 1 1    8   29   17 o  104.364   4.2284  229.736   14.441  229.047   16.116  232.544   32.530  104.827   3.7275  103.901   7.5911 0.9266739 8.456845 
1 1 1    8   29   18 o   35.688   4.1961   27.996   5.8844   23.782   8.8737   31.303   7.8615   32.796   6.7839   38.580   4.9405 -5.783970 8.392291 
1 1 1    8   29   19 o  100.648   3.9144  221.383   15.455  187.440   24.926  242.582   19.698   93.721   6.4483  107.574   4.4397 -13.85352 7.828866 
1 1 1    8   29   20 o   65.741   3.2542   90.529   8.8128   86.300   12.105   95.298   12.855   64.117   4.5775   67.365   4.6267 -3.247063 6.508437 
1 1 1    8   29   21 o   30.568   5.3717   20.565   6.7116   24.625   10.292   17.561   8.8531   33.113   7.6840   28.022   7.5083 5.091433 10.74330 
1 1 1    8   29   22 o   69.637   3.2604   98.168   9.1761   82.604   11.654  123.555   14.884   62.682   4.5080   76.593   4.7116 -13.91113 6.520823 
1 1 1    8   29   23 o   65.402   3.4734   89.500   9.1285   86.466   11.582   94.474   14.831   64.118   4.3798   66.687   5.3923 -2.568893 6.946853 
1 1 1    8   29   24 o   56.333   7.8721   86.852   11.311   90.527   12.029   58.817   33.227   65.566   4.4484   47.101   15.103 18.46480 15.74427 
1 1 1    8   29   25 o   32.339   5.7475   23.925   7.5727   23.172   9.8788   24.998   11.792   31.862   7.6201   32.816   8.6062 -0.9534988 11.49491 
1 1 1    8   29   26 o   31.039   7.3821   20.969   10.285   25.523   19.738   19.271   12.050   33.104   11.648   28.974   9.0719 4.130274 14.76429 
1 1 1    8   29   27 o   24.420   5.8638   13.055   7.6463   18.578   9.3916   2.1964   13.169   28.348   7.7915   20.491   8.7651 7.857096 11.72751 
1 1 1    8   29   28 o   36.746   6.0085   31.915   8.5600   32.171   10.488   31.404   14.815   37.631   7.0152   35.861   9.7569 1.770111 12.01708 
1 1 1    8   29   29 o   47.197   5.2831   43.487   9.3040   26.085   11.176   82.771   16.792   33.197   8.2088   61.198   6.6528 -28.00036 10.56621 
1 1 1    8   29   30 o   35.585   6.3807   28.065   9.3336   18.563   11.557   45.889   15.828   27.819   8.9055   43.351   9.1403 -15.53165 12.76143 
1 1 1    8   29   31 o   20.049   5.7934   4.3780   8.2302   10.971   9.7925 -11.4834   15.188   22.661   8.1791   17.438   8.2073 5.222380 11.58689 
1 1 1    8   29   32 o   61.752   9.3675  117.252   14.874  119.412   15.654   97.166   47.732   74.122   5.1204   49.382   18.022 24.74070 18.73493 
1 1 1    8   29   33 o   20.545   5.8832   4.0017   9.0454   14.260   11.037 -16.9871   15.787   24.635   8.7058   16.455   7.9157 8.180000 11.76643 
1 1 1    8   29   34 o   23.953   8.2985  -5.2214   10.022  -7.1527   10.276   32.330   45.313   14.652   6.8493   33.254   15.118 -18.60197 16.59695 
1 1 1    8   29   35 o   23.733   7.9491  -7.7270   20.595 -15.1654   27.756   1.3846   30.720   22.016   10.566   25.450   11.879 -3.433565 15.89811 
1 1 1    8   29   36 o   26.190   8.3561   5.3722   20.700   30.530   28.286 -23.6361   30.374   30.896   13.015   21.484   10.484 9.411850 16.71228 
1 1 1    8   30    0 o   49.100   2.7747   50.838   7.8296   50.838   7.8296   50.838   7.8296   49.100   3.9240   49.100   3.9240 0.000000 0.000000 
1 1 1    8   30    1 o  161.359   2.4179  540.097   16.086  530.388   22.906  549.544   22.596  159.913   3.4730  162.804   3.3651 -2.890656 4.835871 
1 1 1    8   30    2 o   55.900   3.1879   62.059   6.9392   56.556   8.3643   74.207   12.428   52.180   3.8866   59.621   5.0541 -7.441929 6.375705 
1 1 1    8   30    3 o  125.840   2.1746  325.639   11.127  314.260   14.455  342.189   17.432  123.203   2.8447  128.476   3.2898 -5.273079 4.349102 
1 1 1    8   30    4 o   60.930   2.4180   74.437   5.9633   58.570   7.7170   97.954   9.3951   53.129   3.5217   68.732   3.3142 -15.60257 4.835938 
1 1 1    8   30    5 o   79.107   2.8923  130.641   8.8414  128.762   15.431  131.559   10.788   78.563   4.7621   79.652   3.2838 -1.088600 5.784549 
1 1 1    8   30    6 o   93.620   2.7931  187.355   10.128  166.492   17.090  198.648   12.574   89.344   4.6377   97.895   3.1141 -8.550697 5.586198 
1 1 1    8   30    7 o  116.953   3.6310  279.949   16.479  268.452   19.966  304.514   29.185  113.528   4.2640  120.378   5.8783 -6.849243 7.262008 
1 1 1    8   30    8 o   54.239   7.1394   91.047   12.473   25.488   26.895  109.011   14.079   36.231   13.474   72.246   4.7248 -36.01431 14.27884 
1 1 1    8   30    9 o   54.721   4.5188   65.143   9.7915   55.008   15.442   71.959   12.663   50.842   7.3639   58.600   5.2393 -7.757668 9.037515 
1 1 1    8   30   10 o   45.389   4.8701   43.905   8.5894   29.956   11.532   61.285   12.873   36.798   7.8384   53.979   5.7820 -17.18153 9.740170 
1 1 1    8   30   11 o   91.807   2.9320  174.120   10.996  165.671   14.438  185.788   16.966   89.226   3.9233   94.388   4.3582 -5.162621 5.863970 
1 1 1    8   30   12 o   22.535   5.7496   9.2423   6.9057   11.420   9.6247   6.9312   9.9140   23.862   8.1471   21.208   8.1153 2.654116 11.49925 
1 1 1    8   30   13 o   71.712   3.9806  108.896   11.515  105.533   18.122  111.173   14.913   70.610   6.2227   72.813   4.9657 -2.203316 7.961179 
1 1 1    8   30   14 o   57.892   7.2125   71.878   17.222   71.878   17.222   0.0000   0.0000   57.892   7.2125  ?   ?       ?      ? 
1 1 1    8   30   15 o   17.847   5.5414  -3.3317   8.3002 -21.3135   15.267   4.2129   9.8893   16.113   7.7595   19.581   7.9132 -3.467941 11.08282 
1 1 1    8   30   16 o   76.776   5.3007  140.013   12.236  147.495   13.577  107.631   28.244   84.040   3.9168   69.513   9.8514 14.52771 10.60145 
1 1 1    8   30   17 o   37.003   7.6542   31.482   9.8468   32.272   10.516   25.863   28.047   38.265   6.9180   35.741   13.656 2.524113 15.30833 
1 1 1    8   30   18 o   29.777   7.5450   17.768   9.0758   18.693   9.6126   10.172   27.543   28.867   7.8614   30.687   12.880 -1.820559 15.09002 
1 1 1    8   30   19 o   52.044   8.6978   42.881   10.265   39.370   10.587   98.047   41.962   43.034   5.9650   61.055   16.341 -18.02118 17.39564 
1 1 1    8   30   20 o   44.345   3.5113   41.411   6.3458   33.376   8.6998   50.548   9.2766   39.684   5.3152   49.006   4.5896 -9.321350 7.022538 
1 1 1    8   30   21 o   43.516   3.7071   39.955   6.6347   44.180   9.7687   36.337   9.0395   45.653   5.1880   41.379   5.2966 4.273891 7.414102 
1 1 1    8   30   22 o   33.314   4.7524   24.684   6.3001   26.370   9.1526   23.165   8.6850   34.429   6.6865   32.199   6.7553 2.230019 9.504898 
1 1 1    8   30   23 o   21.981   5.4523   9.5999   6.2426   6.3511   8.9996   12.613   8.6666   19.951   7.7068   24.011   7.7147 -4.059523 10.90466 
1 1 1    8   30   24 o   37.529   4.7510   30.490   7.1111   23.786   9.4374   39.296   10.816   32.374   7.2485   42.685   6.1438 -10.31101 9.501904 
1 1 1    8   30   25 o   42.269   7.7775   45.909   9.6404   46.904   10.090   35.475   32.676   46.831   5.2236   37.706   14.652 9.125000 15.55499 
1 1 1    8   30   26 o   17.811   5.2811   2.3283   6.5657   4.1421   8.7140  -0.0538   9.9860   18.328   7.4207   17.293   7.5161 1.035145 10.56214 
1 1 1    8   30   27 o   40.852   6.1439   40.118   10.014   34.259   15.819   44.037   12.936   37.201   10.066   44.503   7.0478 -7.301628 12.28778 
1 1 1    8   30   28 o   55.616   5.9822   81.019   11.776   31.525   17.147  125.206   16.201   35.068   10.796   76.165   5.1574 -41.09719 11.96442 
1 1 1    8   30   29 o   20.951   5.9547   5.9443   7.5756   3.1301   9.3643   11.274   12.888   18.043   7.5373   23.859   9.2208 -5.816212 11.90939 
1 1 1    8   30   30 o   27.679   6.4569   17.713   8.1294   16.129   9.8415   21.116   14.424   26.089   8.2033   29.268   9.9735 -3.179577 12.91378 
1 1 1    8   30   31 o   69.005   7.4535  134.550   15.854  147.983   18.274   93.654   31.885   82.155   5.3929   55.855   13.897 26.30093 14.90692 
1 1 1    8   30   32 o   28.502   8.1588   8.7296   10.077   3.7046   10.696   48.416   30.059   18.901   7.9848   38.104   14.230 -19.20285 16.31752 
1 1 1    8   30   33 f   24.982   8.5838 -19.1977   25.528  -4.1198   44.711 -26.4903   31.095   27.979   13.423   21.986   10.702 5.992479 17.16752 
1 1 1    8   30   34 o   23.028   7.7735 -11.8834   20.446 -22.5186   27.474   1.3175   30.609   20.812   10.115   25.243   11.807 -4.431084 15.54703 
1 1 1    8   30   35 o   18.411   6.5037 -47.9052   20.277 -45.0525   27.472 -51.3192   30.054   18.201   9.0761   18.621   9.3175 -0.4209385 13.00732 
1 1 1    8   31    0 o   55.571   2.5758   64.747   8.2669   64.747   8.2669   64.747   8.2669   55.571   3.6428   55.571   3.6428 0.000000 0.000000 
1 1 1    8   31    1 o   90.684   2.1294  170.317   7.9600  163.208   11.059  177.959   11.466   88.721   3.0223   92.647   3.0007 -3.926086 4.258873 
1 1 1    8   31    2 o   47.748   3.3319   45.737   6.1109   42.696   7.2981   52.872   11.178   45.296   3.9065   50.201   5.3986 -4.904659 6.663726 
1 1 1    8   31    3 o  122.659   3.0327  326.830   12.704  338.190   14.527  289.898   26.193  127.771   2.7567  117.548   5.4027 10.22350 6.065346 
1 1 1    8   31    4 o   63.961   3.1029   84.803   7.6871   86.865   13.481   83.810   9.3575   64.411   5.0744   63.510   3.5724 0.9013710 6.205714 
1 1 1    8   31    5 o   49.162   3.5711   49.918   6.4790   52.122   12.419   49.094   7.5944   49.739   6.0538   48.586   3.7898 1.152458 7.142208 
1 1 1    8   31    6 o   64.303   3.6463   87.054   9.6069   81.911   14.156   91.445   13.080   62.466   5.4945   66.140   4.7949 -3.674282 7.292553 
1 1 1    8   31    7 o   92.363   4.2597  182.516   15.366  188.845   19.109  170.932   25.850   95.008   4.8764   89.718   6.9858 5.289940 8.519402 
1 1 1    8   31    8 o   83.859   4.4734  146.888   15.472   0.0000   0.0000  146.888   15.472  ?   ?    83.859   4.4734      ?      ? 
1 1 1    8   31    9 o   53.171   3.7891   59.455   8.2676   59.225   11.140   59.738   12.335   53.109   5.0858   53.234   5.6181 -0.1249962 7.578191 
1 1 1    8   31   10 o   28.519   5.8924   17.741   7.3321   15.333   9.7121   20.933   11.180   26.492   8.1199   30.546   8.5412 -4.054028 11.78490 
1 1 1    8   31   11 o   34.894   5.3194   26.922   7.4166   23.800   10.019   30.707   11.031   32.614   7.5907   37.174   7.4542 -4.559765 10.63874 
1 1 1    8   31   12 o   37.769   5.0346   31.930   7.5412   37.365   10.207   25.398   11.190   41.976   5.8958   33.561   8.1625 8.415169 10.06911 
1 1 1    8   31   13 o   23.532   5.7467   11.214   6.7782   12.082   9.1194   10.143   10.132   23.980   7.9278   23.085   8.3216 0.8953419 11.49346 
1 1 1    8   31   14 o   23.801   5.4381   8.6384   6.8918  -0.8278   9.0173   21.935   10.687   16.435   7.1427   31.167   8.2022 -14.73248 10.87628 
1 1 1    8   31   15 o   86.151   3.0123  155.765   10.535  157.374   13.781  153.503   16.342   86.809   3.8491   85.494   4.6345 1.314651 6.024508 
1 1 1    8   31   16 o   16.006   5.0196  -2.4959   6.5709  -2.2260   8.8803  -2.8226   9.7683   15.713   6.9497   16.298   7.2448 -0.5853472 10.03917 
1 1 1    8   31   17 o   50.866   5.7028   57.271   10.468   57.236   19.465   57.284   12.416   49.827   9.8209   51.906   5.7998 -2.078854 11.40565 
1 1 1    8   31   18 o   49.534   8.8005   40.722   10.071   37.618   10.386   89.634   41.228   41.945   6.0033   57.123   16.546 -15.17715 17.60096 
1 1 1    8   31   19 o   34.341   7.7829   23.478   9.1289   22.370   9.6910   32.211   27.200   31.428   7.5669   37.254   13.603 -5.825346 15.56588 
1 1 1    8   31   20 o   28.089   7.2483   16.715   9.0666   18.814   9.6019  -0.5512   27.540   28.764   7.8668   27.415   12.176 1.349463 14.49654 
1 1 1    8   31   21 o   31.702   6.6214   26.922   9.5722   32.087   10.125 -16.5715   29.381   38.537   6.3699   24.867   11.610 13.67029 13.24273 
1 1 1    8   31   22 o   49.041   3.4257   50.961   6.8511   41.444   9.4452   61.529   9.9526   44.112   5.1915   53.970   4.4712 -9.857937 6.851489 
1 1 1    8   31   23 o   67.984   3.0457   95.218   8.4292   81.550   10.926  115.317   13.249   62.126   4.2639   73.841   4.3502 -11.71498 6.091373 
1 1 1    8   31   24 o   23.465   5.2153   11.851   6.0722   5.0959   8.7674   18.079   8.4181   18.903   7.5149   28.028   7.2334 -9.124733 10.43054 
1 1 1    8   31   25 o   55.488   3.7510   65.844   8.5560   59.785   11.591   73.098   12.683   52.689   5.3337   58.288   5.2756 -5.598701 7.502056 
1 1 1    8   31   26 o   72.694   3.3621  106.870   9.6994   91.576   11.902  137.115   16.737   65.573   4.4007   79.814   5.0843 -14.24180 6.724298 
1 1 1    8   31   27 o   30.520   7.7606   3.8193   8.4096  -1.6694   8.7999   61.622   28.557   15.463   6.8747   45.576   13.916 -30.11318 15.52117 
1 1 1    8   31   28 o   38.778   8.8371   34.936   13.571   28.934   15.151   59.279   30.516   33.689   10.103   43.867   14.502 -10.17805 17.67427 
1 1 1    8   31   29 o   26.627   7.8030   9.3133   9.4992   6.8273   10.085   28.869   28.286   20.276   8.0601   32.978   13.364 -12.70202 15.60607 
1 1 1    8   31   30 o   25.179   8.3814  -6.3549   20.360 -11.6965   24.404   5.8787   36.932   21.866   10.325   28.492   13.205 -6.626055 16.76275 
1 1 1    8   31   31 o   33.398   8.9909   19.646   20.173 -15.7989   26.522   68.302   31.074   21.904   10.463   44.892   14.624 -22.98843 17.98171 
1 1 1    8   31   32 o   31.616   9.6104   29.746   23.971   3.7704   43.432   41.124   28.745   28.317   13.488   34.914   13.693 -6.597450 19.22075 
1 1 1    8   31   33 o   35.048   10.057   46.769   22.851   48.891   26.814   41.139   43.679   37.281   13.522   32.815   14.889 4.465836 20.11317 
1 1 1    8   31   34 o   32.377   8.8694   24.849   20.075 -11.8245   27.403   67.332   29.493   22.010   10.546   42.744   14.263 -20.73350 17.73878 
1 1 1    8   32    0 o   56.880   3.1478   68.423   10.296   68.423   10.296   68.423   10.296   56.880   4.4517   56.880   4.4517 0.000000 0.000000 
1 1 1    8   32    1 o   69.035   2.5949   98.249   7.1248   95.487   8.9045  103.165   11.878   67.787   3.1849   70.284   4.0975 -2.497429 5.189769 
1 1 1    8   32    2 o   38.672   3.0497   31.789   4.7724   34.818   6.3730   27.923   7.2009   40.866   3.7811   36.478   4.7862 4.388206 6.099490 
1 1 1    8   32    3 o  129.241   2.5796  350.885   13.011  338.930   22.144  357.189   16.079  127.323   4.2168  131.158   2.9724 -3.835091 5.159108 
1 1 1    8   32    4 o  102.494   2.7135  219.296   11.037  218.677   18.268  219.651   13.850  102.218   4.3331  102.771   3.2674 -0.5529022 5.426944 
1 1 1    8   32    5 o   17.959   4.7759   5.6539   4.3765  -0.7591   10.255   7.0820   4.8393   17.573   7.6272   18.346   5.7498 -0.7723942 9.551704 
1 1 1    8   32    6 o   37.381   5.8246   34.806   8.5710   19.513   15.020   42.191   10.437   30.107   10.178   44.655   5.6669 -14.54873 11.64930 
1 1 1    8   32    7 o   34.232   7.1260   25.713   9.3424   25.471   10.441   26.684   20.924   33.723   7.6787   34.741   12.006 -1.018150 14.25197 
1 1 1    8   32    8 o   99.356   3.1348  207.191   12.782  203.471   18.947  210.298   17.316   98.451   4.6661  100.261   4.1876 -1.810165 6.269642 
1 1 1    8   32    9 o   27.915   5.2225   17.021   6.9380   28.505   9.6282   4.6160   10.006   35.975   6.7365   19.855   7.9824 16.12074 10.44505 
1 1 1    8   32   10 o   41.887   4.8085   39.864   7.6534   45.276   9.8366   31.562   12.183   46.336   5.1471   37.437   8.1236 8.899326 9.616926 
1 1 1    8   32   11 o   31.767   5.3346   22.669   6.8192   23.000   8.9238   22.203   10.572   32.173   6.9297   31.360   8.1123 0.8129082 10.66914 
1 1 1    8   32   12 o   71.431   6.0326  139.054   11.052  152.059   12.166   77.666   26.433   85.437   3.4525   57.425   11.561 28.01247 12.06515 
1 1 1    8   32   13 o   68.167   3.0926   89.815   8.2978   73.240   10.060  125.082   14.675   59.161   4.1230   77.174   4.6105 -18.01302 6.185144 
1 1 1    8   32   14 o   54.841   3.5658   58.227   7.7034   46.034   9.3608   83.811   13.559   46.732   4.8566   62.950   5.2224 -16.21798 7.131567 
1 1 1    8   32   15 o   23.982   7.1790   0.0839   7.0981  -1.9514   7.4028   23.290   24.997   14.306   6.3355   33.658   12.885 -19.35181 14.35793 
1 1 1    8   32   16 o   50.343   3.8074   52.145   7.7027   46.836   9.6730   61.346   12.734   47.056   4.9840   53.630   5.7571 -6.573772 7.614777 
1 1 1    8   32   17 o   74.350   3.3392  116.986   10.121  118.785   13.403  114.600   15.438   75.155   4.3239   73.545   5.0896 1.609970 6.678336 
1 1 1    8   32   18 o   60.478   4.3546   77.059   10.862   77.059   10.862   0.0000   0.0000   60.478   4.3546  ?   ?       ?      ? 
1 1 1    8   32   19 o   79.954   5.1945  138.336   14.771  136.400   17.026  144.228   29.701   80.067   5.1558   79.842   9.0193 0.2254410 10.38894 
1 1 1    8   32   20 o  131.089   4.2233  379.927   21.616  406.095   27.203  335.101   35.604  138.389   4.7660  123.789   6.9735 14.60044 8.446582 
1 1 1    8   32   21 o   77.022   5.7589  142.748   12.305  147.003   13.365  119.078   31.526   83.566   3.8777   70.478   10.845 13.08789 11.51778 
1 1 1    8   32   22 o   54.091   8.5276   66.792   10.751   65.306   11.179   85.083   39.222   55.297   4.9015   52.886   16.336 2.411301 17.05516 
1 1 1    8   32   23 o   29.853   7.6248   19.049   9.3150   19.169   9.8993   18.122   27.522   28.603   8.0508   31.102   12.951 -2.498852 15.24950 
1 1 1    8   32   24 o   45.576   4.1632   46.666   7.4474   39.989   11.986   50.865   9.5047   42.394   6.8551   48.758   4.7264 -6.363449 8.326491 
1 1 1    8   32   25 o   36.102   7.1084   34.800   9.1206   36.340   9.6723   22.445   27.396   40.728   5.7580   31.476   12.999 9.251966 14.21686 
1 1 1    8   32   26 o   29.424   8.2989   17.332   9.7765   17.555   10.069   13.653   40.889   27.128   8.2584   31.720   14.397 -4.592155 16.59786 
1 1 1    8   32   27 o   25.847   8.2052   1.2017   17.975  -8.3163   23.364   15.006   28.137   22.435   10.434   29.259   12.666 -6.823702 16.41050 
1 1 1    8   32   28 o   21.955   7.3706 -14.3653   18.012 -10.8590   24.076 -18.8217   27.143   21.973   10.339   21.938   10.507 0.3560448E-01 14.74112 
1 1 1    8   32   29 o   34.856   9.8551   37.623   20.613   36.276   24.614   40.787   37.720   34.653   12.890   35.059   14.911 -0.4060211 19.71021 
1 1 1    8   32   30 o   27.880   8.8427   12.050   21.161   21.597   30.734   3.4432   29.180   29.919   13.091   25.840   11.891 4.079044 17.68533 
1 1 1    8   32   31 o   26.212   8.4090   9.6753   19.514   9.5594   25.539   9.8377   30.246   25.709   11.550   26.715   12.224 -1.005827 16.81792 
1 1 1    8   32   32 o   26.873   8.9908   7.0235   24.556   6.6627   47.084   7.1582   28.780   28.175   13.583   25.571   11.783 2.604040 17.98155 
1 1 1    8   33    0 o   37.268   3.2054   30.123   6.6931   30.123   6.6931   30.123   6.6931   37.268   4.5332   37.268   4.5332 0.000000 0.000000 
1 1 1    8   33    1 o   22.318   4.3959   11.740   4.5757   15.975   5.6064   3.2912   7.9188   27.092   5.2065   17.544   7.0842 9.548492 8.791714 
1 1 1    8   33    2 o   77.754   2.7707  126.321   8.3161  126.261   14.587  126.350   10.122   77.562   4.5600   77.946   3.1485 -0.3835144 5.541382 
1 1 1    8   33    3 o   17.433   4.6291   0.4078   4.1916   12.450   9.0151  -2.9136   4.7345   24.194   7.8768   10.672   4.8651 13.52254 9.258144 
1 1 1    8   33    4 f   52.895   3.5135   61.849   6.8557   51.948   12.369   66.239   8.2366   49.417   6.0688   56.373   3.5426 -6.955597 7.027084 
1 1 1    8   33    5 o  120.751   3.3924  302.949   15.597  316.253   28.341  297.169   18.680  122.194   5.6234  119.309   3.7962 2.885437 6.784832 
1 1 1    8   33    6 o   58.093   3.4039   70.917   8.1322   63.882   11.318   78.426   11.692   55.077   4.9825   61.110   4.6390 -6.032955 6.807772 
1 1 1    8   33    7 f  106.997   3.4322  238.200   13.426  235.176   15.668  246.558   26.046  106.213   3.5765  107.781   5.8590 -1.567627 6.864388 
1 1 1    8   33    8 o   74.349   3.2949  116.423   10.058  103.707   14.204  129.211   14.245   70.192   4.9063   78.505   4.3993 -8.313118 6.589869 
1 1 1    8   33    9 o  101.886   4.6895  222.004   19.438  272.941   28.359  176.864   26.696  113.200   6.0740   90.572   7.1465 22.62810 9.379014 
1 1 1    8   33   10 o   71.679   4.8038  115.485   13.198   95.126   22.025  126.892   16.486   65.890   8.1045   77.467   5.1596 -11.57722 9.607537 
1 1 1    8   33   11 o   64.459   4.5662   78.017   11.076  119.498   21.854   63.678   12.849   74.238   7.1374   54.680   5.6973 19.55795 9.132430 
1 1 1    8   33   12 o   27.444   6.9101   14.531   8.8465   18.808   17.735   13.115   10.207   30.038   10.982   24.851   8.3904 5.187109 13.82012 
1 1 1    8   33   13 o   62.208   5.1992   84.920   12.324   82.367   21.838   86.113   14.928   60.855   8.7005   63.560   5.6946 -2.704552 10.39844 
1 1 1    8   33   14 o   33.046   7.2004   18.162   9.7384   43.826   20.625   10.800   11.047   42.407   11.501   23.684   8.6660 18.72298 14.40074 
1 1 1    8   33   15 o   32.498   8.5179   14.142   16.480  -5.3781   21.085   44.789   26.420   23.111   10.428   41.885   13.471 -18.77454 17.03583 
1 1 1    8   33   16 o   47.574   6.0700   74.821   12.130  -1.3854   22.889  104.585   14.305   24.946   11.089   70.202   4.9403 -45.25632 12.13991 
1 1 1    8   33   17 o  166.101   4.5804  592.445   30.778  627.221   49.027  569.826   39.541  169.383   7.0179  162.819   5.8881 6.563507 9.160780 
1 1 1    8   33   18 o   48.062   7.3413   61.264   12.647   42.563   25.464   67.387   14.572   40.416   13.242   55.707   6.3422 -15.29145 14.68254 
1 1 1    8   33   19 o   55.917   3.7360   68.176   7.8939   70.044   9.5269   64.085   14.100   57.617   4.0090   54.216   6.3055 3.401146 7.472048 
1 1 1    8   33   20 o   40.274   7.0211   45.659   8.8952   48.233   9.4136   24.200   27.181   47.542   4.8008   33.005   13.196 14.53639 14.04215 
1 1 1    8   33   21 o   22.980   7.1726   0.3369   7.8333  -1.4799   8.2148   18.542   26.004   15.131   6.6888   30.828   12.690 -15.69691 14.34514 
1 1 1    8   33   22 o   41.652   7.2243   51.996   13.510   64.439   15.601   14.678   27.016   53.667   7.0481   29.638   12.613 24.02898 14.44858 
1 1 1    8   33   23 o   75.599   5.3087  125.996   11.955  124.052   13.019  136.454   30.194   76.336   4.1349   74.862   9.7791 1.474373 10.61739 
1 1 1    8   33   24 o   44.924   9.4224   59.068   18.936   64.659   25.251   51.884   28.624   48.303   12.558   41.545   14.051 6.758568 18.84477 
1 1 1    8   33   25 o   59.684   10.031  102.783   22.740   99.624   26.574  111.423   43.945   63.263   10.184   56.105   17.285 7.158424 20.06214 
1 1 1    8   33   26 o   24.591   7.9697  -0.8345   18.140   0.9875   23.742  -3.3894   28.115   24.285   11.002   24.897   11.533 -0.6126614 15.93930 
1 1 1    8   33   27 o   29.569   8.8203   18.296   18.358   7.4655   23.915   33.831   28.643   25.581   11.355   33.556   13.500 -7.975784 17.64062 
1 1 1    8   33   28 o   26.360   8.3222   5.0968   18.655  -9.7127   24.778   24.476   28.345   22.150   10.442   30.571   12.961 -8.421490 16.64437 
1 1 1    8   33   29 o   26.286   8.5530   6.9072   19.769   4.3922   23.573   12.867   36.290   24.170   10.955   28.402   13.138 -4.232588 17.10604 
1 1 1    8   33   30 o   31.243   8.2780   19.157   18.838   60.545   25.926 -27.1313   27.418   42.382   13.313   20.103   9.8423 22.27873 16.55596 
1 1 1    8   33   31 o   27.837   8.5360   12.718   18.924  -8.9760   24.955   42.077   29.031   21.643   10.285   34.031   13.626 -12.38811 17.07205 
1 1 1    8   34    0 o   15.407   5.7972   7.3083   7.0524   7.3083   7.0524   7.3083   7.0524   15.407   8.1985   15.407   8.1985 0.000000 0.000000 
1 1 1    8   34    1 o   41.604   3.9383   35.938   6.6816   43.338   10.394   30.727   8.7228   45.170   5.5791   38.038   5.5600 7.132126 7.876522 
1 1 1    8   34    2 o   47.775   3.5160   49.156   6.2743   45.850   11.434   50.581   7.5052   46.352   5.9807   49.199   3.6987 -2.846386 7.031972 
1 1 1    8   34    3 o   89.116   2.7452  162.026   9.6870  181.031   16.521  152.069   11.958   92.844   4.3145   85.387   3.3955 7.456505 5.490372 
1 1 1    8   34    4 o   38.831   4.5642   32.051   5.7267   34.400   12.746   31.457   6.4101   38.917   8.1998   38.744   4.0114 0.1734390 9.128432 
1 1 1    8   34    5 o   91.828   3.0207  177.557   11.397  171.501   16.685  182.856   15.606   90.272   4.4814   93.384   4.0517 -3.112289 6.041468 
1 1 1    8   34    6 o  105.002   3.6484  227.597   15.241  211.999   18.919  256.435   25.726  100.312   4.5729  109.692   5.6862 -9.380577 7.296844 
1 1 1    8   34    7 o   89.499   4.6609  174.335   16.939  206.284   23.825  141.675   24.089   98.272   5.8782   80.726   7.2350 17.54586 9.321883 
1 1 1    8   34    8 o   40.925   6.3618   35.987   10.738   0.0000   0.0000   35.987   10.738  ?   ?    40.925   6.3618      ?      ? 
1 1 1    8   34    9 o   68.940   4.2937   97.278   11.227  113.625   21.018   90.750   13.281   72.369   7.0415   65.511   4.9154 6.857430 8.587416 
1 1 1    8   34   10 o   41.921   6.2072   39.019   9.8360   42.475   17.876   37.518   11.780   42.239   10.343   41.602   6.8652 0.6374550 12.41443 
1 1 1    8   34   11 o   50.094   5.8501   56.640   10.332   56.056   19.853   56.856   12.099   48.624   10.224   51.564   5.6891 -2.940430 11.70026 
1 1 1    8   34   12 o   50.944   6.1441   64.524   10.764   47.130   20.049   71.567   12.758   43.944   11.068   57.944   5.3383 -13.99982 12.28815 
1 1 1    8   34   13 o   30.595   7.0325   21.962   9.8012   16.268   19.062   24.009   11.427   29.019   11.214   32.171   8.4890 -3.151665 14.06509 
1 1 1    8   34   14 o   33.404   7.2327   22.983   9.6547   35.854   19.891   19.016   11.043   38.058   11.612   28.750   8.6257 9.308260 14.46533 
1 1 1    8   34   15 o   43.376   8.1374   50.645   17.209   74.717   22.304   15.234   27.052   56.016   10.022   30.737   12.823 25.27908 16.27475 
1 1 1    8   34   16 o   34.588   8.1271   27.929   11.398   0.0000   0.0000   27.929   11.398  ?   ?    34.588   8.1271      ?      ? 
1 1 1    8   34   17 o   22.478   6.7861   4.7834   9.1487   4.7673   21.155   4.7871   10.147   25.335   10.975   19.621   7.9843 5.714043 13.57225 
1 1 1    8   34   18 o   46.072   7.0009   48.566   11.115   56.467   23.958   46.399   12.547   46.251   12.333   45.892   6.6285 0.3585243 14.00179 
1 1 1    8   34   19 o   33.552   7.2780   30.368   10.751   11.581   26.234   34.161   11.787   28.765   12.340   38.338   7.7210 -9.573795 14.55604 
1 1 1    8   34   20 o   29.998   7.4547   20.855   10.259   22.866   21.695   20.276   11.643   30.999   11.968   28.997   8.8910 2.001638 14.90934 
1 1 1    8   34   21 o   36.445   9.2678   38.571   19.254   49.346   23.479   16.444   33.647   41.936   12.576   30.953   13.616 10.98336 18.53559 
1 1 1    8   34   22 o   49.431   9.2950   69.824   20.037   91.969   28.845   49.175   27.853   58.239   12.389   40.624   13.860 17.61519 18.58993 
1 1 1    8   34   23 o   30.558   8.7051   18.507   17.122   5.4458   22.224   37.578   26.856   25.106   11.055   36.009   13.450 -10.90277 17.41018 
1 1 1    8   34   24 o   29.599   9.2847   15.552   22.524   2.7779   39.320   21.790   27.479   28.760   13.429   30.438   12.825 -1.677559 18.56941 
1 1 1    8   34   25 o   32.219   9.7175   13.905   19.748  -2.5034   22.503   68.874   41.187   22.796   10.472   41.642   16.372 -18.84638 19.43500 
1 1 1    8   34   26 o   26.915   8.3740   10.604   17.755   3.4805   23.117   20.852   27.726   24.239   10.930   29.592   12.690 -5.353163 16.74802 
1 1 1    8   34   27 o   48.216   8.4967   74.974   19.423  101.471   25.646   39.331   29.745   62.280   9.9839   34.152   13.751 28.12776 16.99348 
1 1 1    8   34   28 o   24.546   8.0348   2.1032   18.758  -3.7389   24.152   10.986   29.781   22.433   10.491   26.659   12.172 -4.226423 16.06954 
1 1 1    8   34   29 o   21.751   7.4340 -20.3397   20.074 -38.6140   27.088   1.9199   29.896   18.658   9.2555   24.844   11.636 -6.186031 14.86796 
1 1 1    8   35    0 o   12.437   5.0725   4.1736   5.9317   4.1736   5.9317   4.1736   5.9317   12.437   7.1736   12.437   7.1736 0.000000 0.000000 
1 1 1    8   35    1 o   84.214   2.6801  146.326   8.6165  154.555   15.632  142.734   10.327   85.650   4.4251   82.778   3.0248 2.872635 5.360102 
1 1 1    8   35    2 o   61.628   3.2991   78.172   8.2778   95.373   12.979   66.378   10.747   67.191   4.6835   56.065   4.6478 11.12619 6.598217 
1 1 1    8   35    3 o   32.946   4.9176   27.770   5.7573   16.312   11.535   31.571   6.6440   27.141   8.9136   38.751   4.1569 -11.61029 9.835238 
1 1 1    8   35    4 o   44.363   4.1441   42.310   7.5439   40.620   11.100   43.761   10.284   43.439   6.1952   45.288   5.5059 -1.848370 8.288300 
1 1 1    8   35    5 o   81.489   4.1198  137.170   13.075  127.386   15.822  158.249   23.223   77.502   4.9496   85.476   6.5874 -7.974289 8.239674 
1 1 1    8   35    6 o  117.842   4.0481  296.607   19.648  316.840   28.644  278.627   27.001  121.639   5.7094  114.046   5.7403 7.593864 8.096154 
1 1 1    8   35    7 o  126.285   3.5196  335.338   16.782  346.792   30.837  330.517   20.004  127.084   5.8832  125.487   3.8651 1.596977 7.039227 
1 1 1    8   35    8 o   57.815   5.1181   71.100   12.204   0.0000   0.0000   71.100   12.204  ?   ?    57.815   5.1181      ?      ? 
1 1 1    8   35    9 o   53.715   5.4399   67.953   10.259   56.027   18.683   73.101   12.275   48.808   9.6228   58.621   5.0768 -9.813732 10.87988 
1 1 1    8   35   10 o   77.939   4.5116  134.516   13.716  121.920   22.814  141.645   17.164   74.333   7.4413   81.545   5.1035 -7.212837 9.023225 
1 1 1    8   35   11 o   79.269   4.4232  137.641   13.147  132.991   23.929  139.651   15.734   77.441   7.4919   81.096   4.7042 -3.654549 8.846333 
1 1 1    8   35   12 o   52.395   5.4690   57.282   10.583   71.311   20.902   52.445   12.273   55.621   9.1111   49.169   6.0519 6.452721 10.93792 
1 1 1    8   35   13 o   51.521   6.0940   58.058   11.259   69.285   22.000   54.074   13.106   53.310   10.379   49.732   6.3895 3.578331 12.18801 
1 1 1    8   35   14 o   44.437   6.7306   44.791   10.619   51.901   21.822   42.585   12.155   44.907   11.674   43.967   6.7028 0.9402885 13.46111 
1 1 1    8   35   15 o   51.010   8.4022   67.499   17.279   69.314   23.103   65.194   26.030   52.583   11.006   49.438   12.699 3.145466 16.80449 
1 1 1    8   35   16 o   22.556   8.4383   9.9888   10.578   0.0000   0.0000   9.9888   10.578  ?   ?    22.556   8.4383      ?      ? 
1 1 1    8   35   17 f   88.253   5.2582  182.972   15.706  162.238   32.081  189.509   18.012   82.426   9.4365   94.081   4.6419 -11.65518 10.51647 
1 1 1    8   35   18 o   64.499   6.6955  107.150   13.540   87.050   28.061  113.249   15.458   56.715   12.346   72.284   5.1850 -15.56911 13.39106 
1 1 1    8   35   19 o   44.690   7.0573   62.518   12.205   23.756   26.363   73.093   13.770   31.658   12.875   57.722   5.7840 -26.06370 14.11451 
1 1 1    8   35   20 o   58.148   8.4665   92.364   20.545  138.966   29.756   49.906   28.402   75.645   9.5373   40.652   13.992 34.99317 16.93308 
1 1 1    8   35   21 o   38.593   6.7253   44.320   11.511   15.582   22.671   54.302   13.361   28.051   11.724   49.135   6.5930 -21.08330 13.45054 
1 1 1    8   35   22 o   29.573   8.9010   19.386   19.006   17.163   26.101   21.894   27.730   28.808   12.332   30.339   12.839 -1.530903 17.80203 
1 1 1    8   35   23 o   26.644   8.1718   11.629   16.934   18.350   21.887   1.6060   26.729   28.203   11.630   25.084   11.483 3.119066 16.34352 
1 1 1    8   35   24 o   29.657   9.2839   18.980   22.801   3.3255   39.446   26.834   27.942   28.129   13.235   31.185   13.023 -3.055857 18.56784 
1 1 1    8   35   25 o   19.077   6.6071 -26.1847   16.445 -28.5347   20.563 -22.0151   27.391   17.154   8.4239   21.000   10.181 -3.845709 13.21425 
1 1 1    8   35   26 o   34.231   9.0326   32.627   17.918   12.321   22.787   65.528   29.005   25.649   11.246   42.812   14.138 -17.16299 18.06522 
1 1 1    8   35   27 o   19.862   6.8572 -24.3199   17.293 -34.4360   21.981  -7.8906   28.013   16.925   8.3853   22.799   10.852 -5.874834 13.71448 
1 1 1    8   36    0 o   20.780   6.3372   13.194   7.8964   13.194   7.8964   13.194   7.8964   20.780   8.9622   20.780   8.9622 0.000000 0.000000 
1 1 1    8   36    1 o   94.634   3.4864  187.604   13.608   0.0000   0.0000  187.604   13.608  ?   ?    94.634   3.4864      ?      ? 
1 1 1    8   36    2 o   73.864   5.8374  117.543   17.784   0.0000   0.0000  117.543   17.784  ?   ?    73.864   5.8374      ?      ? 
1 1 1    8   36    3 o   35.763   4.2269   28.524   5.2179   27.046   10.297   29.035   6.0527   34.386   7.4735   37.139   3.9514 -2.752922 8.453789 
1 1 1    8   36    4 o   68.925   2.9100  101.149   8.1742  108.042   11.006   92.667   12.208   71.710   3.7211   66.140   4.4750 5.569969 5.820018 
1 1 1    8   36    5 o   40.811   4.9059   35.228   7.8580   44.634   13.327   30.215   9.7292   44.938   7.1903   36.685   6.6762 8.253193 9.811805 
1 1 1    8   36    6 o   29.996   5.9876   19.369   7.5044   28.278   12.876   14.786   9.2351   34.475   8.9696   25.516   7.9341 8.959175 11.97511 
1 1 1    8   36    7 o   98.574   3.6180  202.863   13.610  221.847   24.849  194.727   16.268  101.145   5.9566   96.003   4.1084 5.142128 7.235994 
1 1 1    8   36    8 o   40.328   6.6888   35.762   11.126   0.0000   0.0000   35.762   11.126  ?   ?    40.328   6.6888      ?      ? 
1 1 1    8   36    9 o   49.032   5.6499   55.780   10.001   52.679   18.241   57.113   11.959   46.657   9.7914   51.406   5.6405 -4.749020 11.29987 
1 1 1    8   36   10 o   52.823   5.7372   65.773   11.055   58.684   19.413   69.175   13.448   49.160   9.9168   56.485   5.7724 -7.324802 11.47443 
1 1 1    8   36   11 o   55.383   5.3089   66.163   10.864   75.290   21.011   62.832   12.693   56.937   8.9470   53.829   5.7173 3.108700 10.61773 
1 1 1    8   36   12 o   35.517   6.8476   32.686   9.8726   24.255   19.757   35.492   11.398   31.704   11.591   39.330   7.2948 -7.625824 13.69524 
1 1 1    8   36   13 o   81.441   4.7755  151.521   14.807  135.193   25.537  159.790   18.174   76.778   8.0644   86.103   5.1175 -9.325249 9.551061 
1 1 1    8   36   14 o   36.111   6.9190   33.579   9.9632   29.085   19.676   35.128   11.554   33.404   11.637   38.819   7.4877 -5.415119 13.83802 
1 1 1    8   36   15 o   22.727   7.2574  -3.7969   15.074   7.3631   19.634 -19.8201   23.526   24.875   10.673   20.579   9.8366 4.296593 14.51475 
1 1 1    8   36   16 f   20.688   8.3138   6.6543   10.849   0.0000   0.0000   6.6543   10.849  ?   ?    20.688   8.3138      ?      ? 
1 1 1    8   36   17 o   66.917   6.6698  117.747   14.849   85.920   27.405  130.974   17.667   56.415   12.138   77.418   5.5329 -21.00262 13.33950 
1 1 1    8   36   18 o   30.741   7.3935   23.407   10.108   22.919   22.353   23.532   11.332   30.534   12.043   30.948   8.5797 -0.4140625 14.78701 
1 1 1    8   36   19 o   21.470   6.6968   4.0559   9.6208  -4.3533   23.691   5.7166   10.528   23.093   10.658   19.847   8.1110 3.246346 13.39354 
1 1 1    8   36   20 o   25.055   7.4623   4.9902   10.001   30.186   24.950   0.1666   10.917   32.502   12.754   17.608   7.7506 14.89435 14.92467 
1 1 1    8   36   21 o   30.868   6.5262   28.129   11.331 -12.4226   24.723   38.912   12.749   21.748   10.306   39.988   8.0091 -18.23954 13.05235 
1 1 1    8   36   22 o   39.487   8.0849   32.438   17.181  -2.5556   21.484   94.524   28.617   22.160   10.199   56.815   12.547 -34.65517 16.16984 
1 1 1    8   36   23 o   31.265   9.4040   29.378   22.641   6.0916   38.944   41.268   27.827   27.706   13.071   34.825   13.524 -7.119804 18.80806 
1 1 1    8   36   24 o   21.100   7.1366 -11.4563   16.867 -10.2901   20.916 -13.6250   28.523   19.966   9.4668   22.235   10.682 -2.269352 14.27314 
1 1 1    8   36   25 o   26.398   8.0877   13.697   17.589   26.971   22.079  -9.3596   29.099   29.907   11.914   22.889   10.941 7.017750 16.17547 
1 1 1    8   37    0 o   13.396   5.4547   5.0402   6.8416   5.0402   6.8416   5.0402   6.8416   13.396   7.7141   13.396   7.7141 0.000000 0.000000 
1 1 1    8   37    1 o   27.094   6.2733   17.731   6.9524   3.3989   21.156   19.467   7.3612   24.845   10.866   29.343   6.2725 -4.498543 12.54664 
1 1 1    8   37    2 o   42.461   4.1876   43.207   5.6011   33.490   11.658   46.124   6.3866   38.028   7.6968   46.894   3.3021 -8.865898 8.375235 
1 1 1    8   37    3 o   58.713   3.2796   72.872   7.9071   80.907   11.865   66.451   10.606   61.586   4.6709   55.839   4.6050 5.746204 6.559261 
1 1 1    8   37    4 o   17.049   5.0457  -2.5422   6.4095   9.2072   10.129 -10.3887   8.2775   21.951   8.2483   12.147   5.8139 9.804327 10.09135 
1 1 1    8   37    5 o   46.476   5.1717   50.507   8.9502   43.694   15.092   54.203   11.116   42.838   8.8354   50.114   5.3778 -7.275814 10.34335 
1 1 1    8   37    6 o   57.215   4.4005   69.531   9.7349   78.564   17.436   65.441   11.734   59.293   7.1299   55.137   5.1598 4.155510 8.801087 
1 1 1    8   37    7 o   34.663   5.9184   29.763   8.1896   23.051   14.807   32.722   9.8299   30.719   10.099   38.607   6.1732 -7.888475 11.83670 
1 1 1    8   37    8 o   51.528   10.489   66.643   21.533   0.0000   0.0000   66.643   21.533  ?   ?    51.528   10.489      ?      ? 
1 1 1    8   37    9 o   30.291   6.3020   23.816   8.6483   13.290   16.026   28.140   10.272   25.880   10.201   34.701   7.4030 -8.820993 12.60399 
1 1 1    8   37   10 o   21.081   6.2712   5.3706   8.7295  -0.2218   17.001   7.3729   10.173   21.437   9.5419   20.724   8.1404 0.7127476 12.54245 
1 1 1    8   37   11 o   24.473   5.8769   13.065   8.9593 -19.1308   18.501   22.929   10.240   18.000   8.6356   30.946   7.9735 -12.94565 11.75371 
1 1 1    8   37   12 o   28.751   7.0417   14.918   9.1455   34.004   18.809   9.0094   10.466   35.752   11.353   21.749   8.3344 14.00323 14.08338 
1 1 1    8   37   13 o   20.443   5.8372   3.6449   8.9812 -28.4833   18.567   13.458   10.262   16.542   8.0988   24.344   8.4084 -7.802069 11.67443 
1 1 1    8   37   14 o   21.144   6.5762   0.7535   9.0582   10.194   19.960  -1.6949   10.165   25.749   10.895   16.538   7.3684 9.211315 13.15234 
1 1 1    8   37   15 o   44.304   8.5360   55.211   16.938   35.619   23.607   76.000   24.318   35.294   12.704   53.314   11.404 -18.02069 17.07191 
1 1 1    8   37   16 o   34.085   8.5135   28.786   11.933   0.0000   0.0000   28.786   11.933  ?   ?    34.085   8.5135      ?      ? 
1 1 1    8   37   17 o   27.721   7.0762   19.863   10.934   4.1594   21.822   25.127   12.635   24.119   10.767   31.323   9.1845 -7.204737 14.15237 
1 1 1    8   37   18 o   33.698   7.6491   29.922   11.001   33.284   22.906   28.913   12.543   33.654   12.451   33.743   8.8886 -0.8913422E-01 15.29822 
1 1 1    8   37   19 o   17.281   5.9062  -9.4855   9.1790 -14.3900   22.865  -8.5432   10.022   20.530   9.7809   14.032   6.6230 6.498244 11.81233 
1 1 1    8   37   20 o   20.200   6.6016  -2.0289   10.209   2.9203   23.274  -3.2079   11.360   23.826   10.833   16.574   7.5482 7.252178 13.20329 
1 1 1    8   37   21 o   23.716   6.9038   11.741   10.765  -6.1239   24.407   16.056   11.995   22.151   10.419   25.280   9.0606 -3.128511 13.80752 
1 1 1    8   37   22 o   39.303   9.7077   55.281   19.541   62.149   27.687   48.465   27.583   41.916   13.812   36.689   13.646 5.226254 19.41548 
1 1 1    8   37   23 o   20.225   7.0376  -6.6318   10.600  -5.2474   37.048  -6.7553   11.063   25.296   12.158   15.155   7.0916 10.14068 14.07511 
1 1 1    8   38    0 o   12.720   5.2723   4.3614   6.5728   4.3614   6.5728   4.3614   6.5728   12.720   7.4561   12.720   7.4561 0.000000 0.000000 
1 1 1    8   38    1 o   23.966   7.1910   4.1229   7.3429   2.2449   7.6797   24.137   25.071   16.327   6.8237   31.604   12.660 -15.27611 14.38192 
1 1 1    8   38    2 o   21.252   6.8961  -1.0242   7.5457  -2.1407   7.8794   11.324   26.205   14.425   6.4528   28.079   12.190 -13.65318 13.79230 
1 1 1    8   38    3 o   23.791   6.4580   11.336   9.6165   17.986   10.277 -35.4573   27.263   27.417   8.3429   20.165   9.8601 7.251902 12.91606 
1 1 1    8   38    4 o   24.157   5.7120   13.494   6.9535   7.7434   11.160   17.142   8.8900   21.391   8.4867   26.923   7.6474 -5.532066 11.42395 
1 1 1    8   38    5 o   56.403   4.2455   70.471   9.5258   68.551   15.493   71.637   12.079   55.272   6.7961   57.535   5.0901 -2.262352 8.490932 
1 1 1    8   38    6 o   46.298   4.8210   46.776   8.7054   52.474   15.279   44.038   10.593   47.771   7.7549   44.825   5.7296 2.945530 9.641979 
1 1 1    8   38    7 o   26.517   6.3035   16.663   7.9194   14.478   14.248   17.639   9.5265   25.821   9.7649   27.213   7.9739 -1.391685 12.60701 
1 1 1    8   38    8 o   53.595   9.6198   70.993   20.483   0.0000   0.0000   70.993   20.483  ?   ?    53.595   9.6198      ?      ? 
1 1 1    8   38    9 o   48.844   5.7836   60.599   9.9732   45.206   17.687   67.776   12.076   41.877   10.309   55.810   5.2463 -13.93324 11.56729 
1 1 1    8   38   10 o   31.352   6.6277   26.062   9.6045   15.827   16.831   31.004   11.696   26.849   10.493   35.854   8.0999 -9.005711 13.25530 
1 1 1    8   38   11 o   33.620   6.2128   31.310   9.3424   13.879   17.803   37.935   10.975   26.169   10.603   41.071   6.4789 -14.90194 12.42562 
1 1 1    8   38   12 o   30.678   6.7282   25.221   9.2902   16.826   18.883   27.902   10.671   27.371   10.979   33.986   7.7805 -6.615814 13.45650 
1 1 1    8   38   13 o   20.475   6.2470   4.3767   8.8641  -2.5635   18.327   6.4960   10.127   21.009   9.5756   19.940   8.0256 1.069090 12.49409 
1 1 1    8   38   14 o   64.247   5.3378   98.768   12.372   90.721   23.202  101.965   14.625   60.350   9.3215   68.144   5.2037 -7.793896 10.67562 
1 1 1    8   38   15 o   26.937   7.8525   4.1194   15.740 -19.9971   20.573   38.162   24.443   18.592   8.9670   35.282   12.893 -16.68981 15.70494 
1 1 1    8   38   16 o   23.802   6.8577   11.482   9.9446   1.1191   22.245   14.070   11.117   23.270   10.584   24.333   8.7227 -1.063526 13.71531 
1 1 1    8   38   17 o   25.775   7.3812   14.215   10.837   18.984   22.386   12.755   12.385   27.864   11.648   23.687   9.0689 4.177870 14.76237 
1 1 1    8   38   18 o   40.467   7.2084   49.783   11.784   34.341   24.856   54.260   13.383   32.658   12.754   48.276   6.7214 -15.61866 14.41674 
1 1 1    8   38   19 o   23.781   7.2497   2.7134   10.464   30.451   23.819  -3.9194   11.648   31.146   12.385   16.417   7.5390 14.72938 14.49931 
1 1 1    8   38   20 o   41.877   7.3304   57.029   13.261   31.963   26.539   65.368   15.308   31.280   12.842   52.473   7.0734 -21.19308 14.66090 
1 1 1    8   39    9 o   35.061   8.3004   38.400   15.499   45.647   17.539   12.561   33.118   41.385   10.312   28.738   13.009 12.64743 16.60075 
1 1 1    8   39   10 o   50.760   8.1700   90.040   18.491  109.220   21.413   33.798   36.668   68.140   7.6192   33.379   14.455 34.76099 16.34010 
1 1 1    8   39   11 o   26.653   8.1175   13.441   16.015   19.938   17.941 -12.0291   35.521   28.115   10.876   25.191   12.054 2.924095 16.23498 
1 1 1    8   39   12 o   46.387   10.841   59.140   20.368   59.140   20.368   0.0000   0.0000   46.387   10.841  ?   ?       ?      ? 
1 1 1    8   39   13 o   31.361   9.3848   17.783   16.985   6.6363   18.916   64.161   38.585   23.334   10.238   39.388   15.731 -16.05422 18.76969 
1 1 1    8   39   14 o   35.571   9.6723   43.044   19.044   41.756   21.859   47.100   38.790   36.437   12.279   34.704   14.948 1.732613 19.34466 
1 1 1    8   39   15 o   39.848   9.0624   51.344   16.936   43.268   22.741   61.402   25.379   36.505   12.523   43.191   13.103 -6.686352 18.12472 
1 1 1    8   39   16 o   32.911   8.9696   35.742   17.172   34.151   23.377   37.607   25.308   32.455   12.452   33.366   12.914 -0.9115639 17.93918 
1 1 1    8   39   17 o   22.550   7.5099  -9.3716   19.531   10.242   22.587 -67.4938   38.882   24.871   11.038   20.229   10.186 4.641956 15.01987 
1 1 1    9    0    1 o  553.064   5.6039  6323.15  180.695  6323.15  180.695  6323.15  180.695  553.064   7.9251  553.064   7.9251 0.000000 0.000000 
1 1 1    9    0    2 o  261.895   2.3381  1415.57   35.704  1415.57   35.704  1415.57   35.704  261.895   3.3066  261.895   3.3066 0.000000 0.000000 
1 1 1    9    0    3 f  283.659   2.4430  1660.60   40.407  1660.60   40.407  1660.60   40.407  283.659   3.4550  283.659   3.4550 0.000000 0.000000 
1 1 1    9    0    4 o   36.960   2.8426   29.168   5.9442   29.168   5.9442   29.168   5.9442   36.960   4.0200   36.960   4.0200 0.000000 0.000000 
1 1 1    9    0    5 o   50.271   2.7923   53.096   8.0715   53.096   8.0715   53.096   8.0715   50.271   3.9489   50.271   3.9489 0.000000 0.000000 
1 1 1    9    0    6 o  204.133   2.1089  860.073   25.098  860.073   25.098  860.073   25.098  204.133   2.9824  204.133   2.9824 0.000000 0.000000 
1 1 1    9    0    7 o  512.604   3.7288  5423.78  111.462  5423.78  111.462  5423.78  111.462  512.604   5.2733  512.604   5.2733 0.000000 0.000000 
1 1 1    9    0    8 o  102.296   2.0173  216.337   12.015  216.337   12.015  216.337   12.015  102.296   2.8529  102.296   2.8529 0.000000 0.000000 
1 1 1    9    0    9 o  160.449   2.8031  531.989   26.198  531.989   26.198  531.989   26.198  160.449   3.9642  160.449   3.9642 0.000000 0.000000 
1 1 1    9    0   10 o  244.871   3.3584  1238.29   47.927  1238.29   47.927  1238.29   47.927  244.871   4.7494  244.871   4.7494 0.000000 0.000000 
1 1 1    9    0   11 o  427.345   3.2700  3768.51   81.488  3768.51   81.488  3768.51   81.488  427.345   4.6245  427.345   4.6245 0.000000 0.000000 
1 1 1    9    0   12 o  765.624   5.3027 12101.64  236.757 12101.64  236.757 12101.64  236.757  765.624   7.4992  765.624   7.4992 0.000000 0.000000 
1 1 1    9    0   13 o  973.706   9.3850 19609.03  532.795 19609.03  532.795 19609.03  532.795  973.706   13.272  973.706   13.272 0.000000 0.000000 
1 1 1    9    0   14 o  121.999   2.9178  308.067   20.709  308.067   20.709  308.067   20.709  121.999   4.1264  121.999   4.1264 0.000000 0.000000 
1 1 1    9    0   15 o  123.650   2.8518  316.388   20.519  316.388   20.519  316.388   20.519  123.650   4.0331  123.650   4.0331 0.000000 0.000000 
1 1 1    9    0   16 o  121.537   2.6237  305.535   18.561  305.535   18.561  305.535   18.561  121.537   3.7105  121.537   3.7105 0.000000 0.000000 
1 1 1    9    0   17 o  107.175   2.8611  237.962   17.828  237.962   17.828  237.962   17.828  107.175   4.0463  107.175   4.0463 0.000000 0.000000 
1 1 1    9    0   18 o  102.876   4.4347  220.876   26.384  220.876   26.384  220.876   26.384  102.876   6.2716  102.876   6.2716 0.000000 0.000000 
1 1 1    9    0   19 o  160.444   2.6315  531.909   24.597  531.909   24.597  531.909   24.597  160.444   3.7216  160.444   3.7216 0.000000 0.000000 
1 1 1    9    0   20 o  174.420   2.6265  628.488   26.694  628.488   26.694  628.488   26.694  174.420   3.7144  174.420   3.7144 0.000000 0.000000 
1 1 1    9    0   21 o  500.165   3.7769  5165.54  110.159  5165.54  110.159  5165.54  110.159  500.165   5.3414  500.165   5.3414 0.000000 0.000000 
1 1 1    9    0   22 o   44.628   8.1087   48.534   18.245   48.534   18.245   48.534   18.245   44.628   11.467   44.628   11.467 0.000000 0.000000 
1 1 1    9    0   23 o  212.154   2.7020  929.703   33.412  929.703   33.412  929.703   33.412  212.154   3.8212  212.154   3.8212 0.000000 0.000000 
1 1 1    9    0   24 o  243.235   3.0997  1222.55   43.945  1222.55   43.945  1222.55   43.945  243.235   4.3837  243.235   4.3837 0.000000 0.000000 
1 1 1    9    0   25 o  189.638   3.2286  743.759   35.666  743.759   35.666  743.759   35.666  189.638   4.5660  189.638   4.5660 0.000000 0.000000 
1 1 1    9    0   26 o  126.446   3.2094  331.406   23.601  331.406   23.601  331.406   23.601  126.446   4.5387  126.446   4.5387 0.000000 0.000000 
1 1 1    9    0   27 o   25.215   9.4353   19.148   18.600   19.148   18.600   19.148   18.600   25.215   13.344   25.215   13.344 0.000000 0.000000 
1 1 1    9    0   28 f  215.355   4.1893  961.034   52.534  961.034   52.534  961.034   52.534  215.355   5.9246  215.355   5.9246 0.000000 0.000000 
1 1 1    9    0   29 o  121.585   3.5501  307.000   25.080  307.000   25.080  307.000   25.080  121.585   5.0207  121.585   5.0207 0.000000 0.000000 
1 1 1    9    0   30 o   46.673   8.4323   53.219   19.845   53.219   19.845   53.219   19.845   46.673   11.925   46.673   11.925 0.000000 0.000000 
1 1 1    9    0   31 o   79.216   5.2349  133.365   23.703  133.365   23.703  133.365   23.703   79.216   7.4033   79.216   7.4033 0.000000 0.000000 
1 1 1    9    0   32 o  109.904   3.9998  251.808   25.486  251.808   25.486  251.808   25.486  109.904   5.6565  109.904   5.6565 0.000000 0.000000 
1 1 1    9    0   33 o   78.066   5.3997  130.038   24.047  130.038   24.047  130.038   24.047   78.066   7.6364   78.066   7.6364 0.000000 0.000000 
1 1 1    9    0   34 o  139.512   4.2943  405.634   34.794  405.634   34.794  405.634   34.794  139.512   6.0730  139.512   6.0730 0.000000 0.000000 
1 1 1    9    0   35 o   14.597   7.2595 -26.2444   24.037 -26.2444   24.037 -26.2444   24.037   14.597   10.266   14.597   10.266 0.000000 0.000000 
1 1 1    9    0   36 o  105.832   6.3184  239.563   38.364  239.563   38.364  239.563   38.364  105.832   8.9356  105.832   8.9356 0.000000 0.000000 
1 1 1    9    0   37 o   22.098   10.670 -21.4176   42.963 -21.4176   42.963 -21.4176   42.963   22.098   15.090   22.098   15.090 0.000000 0.000000 
1 1 1    9    0   38 o   95.069   4.9254  191.993   26.976  191.993   26.976  191.993   26.976   95.069   6.9656   95.069   6.9656 0.000000 0.000000 
1 1 1    9    0   39 o   18.161   8.5681  -5.9300   24.757  -5.9300   24.757  -5.9300   24.757   18.161   12.117   18.161   12.117 0.000000 0.000000 
1 1 1    9    0   40 o   67.931   7.0402  104.503   26.141  104.503   26.141  104.503   26.141   67.931   9.9563   67.931   9.9563 0.000000 0.000000 
1 1 1    9    0   41 o   26.727   10.556   22.957   24.579   22.957   24.579   22.957   24.579   26.727   14.929   26.727   14.929 0.000000 0.000000 
1 1 1    9    0   42 o   43.552   10.672   54.665   24.456   54.665   24.456   54.665   24.456   43.552   15.092   43.552   15.092 0.000000 0.000000 
1 1 1    9    0   43 o   17.319   8.2197  -5.9158   23.392  -5.9158   23.392  -5.9158   23.392   17.319   11.624   17.319   11.624 0.000000 0.000000 
1 1 1    9    0   44 o   35.785   12.819   46.983   33.341   46.983   33.341   46.983   33.341   35.785   18.129   35.785   18.129 0.000000 0.000000 
1 1 1    9    0   45 o   71.043   6.3266  114.580   25.087  114.580   25.087  114.580   25.087   71.043   8.9471   71.043   8.9471 0.000000 0.000000 
1 1 1    9    0   46 o   16.179   7.7735  -7.4591   22.205  -7.4591   22.205  -7.4591   22.205   16.179   10.993   16.179   10.993 0.000000 0.000000 
1 1 1    9    0   47 o   21.118   9.1310   12.916   21.416   12.916   21.416   12.916   21.416   21.118   12.913   21.118   12.913 0.000000 0.000000 
1 1 1    9    0   48 o   43.648   12.377   66.538   30.617   66.538   30.617   66.538   30.617   43.648   17.504   43.648   17.504 0.000000 0.000000 
1 1 1    9    0   49 o   23.246   10.344   17.696   29.499   17.696   29.499   17.696   29.499   23.246   14.628   23.246   14.628 0.000000 0.000000 
1 1 1    9    1    0 o  156.163   2.7305  504.047   24.837  504.047   24.837  504.047   24.837  156.163   3.8615  156.163   3.8615 0.000000 0.000000 
1 1 1    9    1    1 o  207.530   2.4326  888.659   20.819  881.254   29.194  896.321   29.698  206.651   3.4253  208.409   3.4550 -1.757858 4.865142 
1 1 1    9    1    2 o  363.004   3.0819  2720.93   45.689  2724.53   60.542  2716.16   69.634  363.311   4.0403  362.697   4.6549 0.6135254 6.163806 
1 1 1    9    1    3 o  222.363   2.1640  1020.16   19.846  1014.96   27.931  1025.45   28.204  221.792   3.0533  222.935   3.0673 -1.143021 4.327964 
1 1 1    9    1    4 o  218.452   2.1573  984.611   19.437  983.367   27.439  985.863   27.538  218.314   3.0473  218.590   3.0544 -0.2765656 4.314597 
1 1 1    9    1    5 o  320.234   2.6330  2115.22   34.760  2082.76   48.284  2150.14   50.082  317.687   3.6850  322.780   3.7619 -5.093445 5.266058 
1 1 1    9    1    6 o  187.628   2.0510  726.285   15.872  727.214   22.451  725.358   22.441  187.748   2.8993  187.508   2.9017 0.2397766 4.101960 
1 1 1    9    1    7 o  469.378   3.4676  4548.10   67.130  4555.57   95.173  4540.71   94.700  469.761   4.9122  468.996   4.8957 0.7651367 6.935228 
1 1 1    9    1    8 o  336.294   3.9031  2262.45   52.507  2626.99   87.874  2060.03   65.481  356.677   5.9734  315.912   5.0256 40.76474 7.806271 
1 1 1    9    1    9 o  440.378   3.3077  4001.77   60.076  3987.41   84.546  4016.41   85.380  439.582   4.6633  441.175   4.6922 -1.593628 6.615350 
1 1 1    9    1   10 o  499.497   3.6688  5146.85   75.552  5208.31  108.661  5089.33  105.121  502.379   5.2442  496.615   5.1322 5.764221 7.337632 
1 1 1    9    1   11 o  211.872   3.2454  925.541   28.348  902.624   39.379  950.191   40.841  209.152   4.5649  214.591   4.6144 -5.438980 6.490864 
1 1 1    9    1   12 o  481.606   3.5857  4786.55   71.221  4805.67  101.339  4767.88  100.116  482.555   5.0917  480.657   5.0501 1.898071 7.171439 
1 1 1    9    1   13 o  472.558   4.5941  4610.77   87.740  4612.33  113.311  4608.44  138.658  472.711   5.8118  472.405   7.1165 0.3062744 9.188121 
1 1 1    9    1   14 o  255.708   2.6631  1342.78   27.693  1385.30   43.216  1313.16   36.072  259.118   4.0437  252.297   3.4665 6.820572 5.326186 
1 1 1    9    1   15 o  571.903   4.7746  6753.90  112.607  6711.35  157.747  6798.10  160.797  570.072   6.7091  573.734   6.7952 -3.662109 9.549192 
1 1 1    9    1   16 o  445.655   3.6868  4104.12   67.302  4140.43   90.269  4058.67  100.990  447.902   4.8864  443.409   5.5222 4.492737 7.373688 
1 1 1    9    1   17 o  459.766   3.5154  4357.87   66.564  4267.12   91.311  4460.77   97.238  454.674   4.8692  464.858   5.0717 -10.18390 7.030739 
1 1 1    9    1   18 o  178.679   3.6037  658.633   26.545  677.784   38.254  640.847   36.866  181.181   5.1192  176.177   5.0736 5.004211 7.207440 
1 1 1    9    1   19 o   40.017   6.6245   34.285   10.837   43.205   15.742   26.251   14.941   44.911   8.8134   35.124   9.8923 9.786663 13.24893 
1 1 1    9    1   20 f  316.705   2.8524  2070.39   37.257  2058.24   52.426  2082.78   52.958  315.768   4.0254  317.643   4.0423 -1.875549 5.704761 
1 1 1    9    1   21 o  380.287   3.1552  2984.78   49.465  3031.71   71.259  2941.15   68.719  383.165   4.5091  377.409   4.4147 5.755646 6.310383 
1 1 1    9    1   22 o  121.063   3.2029  302.737   15.992  299.653   22.630  305.814   22.602  120.446   4.5553  121.680   4.5037 -1.234039 6.405810 
1 1 1    9    1   23 o  122.547   3.1671  309.728   15.988  288.809   22.153  332.468   23.097  118.232   4.5428  126.861   4.4143 -8.628731 6.334263 
1 1 1    9    1   24 o   27.888   7.7312   5.7396   13.810  -7.4728   19.160   20.028   19.924   22.694   10.113   33.082   11.696 -10.38764 15.46245 
1 1 1    9    1   25 o  257.981   3.5198  1376.21   36.703  1376.21   57.986  1376.20   47.408  257.912   5.4511  258.050   4.4543 -0.1378479 7.039570 
1 1 1    9    1   26 o  137.850   3.0644  392.778   17.423  391.339   24.613  394.223   24.666  137.597   4.3369  138.104   4.3304 -0.5065308 6.128749 
1 1 1    9    1   27 o   37.594   7.8292   30.035   13.056   34.749   18.393   25.248   18.535   40.075   10.858   35.112   11.282 4.963581 15.65831 
1 1 1    9    1   28 o  143.058   4.4010  428.612   25.601  395.749   38.727  454.123   34.121  138.061   6.8011  148.055   5.5876 -9.994781 8.802063 
1 1 1    9    1   29 o   58.836   5.9728   72.006   14.402   61.460   19.851   83.725   20.926   54.265   8.8694   63.406   8.0019 -9.141521 11.94554 
1 1 1    9    1   30 o   31.198   8.1452   15.942   13.940   20.544   20.037   11.624   19.406   33.237   11.732   29.159   11.302 4.078348 16.29036 
1 1 1    9    1   31 o  237.087   3.3197  1163.70   32.461  1161.42   46.059  1165.95   45.756  236.852   4.7149  237.321   4.6746 -0.4689941 6.639452 
1 1 1    9    1   32 o   90.675   5.4712  170.491   19.581  168.130   24.311  174.852   33.039   89.929   6.5544   91.421   8.7621 -1.491486 10.94235 
1 1 1    9    1   33 o  121.865   4.6874  308.488   23.521  323.168   34.505  295.748   32.146  124.550   6.7171  119.180   6.5397 5.369492 9.374816 
1 1 1    9    1   34 o   64.823   7.1579   89.017   19.097   89.617   27.958   88.492   26.148   64.973   10.433   64.673   9.8028 0.3008499 14.31583 
1 1 1    9    1   35 f   39.385   9.2673   32.498   17.674   28.221   26.302   36.019   23.864   37.979   13.437   40.791   12.766 -2.812126 18.53451 
1 1 1    9    1   36 o  118.418   4.5016  292.615   21.931  268.351   29.894  320.896   32.274  113.115   6.4076  123.721   6.3246 -10.60625 9.003280 
1 1 1    9    1   37 o   74.848   8.6880  138.403   22.761  158.054   27.555   96.195   40.384   86.261   7.7449   63.435   15.555 22.82626 17.37606 
1 1 1    9    1   38 o   27.840   7.9713   0.3006   16.156   24.518   22.745 -24.3623   22.953   34.729   12.474   20.950   9.9287 13.77928 15.94268 
1 1 1    9    1   39 o   86.108   6.0422  161.401   20.544  157.161   34.043  163.829   25.765   84.593   9.7573   87.624   7.1292 -3.030807 12.08431 
1 1 1    9    1   40 o   42.989   8.9293   44.587   16.982   49.313   23.121   39.052   25.024   45.408   12.120   40.570   13.117 4.837719 17.85867 
1 1 1    9    1   41 o   26.161   8.1252  -3.8326   17.425   9.6693   24.676 -17.2627   24.610   29.438   12.261   22.885   10.665 6.552996 16.25042 
1 1 1    9    1   42 o   48.154   9.2150   58.055   19.393   75.996   27.538   40.403   27.315   55.786   12.299   40.522   13.726 15.26361 18.43002 
1 1 1    9    1   43 o   58.954   7.9643   82.999   18.621   88.516   27.455   78.299   25.341   60.718   11.381   57.189   11.144 3.529163 15.92865 
1 1 1    9    1   44 o   40.990   10.585   43.870   23.341   47.392   32.850   40.279   33.171   42.188   15.008   39.792   14.932 2.395504 21.17022 
1 1 1    9    1   45 o   32.862   8.4443   21.418   16.771  -1.7840   23.782   44.369   23.653   24.790   11.141   40.934   12.693 -16.14436 16.88861 
1 1 1    9    1   46 o   29.655   8.3216   16.554   15.803   4.3472   22.024   29.507   22.688   25.300   11.076   34.010   12.423 -8.709402 16.64317 
1 1 1    9    1   47 o   26.039   8.0559   6.9144   16.409   5.1019   24.744   8.3373   21.924   26.088   11.567   25.990   11.216 0.9804726E-01 16.11173 
1 1 1    9    1   48 f   55.941   9.0327   92.113   21.770  123.990   30.248   57.859   31.356   69.749   10.515   42.133   14.690 27.61547 18.06537 
1 1 1    9    1   49 o   32.246   9.7029   28.566   23.630   41.029   30.661   10.336   37.083   35.515   14.074   28.978   13.361 6.536348 19.40581 
1 1 1    9    2    0 o  153.880   2.2346  489.069   20.038  489.069   20.038  489.069   20.038  153.880   3.1602  153.880   3.1602 0.000000 0.000000 
1 1 1    9    2    1 o  382.507   3.4221  3020.51   53.975  2991.28   75.352  3051.32   77.350  380.611   4.8001  384.403   4.8787 -3.792816 6.844196 
1 1 1    9    2    2 f  152.346   2.0779  478.647   12.909  477.469   17.014  480.245   19.816  152.131   2.7117  152.561   3.1493 -0.4307709 4.155879 
1 1 1    9    2    3 o  273.496   2.5883  1543.12   28.881  1539.96   38.125  1547.37   44.243  273.182   3.3837  273.809   3.9177 -0.6271362 5.176692 
1 1 1    9    2    4 o  135.126   1.9041  376.686   10.612  376.330   14.955  377.048   15.060  135.062   2.6847  135.191   2.7009 -0.1284485 3.808225 
1 1 1    9    2    5 f  472.070   3.4806  4600.59   67.756  4565.62   94.813  4637.09   96.863  470.241   4.8885  473.899   4.9557 -3.658386 6.961123 
1 1 1    9    2    6 o  342.375   2.7531  2418.89   38.874  2405.02   54.590  2433.15   55.370  341.381   3.8771  343.370   3.9098 -1.988556 5.506188 
1 1 1    9    2    7 f  183.630   2.6920  669.328   19.319  777.617   34.190  618.538   23.415  194.111   4.2705  173.149   3.2788 20.96295 5.383994 
1 1 1    9    2    8 o  165.301   2.5621  567.880   17.236  535.938   26.194  592.271   22.890  161.165   3.9406  169.438   3.2754 -8.272781 5.124150 
1 1 1    9    2    9 o  444.769   3.6151  4071.74   65.289  4142.75  102.093  4022.61   84.924  448.014   5.5251  441.524   4.6635 6.489624 7.230112 
1 1 1    9    2   10 o  403.810   4.4244  3364.64   73.658  3411.18  105.952  3321.11  102.471  406.508   6.3194  401.113   6.1940 5.394775 8.848726 
1 1 1    9    2   11 o  339.874   3.0105  2386.50   41.930  2411.80   56.355  2355.14   62.754  341.905   3.9964  337.844   4.5036 4.060486 6.021083 
1 1 1    9    2   12 f  577.235   4.5038  6863.96  105.498  6795.26  137.091  6963.73  165.203  573.758   5.7932  580.712   6.8975 -6.953857 9.007564 
1 1 1    9    2   13 o  151.404   3.0570  474.507   18.774  481.735   24.528  464.280   29.173  152.809   3.8917  150.000   4.7155 2.808258 6.114007 
1 1 1    9    2   14 o  422.953   4.0150  3688.88   65.742  3703.81  114.971  3681.63   80.136  423.516   6.5819  422.389   4.5999 1.127197 8.029970 
1 1 1    9    2   15 o  288.261   2.8535  1708.63   33.460  1680.16   43.665  1749.13   52.078  285.374   3.7098  291.149   4.3368 -5.775330 5.707065 
1 1 1    9    2   16 f  175.813   2.4390  637.259   17.055  636.050   21.437  639.343   28.150  175.596   2.9600  176.031   3.8772 -0.4353180 4.877934 
1 1 1    9    2   17 o  449.321   3.9879  4167.50   73.874  4208.14  106.215  4129.42  102.816  451.435   5.7046  447.206   5.5742 4.229401 7.975873 
1 1 1    9    2   18 o  292.817   2.9261  1772.77   35.132  1739.12   52.330  1800.37   47.403  290.269   4.3710  295.364   3.8912 -5.094696 5.852108 
1 1 1    9    2   19 o  255.556   2.8499  1347.60   29.664  1345.62   38.980  1350.31   45.724  255.350   3.7011  255.761   4.3346 -0.4106293 5.699736 
1 1 1    9    2   20 o  149.024   2.7087  457.871   16.639  477.891   23.988  439.304   23.101  152.161   3.8223  145.888   3.8392 6.272903 5.417486 
1 1 1    9    2   21 o  130.739   2.9713  353.040   16.016  361.199   22.535  344.713   22.767  132.269   4.1308  129.210   4.2721 3.058945 5.942633 
1 1 1    9    2   22 o   62.496   5.1103   81.550   13.056   91.508   18.159   70.894   18.785   66.499   6.6208   58.493   7.7863 8.006031 10.22065 
1 1 1    9    2   23 o   97.021   3.6779  194.718   14.703  204.810   20.806  184.651   20.780   99.539   5.0679   94.502   5.3313 5.037582 7.355733 
1 1 1    9    2   24 o   94.990   4.2243  187.452   16.488  202.896   23.089  171.379   23.554   99.016   5.6537   90.964   6.2782 8.051918 8.448621 
1 1 1    9    2   25 o  136.925   3.5392  387.164   19.955  396.557   29.198  378.931   27.335  138.473   5.1124  135.377   4.8956 3.096344 7.078424 
1 1 1    9    2   26 o  281.711   3.3144  1638.18   38.473  1549.00   53.219  1735.82   55.683  273.689   4.7145  289.734   4.6597 -16.04443 6.628712 
1 1 1    9    2   27 o  130.279   3.4755  349.689   18.547  339.422   24.665  363.048   28.134  128.108   4.6681  132.450   5.1501 -4.342255 6.950905 
1 1 1    9    2   28 o  124.261   3.9195  325.884   19.478  348.250   25.197  292.675   30.704  129.737   4.7089  118.786   6.2671 10.95161 7.839045 
1 1 1    9    2   29 o   23.203   7.4541 -12.3512   14.724 -14.6444   18.199  -8.0054   25.053   20.160   9.3175   26.247   11.638 -6.087233 14.90813 
1 1 1    9    2   30 o  149.536   4.5617  484.695   25.960  407.716   44.533  524.321   31.951  139.928   7.7163  159.144   4.8677 -19.21587 9.123375 
1 1 1    9    2   31 f   30.571   7.6962   4.5891   15.451 -28.1433   22.046   36.191   21.662   20.158   9.6041   40.983   12.029 -20.82433 15.39233 
1 1 1    9    2   32 o  128.833   3.8930  343.294   20.587  353.797   30.848  334.858   27.644  130.575   5.7279  127.092   5.2737 3.482933 7.785917 
1 1 1    9    2   33 o   89.335   5.5724  167.975   20.248  173.994   26.805  159.978   30.898   91.326   7.1164   87.345   8.5769 3.981743 11.14480 
1 1 1    9    2   34 o   67.493   7.3884  101.931   19.150   70.527   27.882  129.973   26.347   56.304   12.347   78.682   8.1188 -22.37804 14.77682 
1 1 1    9    2   35 o   52.237   7.7909   60.827   16.952   92.068   24.229   30.870   23.726   66.014   8.8988   38.460   12.791 27.55352 15.58181 
1 1 1    9    2   36 o   28.811   8.9974  -4.5409   20.568  -8.7482   33.157  -1.9091   26.223   29.739   13.275   27.883   12.149 1.856766 17.99475 
1 1 1    9    2   37 o   45.413   9.9853   44.626   20.224   35.256   25.379   60.930   33.477   40.006   13.225   50.821   14.964 -10.81438 19.97064 
1 1 1    9    2   38 o   51.483   8.0189   60.685   16.565   57.154   22.996   64.493   23.882   49.862   11.426   53.103   11.254 -3.240768 16.03783 
1 1 1    9    2   39 o   29.190   8.3896   9.9040   16.061   2.5270   22.639   17.380   22.791   26.708   11.460   31.672   12.256 -4.963905 16.77925 
1 1 1    9    2   40 o   63.917   6.7161   92.011   17.082   77.964   24.320  105.687   23.997   58.219   10.515   69.615   8.3578 -11.39616 13.43229 
1 1 1    9    2   41 o   22.061   7.2426 -24.6766   17.011   0.3324   23.347 -52.9769   24.836   26.183   11.434   17.939   8.8926 8.244026 14.48522 
1 1 1    9    2   42 o   79.621   6.2185  142.259   20.193  124.600   29.313  158.210   27.858   74.348   9.5592   84.895   7.9562 -10.54740 12.43701 
1 1 1    9    2   43 o   29.770   9.0989   3.2804   20.554   21.468   31.901  -9.6285   26.875   34.411   14.098   25.128   11.507 9.282320 18.19776 
1 1 1    9    2   44 o   22.334   7.4518 -26.0634   18.776 -51.8999   27.721  -4.1624   25.522   19.238   9.5106   25.431   11.475 -6.193676 14.90369 
1 1 1    9    2   45 o   45.463   8.6923   54.017   17.594   75.277   25.269   34.014   24.512   54.565   11.586   36.361   12.961 18.20375 17.38454 
1 1 1    9    2   46 o   24.513   7.7661 -10.3694   16.567 -29.2969   21.204   19.292   26.544   18.128   8.8271   30.897   12.780 -12.76955 15.53220 
1 1 1    9    2   47 o   47.247   9.0521   62.776   18.380   50.473   25.696   75.666   26.302   41.759   13.270   52.736   12.316 -10.97659 18.10429 
1 1 1    9    2   48 o   36.626   9.9081   41.048   21.286   50.337   29.693   31.228   30.529   39.752   14.255   33.500   13.765 6.251629 19.81626 
1 1 1    9    2   49 o   33.902   10.350   23.255   31.275 -42.4314   47.390   73.939   41.628   25.163   12.439   42.642   16.546 -17.47886 20.70045 
1 1 1    9    3    0 o  105.994   2.1615  232.323   13.338  232.323   13.338  232.323   13.338  105.994   3.0568  105.994   3.0568 0.000000 0.000000 
1 1 1    9    3    1 o  221.993   2.4966  1016.48   22.851  1035.74   32.830  998.375   31.826  224.031   3.5530  219.955   3.5082 4.076660 4.993108 
1 1 1    9    3    2 o  194.628   2.2228  780.781   17.646  776.201   23.256  786.997   27.090  193.964   2.9071  195.293   3.3632 -1.329300 4.445510 
1 1 1    9    3    3 o  205.506   2.2701  872.068   19.054  876.224   25.278  866.599   28.997  206.081   2.9740  204.931   3.4307 1.150818 4.540279 
1 1 1    9    3    4 o   67.641   2.0745   94.486   5.7577  107.237   8.2485   82.369   8.0408   72.097   2.7739   63.184   3.0855 8.913399 4.149065 
1 1 1    9    3    5 o  284.307   2.4590  1667.88   28.834  1667.58   40.793  1668.17   40.763  284.281   3.4791  284.333   3.4759 -0.5111694E-01 4.917982 
1 1 1    9    3    6 o  124.081   1.9250  317.611   9.8515  315.977   13.942  319.241   13.923  123.763   2.7312  124.400   2.7135 -0.6376801 3.850060 
1 1 1    9    3    7 o  229.474   2.2277  1086.29   21.084  1093.61   29.942  1079.10   29.694  230.240   3.1531  228.707   3.1479 1.533066 4.455442 
1 1 1    9    3    8 o  190.611   2.9732  734.945   23.073  841.625   36.364  663.050   29.852  201.958   4.3656  179.264   4.0375 22.69383 5.946402 
1 1 1    9    3    9 o   89.505   2.2918  166.149   8.2246  161.345   13.192  169.203   10.519   88.438   3.6166   90.572   2.8160 -2.133827 4.583611 
1 1 1    9    3   10 o  529.677   4.4437  5740.87   96.037  6125.04  148.925  5467.38  125.655  544.684   6.6291  514.670   5.9195 30.01416 8.887389 
1 1 1    9    3   11 o  266.316   3.5051  1463.56   38.498  1453.92   54.126  1473.42   54.769  265.430   4.9441  267.203   4.9697 -1.773041 7.010132 
1 1 1    9    3   12 o  509.612   7.5082  5363.94  157.813  5363.94  157.813   0.0000   0.0000  509.612   7.5082  ?   ?       ?      ? 
1 1 1    9    3   13 o  341.656   3.3131  2407.99   46.676  2438.60   66.880  2378.93   65.172  343.771   4.7169  339.541   4.6537 4.229401 6.626214 
1 1 1    9    3   14 o  308.505   3.4901  1970.32   43.745  1927.97   67.611  2000.81   57.371  305.624   5.3637  311.387   4.4671 -5.762390 6.980272 
1 1 1    9    3   15 o  348.145   3.1293  2498.86   44.368  2487.17   58.235  2515.02   68.497  347.193   4.0668  349.098   4.7573 -1.904572 6.258600 
1 1 1    9    3   16 o  408.293   3.3171  3447.90   54.401  3473.69   69.588  3407.38   87.240  410.297   4.1122  406.289   5.2061 4.007843 6.634269 
1 1 1    9    3   17 o  368.820   3.9288  2783.85   57.986  2709.13   73.126  2910.41   95.173  362.266   4.8941  375.374   6.1473 -13.10770 7.857575 
1 1 1    9    3   18 f  269.339   2.6603  1496.05   29.541  1462.31   41.084  1532.17   42.506  266.198   3.7420  272.480   3.7823 -6.282043 5.320533 
1 1 1    9    3   19 o  240.628   2.9995  1195.16   29.747  1193.24   41.271  1197.23   42.915  240.432   4.1619  240.825   4.3206 -0.3935699 5.999040 
1 1 1    9    3   20 o  228.809   2.6334  1080.05   24.840  1096.54   35.791  1064.73   34.503  230.491   3.7649  227.127   3.6831 3.363449 5.266848 
1 1 1    9    3   21 o   83.968   3.9278  145.601   13.595  152.993   19.496  138.604   18.967   86.043   5.4935   81.893   5.6153 4.150002 7.855624 
1 1 1    9    3   22 o  293.389   2.8236  1776.84   34.160  1802.72   48.917  1752.21   47.724  295.472   4.0140  291.307   3.9721 4.164917 5.647103 
1 1 1    9    3   23 o  194.710   2.7537  781.851   22.097  812.842   32.020  753.669   30.534  198.387   3.9133  191.033   3.8754 7.354691 5.507453 
1 1 1    9    3   24 o   63.079   7.3482   82.230   16.398   79.817   19.025   89.204   32.341   62.025   7.4367   64.133   12.676 -2.107967 14.69640 
1 1 1    9    3   25 o  192.279   3.4979  764.120   25.881  763.484   31.384  765.472   45.753  192.247   3.9581  192.311   5.7683 -0.6451416E-01 6.995727 
1 1 1    9    3   26 o  239.909   3.0161  1192.43   29.591  1167.75   44.612  1211.81   39.541  237.649   4.5515  242.169   3.9588 -4.519928 6.032245 
1 1 1    9    3   27 f  120.302   4.0862  301.086   20.094  289.163   30.170  310.592   26.939  118.112   6.1932  122.491   5.3322 -4.379036 8.172368 
1 1 1    9    3   28 o  132.437   3.4354  362.994   18.679  362.860   27.778  363.105   25.236  132.392   5.0872  132.482   4.6184 -0.8972168E-01 6.870874 
1 1 1    9    3   29 o   70.230   7.0133  104.572   19.422  108.000   24.391   98.632   32.108   71.989   8.2146   68.470   11.370 3.518982 14.02668 
1 1 1    9    3   30 o  134.004   3.4985  371.205   19.286  363.929   26.235  379.759   28.448  132.593   4.7973  135.414   5.0937 -2.820663 6.997092 
1 1 1    9    3   31 o   72.622   5.2576  109.779   15.706  120.924   22.553   99.283   21.886   76.224   7.1737   69.020   7.6882 7.203522 10.51521 
1 1 1    9    3   32 o  125.778   3.7284  327.999   19.342  328.011   27.316  327.987   27.391  125.782   5.2653  125.775   5.2801 0.6546021E-02 7.456764 
1 1 1    9    3   33 o  113.068   4.3865  265.005   20.317  257.798   27.039  274.352   30.791  111.359   5.8871  114.777   6.5043 -3.418335 8.772904 
1 1 1    9    3   34 o   95.545   4.7927  190.207   18.823  169.493   25.987  213.068   27.301   90.046   6.9974  101.043   6.5510 -10.99757 9.585335 
1 1 1    9    3   35 o   54.525   7.7492   66.173   17.069   90.981   24.270   41.890   24.011   65.589   8.9716   43.461   12.638 22.12791 15.49844 
1 1 1    9    3   36 f   37.271   9.7938   25.845   19.545   24.546   32.859   26.557   24.315   38.114   14.725   36.429   12.917 1.685822 19.58757 
1 1 1    9    3   37 o   24.687   7.7873 -17.9969   17.354   9.6588   25.448 -42.0366   23.726   30.528   12.559   18.845   9.2113 11.68309 15.57467 
1 1 1    9    3   38 o   29.353   8.3399   9.3046   16.077   20.713   22.289  -3.0656   23.210   33.049   12.271   25.657   11.297 7.391600 16.67986 
1 1 1    9    3   39 o   51.274   7.9870   61.348   16.466   69.014   23.133   53.475   23.444   54.911   10.598   47.638   11.952 7.272808 15.97400 
1 1 1    9    3   40 o   25.828   7.9025  -0.9528   15.970   10.721   22.486 -12.8356   22.686   28.934   11.843   22.721   10.466 6.212975 15.80495 
1 1 1    9    3   41 o   28.850   8.3091   9.8532   15.931   0.6124   22.601   18.979   22.460   25.886   11.279   31.814   12.205 -5.927605 16.61830 
1 1 1    9    3   42 o   88.056   5.5467  170.862   20.025  157.455   29.066  182.975   27.628   84.402   8.3496   91.710   7.3040 -7.307251 11.09348 
1 1 1    9    3   43 o   32.930   9.2697   18.078   20.437  -5.8520   31.785   34.942   26.684   27.927   12.683   37.932   13.522 -10.00487 18.53949 
1 1 1    9    3   44 o   25.113   7.8929  -2.3070   16.675 -11.6871   23.753   6.8087   23.415   22.962   10.624   27.264   11.676 -4.302568 15.78571 
1 1 1    9    3   45 o   23.253   7.7279 -20.5082   18.128 -33.8760   22.858   2.1528   29.761   18.566   9.0678   27.940   12.516 -9.373695 15.45589 
1 1 1    9    3   46 o   24.112   7.8396 -11.7154   17.884   10.057   27.819 -27.0494   23.347   28.642   12.495   19.583   9.4711 9.059111 15.67917 
1 1 1    9    3   47 o   26.500   8.2593   5.8464   17.627  -0.4477   24.102   13.084   25.845   24.545   11.106   28.454   12.228 -3.908262 16.51868 
1 1 1    9    3   48 o   24.855   8.0983  -3.1749   18.962 -10.5632   24.929   6.9679   29.208   22.443   10.547   27.267   12.292 -4.824192 16.19667 
1 1 1    9    3   49 o   37.352   10.955   40.939   29.504   94.509   45.682   2.6031   38.645   46.697   17.523   28.006   13.153 18.69065 21.90967 
1 1 1    9    3   50 o   31.793   13.923   33.211   34.829   0.0000   0.0000   33.211   34.829  ?   ?    31.793   13.923      ?      ? 
1 1 1    9    4    0 o  358.899   3.2729  2659.13   68.490  2659.13   68.490  2659.13   68.490  358.899   4.6286  358.899   4.6286 0.000000 0.000000 
1 1 1    9    4    1 o  286.666   2.8414  1695.97   33.593  1685.40   47.180  1706.84   47.842  285.761   4.0031  287.571   4.0337 -1.810272 5.682855 
1 1 1    9    4    2 o   66.265   2.2238   90.743   6.0091   91.577   7.9437   89.626   9.1876   66.624   2.8908   65.906   3.3800 0.7187119 4.447617 
1 1 1    9    4    3 o  271.926   2.5821  1526.47   28.680  1530.05   38.034  1521.75   43.667  272.309   3.3864  271.544   3.8990 0.7646790 5.164299 
1 1 1    9    4    4 o  171.248   2.1623  604.221   15.093  599.814   19.845  610.268   23.245  170.514   2.8218  171.982   3.2771 -1.468124 4.324579 
1 1 1    9    4    5 o  367.147   2.8887  2781.72   43.741  2769.51   61.513  2794.21   62.212  366.333   4.0712  367.961   4.0993 -1.627899 5.777439 
1 1 1    9    4    6 o   84.046   2.0251  145.705   7.0195  147.044   9.9792  144.394   9.8758   84.428   2.8658   83.664   2.8620 0.7642746 4.050159 
1 1 1    9    4    7 o   97.789   2.0103  197.213   8.1064  192.045   11.379  202.538   11.551   96.488   2.8593   99.089   2.8264 -2.601196 4.020500 
1 1 1    9    4    8 o  216.000   2.5500  959.005   22.673  906.648   30.908  1020.00   33.361  209.641   3.5747  222.359   3.6377 -12.71790 5.100078 
1 1 1    9    4    9 o  481.570   4.1063  4760.88   81.042  5004.47  122.887  4573.40  107.810  492.395   6.0510  470.745   5.5527 21.65012 8.212647 
1 1 1    9    4   10 o  333.595   2.8416  2297.07   37.913  2291.53   61.640  2300.45   48.083  333.253   4.4846  333.937   3.4911 -0.6847839 5.683275 
1 1 1    9    4   11 o  339.435   3.2741  2376.74   45.826  2408.80   65.700  2346.37   63.951  341.662   4.6623  337.209   4.5981 4.453186 6.548279 
1 1 1    9    4   12 o  455.457   4.2643  4247.28   74.136  4191.48   89.009  4373.67  133.961  450.695   4.7883  460.220   7.0575 -9.524963 8.528546 
1 1 1    9    4   13 o  105.978   2.3535  231.642   10.281  233.058   14.811  230.325   14.284  106.290   3.3785  105.666   3.2775 0.6240616 4.707055 
1 1 1    9    4   14 o  407.443   3.4548  3427.81   57.556  3439.50   76.605  3412.66   87.216  408.262   4.5494  406.624   5.2004 1.637207 6.909524 
1 1 1    9    4   15 o  356.969   3.1761  2631.62   46.334  2645.16   61.594  2613.97   70.324  358.043   4.1710  355.894   4.7909 2.149567 6.352137 
1 1 1    9    4   16 o  404.448   3.2905  3388.74   53.574  3435.83   68.910  3316.77   85.180  408.050   4.0945  400.845   5.1522 7.204926 6.581077 
1 1 1    9    4   17 o  212.766   3.1703  920.958   27.302  869.108   34.957  1002.05   43.717  205.213   4.1302  220.320   4.8109 -15.10681 6.340614 
1 1 1    9    4   18 o  389.431   3.3911  3133.20   54.047  3148.60   72.186  3113.55   81.533  390.548   4.4814  388.313   5.0908 2.235474 6.782248 
1 1 1    9    4   19 o  164.166   3.0062  552.756   20.255  522.296   27.073  591.485   30.527  159.066   4.1265  169.265   4.3727 -10.19814 6.012391 
1 1 1    9    4   20 o  134.768   3.2005  373.639   17.421  368.301   22.389  381.830   27.733  133.570   4.0640  135.967   4.9454 -2.397141 6.401082 
1 1 1    9    4   21 o  190.196   2.9509  748.073   22.855  754.214   30.088  739.697   35.138  191.140   3.8166  189.253   4.5017 1.887299 5.901848 
1 1 1    9    4   22 o   81.044   4.4230  136.847   14.457  131.082   22.722  140.768   18.738   79.570   6.9237   82.517   5.5058 -2.946907 8.846000 
1 1 1    9    4   23 o  245.249   3.5299  1247.56   35.128  1220.44   54.512  1266.82   45.937  242.904   5.4412  247.594   4.4984 -4.690094 7.059901 
1 1 1    9    4   24 o   89.587   4.1311  166.887   15.094  160.707   22.896  171.637   20.073   88.086   6.3021   91.088   5.3429 -3.001762 8.262184 
1 1 1    9    4   25 o   79.486   4.5173  130.169   14.761  122.239   19.921  139.825   21.982   76.821   6.2874   82.150   6.4878 -5.328796 9.034550 
1 1 1    9    4   26 o  144.371   3.4657  431.292   20.621  428.110   29.693  434.256   28.658  143.847   5.0048  144.895   4.7955 -1.048126 6.931404 
1 1 1    9    4   27 o  228.335   3.5098  1077.95   32.927  1069.58   44.574  1088.00   48.851  227.391   4.7528  229.277   5.1659 -1.886063 7.019653 
1 1 1    9    4   28 o  134.565   3.2010  374.759   17.756  366.689   25.340  382.545   24.889  133.133   4.6148  135.997   4.4372 -2.864410 6.401928 
1 1 1    9    4   29 o   42.660   7.8462   37.571   14.925   61.664   22.145   17.521   20.202   53.341   10.440   31.979   11.716 21.36237 15.69232 
1 1 1    9    4   30 o   66.504   5.6348   92.116   15.425   84.448   21.523  100.213   22.118   63.639   8.1998   69.368   7.7308 -5.728485 11.26951 
1 1 1    9    4   31 o  164.049   3.1786  556.660   21.499  540.201   29.967  574.117   30.862  161.552   4.4974  166.547   4.4929 -4.994888 6.357114 
1 1 1    9    4   32 o   57.244   7.5535   69.535   17.282   51.475   23.261   91.790   25.821   48.360   11.773   66.128   9.4673 -17.76822 15.10705 
1 1 1    9    4   33 o   82.004   5.0725  140.954   17.064  156.546   24.025  125.080   24.241   86.660   6.7216   77.348   7.5988 9.312431 10.14501 
1 1 1    9    4   34 f   25.506   7.8837  -4.4251   15.875 -10.8328   22.334   2.1172   22.568   23.705   10.711   27.306   11.571 -3.601864 15.76735 
1 1 1    9    4   35 o   47.701   9.1724   51.463   19.013   36.461   27.472   65.256   26.341   41.435   13.763   53.967   12.129 -12.53283 18.34485 
1 1 1    9    4   36 o   79.968   5.4545  135.179   17.983  139.755   25.882  130.908   25.004   81.274   7.7210   78.663   7.7067 2.610977 10.90901 
1 1 1    9    4   37 o   53.164   7.7879   63.569   16.827   48.791   23.622   78.794   23.976   45.998   12.237   60.329   9.6358 -14.33084 15.57575 
1 1 1    9    4   38 o   33.892   9.2287   12.705   18.177  -0.9154   22.370   39.177   31.186   25.783   11.228   42.002   14.650 -16.21899 18.45741 
1 1 1    9    4   39 o   76.492   5.6607  127.185   17.594  102.040   24.632  153.377   25.139   68.392   8.7324   84.591   7.2055 -16.19891 11.32141 
1 1 1    9    4   40 o   41.594   9.3836   41.496   18.376   48.508   25.555   33.987   26.444   44.681   13.051   38.508   13.487 6.172974 18.76720 
1 1 1    9    4   41 o   31.102   7.9796   9.5670   16.205 -21.4701   22.977   40.283   22.858   21.178   10.006   41.027   12.433 -19.84867 15.95929 
1 1 1    9    4   42 o   32.235   8.1073   7.8008   16.915 -25.1678   22.674   49.176   25.401   20.176   9.6475   44.294   13.032 -24.11842 16.21468 
1 1 1    9    4   43 o   46.459   9.8960   54.413   19.875   66.216   33.344   47.908   24.754   49.495   15.020   43.423   12.889 6.072006 19.79193 
1 1 1    9    4   44 o   43.070   8.1239   44.373   16.995   78.577   24.673   13.491   23.444   56.915   10.908   29.224   12.042 27.69105 16.24775 
1 1 1    9    4   45 o   22.240   7.4474 -19.4047   18.288  -9.9210   23.407 -34.2631   29.299   22.787   10.544   21.694   10.521 1.092314 14.89485 
1 1 1    9    4   46 o   23.702   7.5906  -2.5653   15.997  -5.8665   22.472   0.8259   22.777   22.862   10.489   24.542   10.975 -1.679180 15.18122 
1 1 1    9    4   47 o   26.256   8.2201   5.6091   17.636   7.7932   24.460   3.2443   25.451   26.647   11.668   25.864   11.581 0.7835808 16.44020 
1 1 1    9    4   48 o   27.167   8.4004   11.003   17.984   5.6851   25.810   16.022   25.073   25.954   11.639   28.379   12.116 -2.424564 16.80073 
1 1 1    9    4   49 o   32.221   10.329   20.396   28.567   58.567   47.345  -1.4563   35.822   37.691   16.374   26.750   12.594 10.94079 20.65706 
1 1 1    9    4   50 o   29.192   9.6468   8.3324   28.098   52.092   44.929 -19.7768   36.009   34.747   15.486   23.637   11.508 11.11042 19.29357 
1 1 1    9    5    0 o  153.962   2.2478  489.576   20.167  489.576   20.167  489.576   20.167  153.962   3.1789  153.962   3.1789 0.000000 0.000000 
1 1 1    9    5    1 o  331.478   3.1060  2267.96   42.463  2260.47   59.815  2275.56   60.292  330.927   4.3824  332.029   4.4027 -1.101440 6.212045 
1 1 1    9    5    2 o  250.048   2.4704  1292.57   25.288  1311.19   33.899  1269.21   37.972  252.091   3.2603  248.005   3.7123 4.086563 4.940717 
1 1 1    9    5    3 o  105.488   2.0600  229.617   8.8603  229.910   11.684  229.220   13.591  105.570   2.6835  105.406   3.1263 0.1646881 4.120050 
1 1 1    9    5    4 o  170.576   2.1674  601.289   15.102  607.872   20.076  592.707   22.921  171.659   2.8357  169.494   3.2788 2.164276 4.334890 
1 1 1    9    5    5 o  386.395   2.9937  3080.50   47.701  3055.77   66.713  3106.36   68.233  384.811   4.2034  387.979   4.2640 -3.168396 5.987488 
1 1 1    9    5    6 o  261.198   2.3820  1407.38   25.660  1399.35   36.050  1415.62   36.532  260.444   3.3560  261.952   3.3813 -1.508759 4.764051 
1 1 1    9    5    7 o  495.935   3.6294  5074.69   74.218  5030.14  103.624  5121.61  106.350  493.704   5.0889  498.166   5.1761 -4.462097 7.258717 
1 1 1    9    5    8 o  164.982   2.1603  561.757   14.329  560.080   22.976  562.824   18.329  164.777   3.3808  165.188   2.6903 -0.4118347 4.320618 
1 1 1    9    5    9 o  190.193   2.4438  742.814   19.108  787.080   28.449  706.430   25.792  195.330   3.5312  185.055   3.3792 10.27530 4.887591 
1 1 1    9    5   10 o  302.486   2.7048  1883.24   32.635  1905.06   53.599  1870.39   41.140  303.858   4.2768  301.112   3.3126 2.745850 5.409621 
1 1 1    9    5   11 o  500.034   3.9763  5165.69   81.353  5201.02  108.617  5120.54  122.782  502.012   5.2459  498.057   5.9771 3.955048 7.952675 
1 1 1    9    5   12 o  297.397   3.2331  1827.27   37.296  1831.73   45.596  1818.25   64.832  297.975   3.7101  296.818   5.2958 1.157440 6.466105 
1 1 1    9    5   13 f  415.640   3.7320  3565.20   63.967  3592.29   91.422  3539.23   89.533  417.184   5.3132  414.096   5.2422 3.087952 7.463958 
1 1 1    9    5   14 o  291.119   2.8657  1747.92   34.057  1743.59   45.029  1753.71   52.059  290.708   3.7555  291.529   4.3296 -0.8211365 5.731408 
1 1 1    9    5   15 o  418.751   3.7838  3611.51   65.183  3728.24   96.284  3512.75   88.564  424.973   5.4932  412.530   5.2052 12.44254 7.567660 
1 1 1    9    5   16 o  456.457   5.4519  4330.32   83.277  4347.20   93.665  4266.63  181.939  458.908   4.9486  454.006   9.7162 4.902557 10.90386 
1 1 1    9    5   17 o  228.168   3.0083  1083.14   25.175  1093.58   29.566  1055.61   48.012  230.228   3.1136  226.107   5.1483 4.120682 6.016640 
1 1 1    9    5   18 o  390.082   3.6638  3139.41   58.903  3070.49   81.450  3214.97   85.284  385.604   5.1213  394.559   5.2407 -8.955566 7.327551 
1 1 1    9    5   19 o  220.294   3.3554  1003.16   29.762  997.393   47.484  1006.89   38.195  219.739   5.2393  220.848   4.1932 -1.109192 6.710708 
1 1 1    9    5   20 o  169.872   3.1344  594.172   21.875  577.977   29.489  613.984   32.618  167.313   4.2734  172.431   4.5864 -5.117523 6.268704 
1 1 1    9    5   21 o  194.010   2.6668  776.856   21.336  759.877   29.919  794.427   30.436  191.853   3.7811  196.167   3.7617 -4.314087 5.333614 
1 1 1    9    5   22 o  114.771   3.3647  269.262   15.801  250.473   20.821  294.782   24.265  110.108   4.5848  119.434   4.9258 -9.325981 6.729336 
1 1 1    9    5   23 o  391.523   3.7347  3169.93   60.301  3218.27   86.156  3123.51   84.427  394.445   5.2958  388.602   5.2676 5.843933 7.469450 
1 1 1    9    5   24 o  126.274   3.1426  329.434   16.361  341.654   23.342  317.630   22.941  128.578   4.4015  123.970   4.4867 4.607994 6.285189 
1 1 1    9    5   25 o  132.818   3.0921  364.343   16.927  345.595   23.629  384.103   24.259  129.307   4.4306  136.329   4.3144 -7.021820 6.184173 
1 1 1    9    5   26 o  163.910   3.3273  555.375   22.477  562.867   32.507  548.510   31.114  164.961   4.7779  162.858   4.6322 2.102722 6.654689 
1 1 1    9    5   27 o  150.835   3.4204  467.797   20.730  458.099   26.355  483.532   33.571  148.850   4.2929  152.819   5.3262 -3.969299 6.840890 
1 1 1    9    5   28 o  167.876   2.9208  582.493   20.219  573.170   28.253  592.280   28.948  166.502   4.1142  169.251   4.1469 -2.749374 5.841527 
1 1 1    9    5   29 o  120.157   3.7526  296.898   18.456  316.158   28.215  282.495   24.399  123.513   5.5386  116.800   5.0648 6.713432 7.505280 
1 1 1    9    5   30 o   97.995   4.8164  202.905   18.503  211.030   23.116  188.419   30.866  100.897   5.5548   95.092   7.8700 5.805275 9.632897 
1 1 1    9    5   31 o  150.391   3.2723  468.010   20.289  486.640   29.038  450.239   28.361  153.318   4.5920  147.464   4.6631 5.854492 6.544562 
1 1 1    9    5   32 o   83.923   5.3548  147.767   18.432  160.046   25.553  134.448   26.613   87.641   7.0691   80.205   8.0451 7.435692 10.70959 
1 1 1    9    5   33 o   44.062   8.5150   42.593   16.014   35.827   22.255   49.856   23.059   40.677   12.255   47.447   11.826 -6.770016 17.02998 
1 1 1    9    5   34 o   98.125   4.5195  200.852   18.286  197.852   25.516  204.021   26.220   97.378   6.3530   98.871   6.4297 -1.492584 9.038916 
1 1 1    9    5   35 o   21.293   7.4274 -60.5945   22.203 -98.1326   40.415 -44.3672   26.573   22.192   11.057   20.395   9.9199 1.797209 14.85489 
1 1 1    9    5   36 o   68.405   6.1197   99.867   17.237   93.840   24.460  105.813   24.293   66.275   8.9483   70.535   8.3506 -4.259384 12.23941 
1 1 1    9    5   37 o   39.819   8.4900   34.760   16.338   53.149   22.868   15.587   23.350   48.087   11.652   31.550   12.351 16.53736 16.97990 
1 1 1    9    5   38 o   36.916   9.2791   25.828   19.967   45.652   25.775  -3.9203   31.574   44.262   13.155   29.569   13.090 14.69323 18.55827 
1 1 1    9    5   39 o   39.079   8.8141   34.771   16.531   47.386   23.770   22.954   23.005   44.503   12.457   33.654   12.473 10.84949 17.62814 
1 1 1    9    5   40 o   76.249   6.2284  128.511   19.252  156.400   27.502  101.717   26.958   84.894   7.8546   67.603   9.6683 17.29125 12.45677 
1 1 1    9    5   41 o   60.647   7.0102   84.348   16.768   66.699   23.894  101.474   23.537   53.215   11.239   68.079   8.3823 -14.86385 14.02045 
1 1 1    9    5   42 o   31.494   8.7174   16.607   17.315   29.642   23.791   1.9273   25.248   35.847   12.770   27.141   11.870 8.705843 17.43487 
1 1 1    9    5   43 o   49.354   8.7062   62.096   17.807   51.834   26.648   70.376   23.935   44.772   13.392   53.935   11.129 -9.162491 17.41237 
1 1 1    9    5   44 o   79.096   5.4012  138.746   17.590  128.463   24.236  150.193   25.571   75.932   7.7388   82.261   7.5368 -6.329147 10.80245 
1 1 1    9    5   45 o   29.916   8.6833  -0.6199   19.459 -32.1438   25.440   43.829   30.209   20.113   9.7650   39.719   14.361 -19.60658 17.36654 
1 1 1    9    5   46 o   40.542   9.0951   46.583   17.999   60.419   24.694   30.901   26.290   46.870   12.532   34.214   13.185 12.65511 18.19014 
1 1 1    9    5   47 o   26.971   8.3565   8.1790   17.807   4.2611   25.031   12.193   25.338   25.922   11.555   28.020   12.075 -2.098156 16.71297 
1 1 1    9    5   48 o   25.931   8.2401   5.4600   18.573   12.018   23.958  -4.4193   29.405   26.915   11.670   24.947   11.637 1.968233 16.48024 
1 1 1    9    5   49 o   30.269   9.8955   14.453   28.172   35.663   45.238   1.0181   36.006   33.496   15.180   27.041   12.698 6.455378 19.79092 
1 1 1    9    5   50 o   31.928   10.175   35.556   28.318   29.291   47.563   38.996   35.247   31.061   14.588   32.795   14.187 -1.734089 20.34927 
1 1 1    9    6    0 o  420.431   3.6733  3648.93   90.051  3648.93   90.051  3648.93   90.051  420.431   5.1949  420.431   5.1949 0.000000 0.000000 
1 1 1    9    6    1 o  102.205   2.2302  215.441   9.3970  224.432   13.407  206.758   13.175  104.301   3.1165  100.109   3.1909 4.191933 4.460316 
1 1 1    9    6    2 o  295.068   2.7096  1795.55   32.601  1790.10   42.955  1802.95   50.067  294.553   3.5358  295.583   4.1068 -1.029663 5.419203 
1 1 1    9    6    3 o  241.362   2.4453  1197.75   23.986  1178.26   31.234  1225.78   37.449  238.985   3.1687  243.739   3.7253 -4.753586 4.890649 
1 1 1    9    6    4 o  368.996   3.1280  2811.48   47.169  2822.36   62.674  2797.26   71.635  369.837   4.1088  368.155   4.7177 1.682465 6.256052 
1 1 1    9    6    5 o  159.350   2.1599  524.596   14.050  529.503   18.629  518.123   21.395  160.219   2.8192  158.481   3.2731 1.737747 4.319825 
1 1 1    9    6    6 o  350.907   2.8062  2540.33   40.614  2548.93   57.645  2531.86   57.230  351.496   3.9763  350.318   3.9609 1.177887 5.612473 
1 1 1    9    6    7 o  596.314   4.5869  7322.41  111.022  7442.79  173.802  7239.43  144.299  600.391   7.0187  592.237   5.9075 8.153076 9.173869 
1 1 1    9    6    8 o  302.322   2.6750  1887.96   32.452  1875.12   52.246  1896.03   41.409  301.471   4.2019  303.173   3.3116 -1.702759 5.349986 
1 1 1    9    6    9 o  121.559   2.2428  305.721   11.085  299.294   17.089  310.390   14.565  120.450   3.4399  122.669   2.8789 -2.218712 4.485603 
1 1 1    9    6   10 o  281.543   2.8789  1629.24   33.313  1705.54   49.641  1566.73   44.933  287.514   4.1862  275.572   3.9534 11.94147 5.757878 
1 1 1    9    6   11 o  338.245   3.4497  2364.36   45.354  2371.28   55.566  2350.54   78.500  339.024   3.9739  337.466   5.6399 1.558472 6.899311 
1 1 1    9    6   12 o  601.599   4.6610  7457.50  113.825  7384.99  148.032  7562.39  178.035  598.096   6.0009  605.102   7.1337 -7.005188 9.322023 
1 1 1    9    6   13 o  177.795   2.4271  655.112   17.614  674.695   23.490  629.959   26.623  180.850   3.1492  174.741   3.6940 6.108673 4.854191 
1 1 1    9    6   14 o  495.180   4.2690  5057.83   87.104  4959.44  120.128  5166.91  126.485  490.116   5.9426  500.244   6.1304 -10.12793 8.537992 
1 1 1    9    6   15 o  379.071   3.5558  2964.94   55.580  2917.58   77.541  3014.98   79.707  375.961   5.0006  382.181   5.0566 -6.220093 7.111667 
1 1 1    9    6   16 o  248.425   4.5107  1285.26   42.516  1248.57   76.532  1301.64   51.131  245.750   7.5506  251.099   4.9372 -5.348785 9.021488 
1 1 1    9    6   17 o  129.221   2.8321  346.192   14.995  360.800   20.344  328.815   22.188  132.226   3.7303  126.216   4.2623 6.010162 5.664136 
1 1 1    9    6   18 o  180.387   2.6905  671.950   19.896  675.044   26.740  668.113   29.779  180.861   3.5848  179.913   4.0131 0.9471283 5.381004 
1 1 1    9    6   19 o  441.128   3.6817  4022.75   66.337  4041.81   88.023  3997.70  100.925  442.391   4.8242  439.866   5.5631 2.525330 7.363461 
1 1 1    9    6   20 o  420.441   3.6283  3657.69   62.409  3698.06   83.389  3606.28   94.099  423.134   4.7782  417.749   5.4614 5.384888 7.256594 
1 1 1    9    6   21 o  278.127   2.7485  1596.69   31.522  1618.92   45.138  1575.53   44.040  280.014   3.9084  276.240   3.8654 3.774231 5.496980 
1 1 1    9    6   22 o  203.892   2.8874  855.536   24.031  837.674   31.636  879.903   36.950  201.406   3.8084  206.378   4.3410 -4.971893 5.774796 
1 1 1    9    6   23 o  162.441   2.9794  544.288   19.848  553.802   29.808  536.709   26.604  163.698   4.4150  161.183   4.0018 2.515320 5.958709 
1 1 1    9    6   24 o  305.155   3.2720  1921.93   41.133  1867.97   56.554  1982.55   59.936  300.624   4.5612  309.686   4.6925 -9.062317 6.543966 
1 1 1    9    6   25 o  164.334   2.8261  557.864   19.152  547.736   26.828  568.391   27.351  162.813   3.9951  165.854   3.9983 -3.041107 5.652174 
1 1 1    9    6   26 f   81.974   5.4255  143.539   17.591   97.513   24.926  189.209   24.830   68.413   8.8339   95.536   6.3014 -27.12321 10.85109 
1 1 1    9    6   27 o  279.811   3.7588  1640.14   42.623  1506.29   65.128  1740.42   56.371  269.585   5.8574  290.037   4.7123 -20.45206 7.517669 
1 1 1    9    6   28 o  113.148   3.5226  265.072   16.435  271.736   23.223  258.387   23.261  114.579   4.9141  111.717   5.0483 2.861115 7.045135 
1 1 1    9    6   29 o  188.091   3.4577  734.982   26.717  666.924   38.079  800.960   37.493  179.446   5.1451  196.735   4.6207 -17.28922 6.915372 
1 1 1    9    6   30 o  256.908   3.2490  1365.32   33.869  1361.81   44.084  1370.38   52.910  256.589   4.1656  257.227   4.9872 -0.6381836 6.498002 
1 1 1    9    6   31 o   26.550   7.8608   2.7593   14.516  -0.7992   20.679   6.2167   20.383   25.495   10.947   27.605   11.284 -2.109667 15.72161 
1 1 1    9    6   32 o  147.931   3.7851  455.099   23.018  468.114   31.580  440.345   33.622  150.236   5.0964  145.627   5.5978 4.609253 7.570277 
1 1 1    9    6   33 f  124.802   3.7593  323.521   19.349  317.897   27.221  329.264   27.509  123.702   5.3354  125.901   5.2976 -2.198792 7.518682 
1 1 1    9    6   34 o   61.997   6.5251   81.270   16.684   80.590   23.663   81.942   23.526   61.728   9.2945   62.266   9.1606 -0.5377502 13.05010 
1 1 1    9    6   35 o   81.409   6.9818  144.990   22.871  117.328   33.767  168.438   31.088   73.676   11.112   89.142   8.4557 -15.46644 13.96359 
1 1 1    9    6   36 o   52.575   7.8969   62.481   16.617   53.715   23.425   71.360   23.575   48.554   11.811   56.595   10.486 -8.040154 15.79371 
1 1 1    9    6   37 o   38.886   8.5790   32.157   16.503   13.483   23.181   51.349   23.500   30.690   12.214   47.083   12.051 -16.39365 17.15804 
1 1 1    9    6   38 o   32.444   8.8420   15.585   17.209   29.335   25.485   4.0602   23.331   37.235   13.222   27.654   11.744 9.580887 17.68404 
1 1 1    9    6   39 o   38.252   8.9121   33.515   16.673   42.667   23.399   24.076   23.764   42.268   12.528   34.235   12.679 8.033279 17.82417 
1 1 1    9    6   40 o   31.062   8.4165   14.875   15.986   30.128   22.927   0.4424   22.302   36.442   12.569   25.682   11.196 10.76009 16.83309 
1 1 1    9    6   41 o   40.512   8.6821   39.035   16.591   23.547   23.639   54.070   23.292   33.697   12.613   47.328   11.934 -13.63181 17.36410 
1 1 1    9    6   42 o   41.635   9.6490   43.885   20.395   23.535   31.787   58.124   26.589   35.198   14.200   48.072   13.068 -12.87417 19.29798 
1 1 1    9    6   43 o   52.256   8.7938   68.765   18.675   66.877   27.010   70.495   25.848   51.259   12.811   53.254   12.050 -1.994587 17.58769 
1 1 1    9    6   44 o   49.931   8.3241   63.202   16.950   72.875   24.193   53.876   23.756   54.256   11.183   45.606   12.333 8.649616 16.64815 
1 1 1    9    6   45 o   29.499   8.0562   0.8718   16.968   44.898   25.854 -32.4408   22.489   40.498   13.347   18.500   9.0263 21.99824 16.11233 
1 1 1    9    6   46 o   20.669   6.9847 -24.9151   17.292  -5.6634   23.931 -45.9485   25.014   23.386   10.764   17.953   8.9036 5.433525 13.96941 
1 1 1    9    6   47 o   23.596   7.5933 -11.1744   17.432   14.882   24.738 -36.8718   24.567   28.528   12.102   18.664   9.1740 9.863569 15.18660 
1 1 1    9    6   48 o   34.200   9.3844   28.403   22.471 -11.1261   32.628   64.066   30.992   24.772   11.768   43.628   14.621 -18.85560 18.76877 
1 1 1    9    6   49 o   28.298   9.3439   7.6081   27.283 -10.4625   44.932   18.162   34.338   27.145   13.131   29.450   13.297 -2.305298 18.68777 
1 1 1    9    6   50 o   32.434   10.304   31.085   28.503   73.323   45.445   3.6955   36.595   38.369   16.344   26.499   12.552 11.87035 20.60815 
1 1 1    9    7    0 o  114.286   2.2357  270.014   14.878  270.014   14.878  270.014   14.878  114.286   3.1618  114.286   3.1618 0.000000 0.000000 
1 1 1    9    7    1 o  273.478   2.7805  1542.93   31.360  1555.75   44.725  1530.52   43.984  274.596   3.9490  272.360   3.9155 2.235229 5.561085 
1 1 1    9    7    2 o  243.557   2.4543  1224.08   24.405  1226.00   32.309  1221.54   37.241  243.786   3.2133  243.329   3.7107 0.4562531 4.908628 
1 1 1    9    7    3 o  396.540   3.2967  3241.69   53.254  3225.34   69.948  3264.24   82.138  395.371   4.2895  397.710   5.0074 -2.338959 6.593422 
1 1 1    9    7    4 o  356.631   3.0635  2624.44   44.592  2626.11   58.974  2622.20   68.141  356.777   4.0077  356.486   4.6344 0.2911072 6.126999 
1 1 1    9    7    5 o  236.947   2.4397  1156.26   23.544  1146.34   30.879  1170.03   36.387  235.741   3.1758  238.153   3.7044 -2.412094 4.879432 
1 1 1    9    7    6 o   79.007   2.1784  128.777   7.0962  129.527   9.9225  127.992   10.152   79.243   3.0360   78.772   3.1249 0.4713593 4.356834 
1 1 1    9    7    7 f   72.798   2.4298  110.354   7.1295  104.204   11.182  114.567   9.2548   71.070   3.8146   74.526   3.0109 -3.455948 4.859681 
1 1 1    9    7    8 o  334.120   3.1638  2303.51   43.599  2298.69   61.552  2308.37   61.766  333.769   4.4713  334.471   4.4774 -0.7019348 6.327627 
1 1 1    9    7    9 o  562.746   4.3641  6537.36  100.240  6538.94  153.203  6536.18  132.551  562.763   6.6005  562.729   5.7111 0.3417969E-01 8.728265 
1 1 1    9    7   10 f  374.138   3.6261  2886.76   52.736  2894.60   91.461  2882.85   64.545  374.474   5.9217  373.801   4.1866 0.6724548 7.252207 
1 1 1    9    7   11 o  352.821   3.7090  2578.87   53.111  2625.63   69.537  2513.40   82.282  356.701   4.7266  348.940   5.7172 7.760590 7.418046 
1 1 1    9    7   12 o  171.358   2.9016  603.773   20.215  618.043   31.519  593.803   26.347  173.064   4.4157  169.651   3.7654 3.413589 5.803205 
1 1 1    9    7   13 o  481.103   3.7011  4789.15   71.494  4829.48   91.415  4725.63  114.724  483.767   4.5816  478.440   5.8138 5.327484 7.402136 
1 1 1    9    7   14 o  144.930   2.4467  433.639   14.114  434.462   17.777  432.234   23.215  145.124   2.9700  144.736   3.8889 0.3887787 4.893321 
1 1 1    9    7   15 o  440.165   3.9201  3996.11   71.075  4083.14  103.627  3918.81   97.668  444.674   5.6502  435.656   5.4355 9.018494 7.840252 
1 1 1    9    7   16 o  238.117   4.1837  1170.25   41.088  1170.25   41.088   0.0000   0.0000  238.117   4.1837  ?   ?       ?      ? 
1 1 1    9    7   17 o  337.270   2.9725  2344.95   39.853  2336.68   50.040  2359.29   65.903  336.500   3.6055  338.041   4.7268 -1.541931 5.944960 
1 1 1    9    7   18 o  150.439   2.5797  459.207   15.262  441.999   18.761  492.884   26.246  146.358   3.1079  154.520   4.1182 -8.161453 5.159325 
1 1 1    9    7   19 o  206.396   2.6049  880.631   21.428  884.631   27.058  873.902   35.093  207.049   3.1685  205.743   4.1355 1.306122 5.209770 
1 1 1    9    7   20 o  140.112   3.4492  387.095   17.146  370.630   19.544  442.098   35.722  133.999   3.5364  146.225   5.9231 -12.22693 6.898467 
1 1 1    9    7   21 o  155.061   3.1128  501.843   19.472  524.094   25.369  469.940   30.377  159.318   3.8608  150.805   4.8839 8.512268 6.225591 
1 1 1    9    7   22 o   97.510   3.9432  196.405   15.819  192.465   21.532  201.025   23.317   96.458   5.4123   98.562   5.7359 -2.103088 7.886323 
1 1 1    9    7   23 o  108.551   3.4007  243.699   15.218  252.664   21.517  234.728   21.525  110.554   4.7189  106.548   4.8981 4.006195 6.801425 
1 1 1    9    7   24 o  113.850   3.3016  268.005   15.499  275.437   21.920  260.577   21.916  115.433   4.6042  112.268   4.7331 3.164558 6.603132 
1 1 1    9    7   25 o  121.590   3.1994  305.696   16.029  324.025   22.838  287.900   22.503  125.190   4.4230  117.991   4.6240 7.198677 6.398793 
1 1 1    9    7   26 o   30.667   8.0507   11.956   15.056  -8.9417   23.116   27.351   19.841   24.876   11.095   36.459   11.668 -11.58326 16.10147 
1 1 1    9    7   27 o  173.784   3.0929  625.132   21.960  620.660   33.362  628.552   29.171  173.200   4.6702  174.368   4.0562 -1.167786 6.185765 
1 1 1    9    7   28 o  249.478   3.1876  1287.60   32.799  1284.66   46.261  1290.57   46.509  249.192   4.5010  249.763   4.5148 -0.5707855 6.375176 
1 1 1    9    7   29 o  189.781   3.1060  743.398   24.153  730.666   32.239  759.688   36.466  187.964   4.1586  191.598   4.6146 -3.633850 6.211947 
1 1 1    9    7   30 o  131.879   3.6960  363.157   19.948  328.453   29.115  393.858   27.385  125.847   5.6093  137.911   4.8144 -12.06358 7.392068 
1 1 1    9    7   31 o  182.900   3.4263  693.162   25.822  697.333   35.807  688.643   37.273  183.493   4.7313  182.308   4.9571 1.185150 6.852634 
1 1 1    9    7   32 o   82.753   5.0499  143.297   17.182  150.230   23.776  135.719   24.857   84.900   6.7899   80.605   7.4769 4.294533 10.09987 
1 1 1    9    7   33 o   35.096   8.1522   20.618   15.685   43.872   22.149  -2.7752   22.215   44.486   11.857   25.707   11.192 18.77938 16.30433 
1 1 1    9    7   34 o   67.236   6.3747   95.643   17.661   91.379   25.061   99.848   24.891   65.703   9.2482   68.768   8.7760 -3.065407 12.74939 
1 1 1    9    7   35 o  120.765   4.1464  302.239   20.545  265.117   27.673  347.829   30.667  112.551   5.9613  128.979   5.7649 -16.42820 8.292837 
1 1 1    9    7   36 o   80.148   5.5964  135.230   18.383  149.181   27.989  124.648   24.377   83.684   8.1093   76.611   7.7149 7.073875 11.19285 
1 1 1    9    7   37 o   43.380   8.1989   42.240   16.136   65.738   23.249   20.401   22.413   53.797   10.853   32.964   12.293 20.83206 16.39774 
1 1 1    9    7   38 f   85.645   5.3790  151.557   18.533  208.619   29.129  112.747   24.023   98.903   7.1409   72.387   8.0463 26.51643 10.75807 
1 1 1    9    7   39 o   39.854   10.475   32.010   21.167   25.900   25.001   47.477   39.779   35.189   13.010   44.520   16.421 -9.330944 20.95012 
1 1 1    9    7   40 o   48.338   8.2502   56.220   16.726   74.223   23.570   37.959   23.739   56.721   10.461   39.955   12.761 16.76604 16.50038 
1 1 1    9    7   41 o   94.319   4.7256  191.840   18.296  169.820   25.696  214.482   26.056   88.607   7.0312  100.031   6.3156 -11.42342 9.451112 
1 1 1    9    7   42 o   65.602   8.0830  103.087   20.986   94.825   31.780  109.476   27.945   61.799   12.886   69.406   9.7622 -7.607639 16.16607 
1 1 1    9    7   43 o   28.254   8.1040   3.0337   16.819 -23.2644   23.539   30.463   24.040   20.794   9.9117   35.713   12.824 -14.91869 16.20802 
1 1 1    9    7   44 o   28.614   8.1537   9.8375   16.186   29.509   22.941  -9.6611   22.840   34.579   12.513   22.649   10.457 11.93093 16.30748 
1 1 1    9    7   45 o   31.040   7.9977   14.723   15.964 -13.4777   22.320   44.254   22.840   21.428   10.042   40.653   12.451 -19.22501 15.99542 
1 1 1    9    7   46 o   43.337   9.8849   58.345   20.694   64.540   25.346   45.961   35.838   48.185   12.608   38.489   15.228 9.696175 19.76974 
1 1 1    9    7   47 o   38.629   9.3806   44.068   18.143   48.720   25.618   39.387   25.700   40.542   13.282   36.716   13.250 3.826256 18.76126 
1 1 1    9    7   48 o   30.241   9.2545   13.431   22.599   46.194   33.462 -14.0421   30.642   36.809   14.666   23.674   11.291 13.13548 18.50910 
1 1 1    9    7   49 o   32.209   9.9721   32.210   25.050   26.310   33.336   39.862   37.965   30.745   13.538   33.674   14.645 -2.929667 19.94423 
1 1 1    9    7   50 o   24.512   8.4329 -17.5031   27.901 -49.0236   45.418   1.6018   35.359   23.107   11.545   25.918   12.295 -2.811165 16.86587 
1 1 1    9    8    0 o  1098.42   8.5527 24936.18  547.813 24936.18  547.813 24936.18  547.813  1098.42   12.095  1098.42   12.095 0.000000 0.000000 
1 1 1    9    8    1 o  214.184   2.3295  945.658   20.348  942.061   26.821  950.537   31.234  213.708   3.0429  214.659   3.5279 -0.9506836 4.658925 
1 1 1    9    8    2 o  816.799   6.0592 13775.31  201.705 13730.23  265.396 13836.96  310.362  815.331   7.8921  818.267   9.1962 -2.935913 12.11839 
1 1 1    9    8    3 o  317.614   2.8394  2081.38   36.814  2082.58   48.707  2079.79   56.225  317.730   3.7168  317.499   4.2936 0.2313538 5.678868 
1 1 1    9    8    4 o  234.539   2.8757  1141.54   27.542  1188.74   36.914  1082.26   41.367  240.048   3.7284  229.029   4.3792 11.01906 5.751390 
1 1 1    9    8    5 o  153.053   2.7746  483.262   17.514  478.512   24.678  488.083   24.861  152.295   3.9288  153.811   3.9189 -1.515656 5.549129 
1 1 1    9    8    6 f  453.906   4.3720  4255.86   80.291  4241.30  126.377  4265.72  103.971  453.205   6.7609  454.607   5.5451 -1.401093 8.744070 
1 1 1    9    8    7 o  231.378   2.4584  1096.78   23.022  1143.05   36.578  1066.43   29.626  235.383   3.7677  227.372   3.1591 8.011841 4.916859 
1 1 1    9    8    8 o  447.805   4.1497  4117.79   71.386  4197.90  127.177  4080.94   86.257  450.894   6.8386  444.716   4.7027 6.178101 8.299498 
1 1 1    9    8    9 o  227.742   2.4837  1067.52   23.123  1087.95   35.272  1052.12   30.622  229.643   3.7240  225.840   3.2875 3.803635 4.967435 
1 1 1    9    8   10 o  503.571   4.7286  5250.77   97.019  5332.02  128.184  5141.81  148.448  508.199   6.1155  498.943   7.2137 9.256409 9.457129 
1 1 1    9    8   11 o  219.923   2.4597  999.164   22.201  983.536   32.944  1012.17   30.049  218.341   3.6582  221.505   3.2891 -3.164169 4.919475 
1 1 1    9    8   12 o  214.688   2.9780  956.133   26.074  988.614   34.731  914.180   39.472  218.899   3.8469  210.477   4.5469 8.421524 5.955928 
1 1 1    9    8   13 o  508.602   3.8665  5350.18   78.889  5384.26  100.670  5295.94  126.989  510.767   4.7787  506.436   6.0796 4.330780 7.732924 
1 1 1    9    8   14 o  187.564   2.4189  732.415   18.212  756.271   23.433  696.019   28.944  191.467   2.9673  183.661   3.8210 7.806519 4.837867 
1 1 1    9    8   15 o  132.175   3.1583  356.406   17.116  314.699   22.857  409.644   25.824  123.475   4.4883  140.876   4.4445 -17.40135 6.316542 
1 1 1    9    8   16 o  265.251   3.0441  1448.40   33.247  1387.11   45.447  1518.98   48.766  259.233   4.2505  271.269   4.3587 -12.03589 6.088125 
1 1 1    9    8   17 o  284.826   2.7510  1674.04   31.202  1672.86   39.299  1676.05   51.323  284.722   3.3465  284.929   4.3673 -0.2062988 5.502067 
1 1 1    9    8   18 o   61.999   4.3036   81.955   9.9037   85.514   11.828   73.607   18.114   64.355   4.4562   59.642   7.3638 4.712418 8.607144 
1 1 1    9    8   19 o   82.483   3.9223  140.555   13.326  139.671   18.350  141.542   19.383   82.213   5.4117   82.753   5.6791 -0.5401306 7.844670 
1 1 1    9    8   20 o  131.617   2.8615  354.135   15.053  343.750   18.938  371.957   24.809  129.042   3.5582  134.193   4.4824 -5.150070 5.723015 
1 1 1    9    8   21 o  357.016   3.6184  2647.36   47.889  2663.40   56.565  2606.77   89.981  359.130   3.8188  354.902   6.1472 4.227692 7.236799 
1 1 1    9    8   22 o   23.415   7.1780  -5.3048   13.017 -13.5115   17.361   5.2347   19.674   19.843   9.1462   26.987   11.065 -7.143730 14.35593 
1 1 1    9    8   23 o   74.394   4.2967  114.567   13.182  116.807   18.796  112.399   18.493   75.110   6.0675   73.678   6.0855 1.431702 8.593427 
1 1 1    9    8   24 o  118.921   3.2324  292.390   15.854  294.009   22.376  290.758   22.467  119.253   4.5493  118.589   4.5933 0.6639404 6.464866 
1 1 1    9    8   25 o   40.835   7.9404   37.067   13.858   27.474   22.515   42.918   17.583   37.185   12.462   44.485   9.8439 -7.300404 15.88076 
1 1 1    9    8   26 o   94.365   3.9733  183.139   15.408  166.803   20.796  203.023   22.943   89.733   5.6190   98.997   5.6191 -9.264183 7.946518 
1 1 1    9    8   27 o  244.398   3.0453  1232.58   30.341  1252.52   46.765  1218.10   39.872  246.051   4.6082  242.746   3.9825 3.305740 6.090611 
1 1 1    9    8   28 o   55.874   6.2484   66.394   13.948   76.459   19.825   56.528   19.628   60.583   7.9340   51.165   9.6551 9.417786 12.49683 
1 1 1    9    8   29 o  175.137   3.0290  634.531   21.878  631.623   31.101  637.380   30.781  174.735   4.3155  175.538   4.2516 -0.8026733 6.057985 
1 1 1    9    8   30 o  124.201   3.7776  321.986   19.206  295.807   28.186  344.677   26.241  119.408   5.7231  128.994   4.9323 -9.586121 7.555180 
1 1 1    9    8   31 o   85.872   7.1184  169.767   21.687  188.810   25.857  124.594   39.824   95.261   6.5810   76.483   12.625 18.77827 14.23683 
1 1 1    9    8   32 o   47.012   8.2926   48.853   16.115   41.404   22.622   56.529   22.961   43.391   12.155   50.632   11.284 -7.241760 16.58527 
1 1 1    9    8   33 o   74.617   5.4941  116.836   16.903  120.389   23.946  113.308   23.863   75.765   7.6630   73.469   7.8751 2.296227 10.98814 
1 1 1    9    8   34 o   77.845   6.6470  127.007   21.110  140.350   32.885  117.654   27.532   81.171   9.8226   74.519   8.9580 6.652023 13.29395 
1 1 1    9    8   35 o   41.272   8.3222   36.908   15.926   56.716   22.851   18.200   22.208   50.151   11.317   32.394   12.205 17.75616 16.64432 
1 1 1    9    8   36 o   53.098   7.8965   59.846   17.300   98.589   27.180   33.462   22.430   67.434   9.7726   38.762   12.406 28.67168 15.79310 
1 1 1    9    8   37 o   27.570   7.8365   1.9285   15.470   23.725   21.481 -21.5562   22.297   34.088   12.135   21.052   9.9191 13.03570 15.67308 
1 1 1    9    8   38 o   54.440   7.5205   68.050   16.280   68.618   23.135   67.493   22.914   54.667   10.644   54.214   10.628 0.4525108 15.04095 
1 1 1    9    8   39 o   33.005   9.8329   13.401   21.265   15.651   24.963   7.4507   40.597   31.483   12.625   34.527   15.078 -3.043482 19.66575 
1 1 1    9    8   40 o   35.885   8.5036   27.473   16.010   10.447   22.808   44.011   22.478   28.925   11.893   42.844   12.157 -13.91873 17.00723 
1 1 1    9    8   41 o   45.985   8.7157   52.294   16.957   46.145   24.082   58.340   23.882   43.110   12.691   48.861   11.950 -5.750710 17.43147 
1 1 1    9    8   42 o   25.928   8.0133   1.2245   16.353   7.0366   23.266  -4.4498   22.989   27.513   11.707   24.343   10.946 3.169392 16.02660 
1 1 1    9    8   43 o   28.233   8.4276   9.2577   16.799   5.6229   22.825   13.554   24.815   26.693   11.482   29.774   12.340 -3.080591 16.85528 
1 1 1    9    8   44 o   29.123   8.4818   14.703   16.442   14.308   23.392   15.088   23.117   29.036   12.003   29.209   11.988 -0.1732121 16.96366 
1 1 1    9    8   45 o   27.391   8.2778   7.9915   16.916  -2.7790   23.206   20.204   24.710   23.981   10.870   30.801   12.487 -6.820004 16.55553 
1 1 1    9    8   46 f   39.196   9.7305   35.387   20.190   12.301   24.842   80.308   34.652   27.987   12.007   50.404   15.315 -22.41735 19.46091 
1 1 1    9    8   47 o   33.299   8.8821   27.585   18.004   8.0044   24.962   48.811   25.990   26.440   11.675   40.159   13.389 -13.71955 17.76427 
1 1 1    9    8   48 o   26.938   8.5315  -1.9202   22.095 -44.3806   33.154   32.005   29.635   20.978   10.376   32.898   13.545 -11.92046 17.06306 
1 1 1    9    8   49 o   25.344   8.3543   1.8326   21.446  -4.4412   32.365   6.7437   28.635   24.841   11.778   25.847   11.852 -1.005899 16.70865 
1 1 1    9    8   50 o   24.346   8.4658 -25.9875   27.607   9.3584   44.603 -47.9372   35.148   28.135   13.474   20.556   10.253 7.578175 16.93155 
1 1 1    9    9    0 o  148.268   2.3215  454.084   20.054  454.084   20.054  454.084   20.054  148.268   3.2830  148.268   3.2830 0.000000 0.000000 
1 1 1    9    9    1 o  115.851   2.5917  278.484   12.093  269.236   19.134  284.635   15.605  114.235   4.0612  117.466   3.2209 -3.231422 5.183378 
1 1 1    9    9    2 o  323.805   3.0837  2162.23   41.162  2129.31   57.131  2197.75   59.355  321.246   4.3119  326.364   4.4095 -5.118103 6.167374 
1 1 1    9    9    3 o  361.910   3.3113  2702.78   49.427  2702.18   69.839  2703.38   69.962  361.870   4.6793  361.950   4.6865 -0.7998657E-01 6.622589 
1 1 1    9    9    4 o  452.515   3.6397  4232.24   67.527  4285.14   90.992  4167.38  100.747  455.688   4.8414  449.343   5.4361 6.345062 7.279480 
1 1 1    9    9    5 o  133.018   2.8464  364.968   15.616  364.968   15.616   0.0000   0.0000  133.018   2.8464  ?   ?       ?      ? 
1 1 1    9    9    6 o  290.431   2.9155  1738.95   34.900  1705.72   48.315  1775.21   50.468  287.534   4.0741  293.329   4.1715 -5.795166 5.830919 
1 1 1    9    9    7 o  266.029   2.5001  1456.59   26.562  1473.33   43.490  1446.63   33.545  267.234   3.9458  264.823   3.0712 2.410614 5.000144 
1 1 1    9    9    8 o  319.790   2.8872  2099.67   37.405  2163.67   59.105  2056.91   48.310  323.822   4.4254  315.758   3.7095 8.063416 5.774459 
1 1 1    9    9    9 o  129.525   2.1322  343.760   11.091  356.036   17.998  336.245   14.082  131.373   3.3217  127.677   2.6742 3.695892 4.264338 
1 1 1    9    9   10 o  290.454   3.2229  1748.12   38.241  1797.74   51.102  1684.96   57.649  295.172   4.1976  285.735   4.8918 9.437592 6.445845 
1 1 1    9    9   11 o  325.286   2.9379  2184.71   39.112  2171.52   58.998  2195.06   52.242  324.398   4.4095  326.175   3.8833 -1.776703 5.875733 
1 1 1    9    9   12 o   72.383   2.7074  108.423   8.0518  118.798   11.350   97.911   11.424   75.882   3.6265   68.885   4.0210 6.996742 5.414826 
1 1 1    9    9   13 o   62.120   3.4284   84.005   8.1525   93.760   10.193   66.689   13.581   67.410   3.6663   56.829   5.7942 10.58083 6.856749 
1 1 1    9    9   14 o  179.427   2.5641  664.206   18.847  663.395   25.220  665.230   28.362  179.309   3.4102  179.545   3.8300 -0.2352905 5.128178 
1 1 1    9    9   15 o  403.665   4.0830  3376.25   67.271  3442.05   89.430  3290.49  102.095  408.260   5.3110  399.069   6.2028 9.190887 8.165934 
1 1 1    9    9   16 o  179.456   2.6852  660.455   19.644  638.409   25.699  691.441   30.468  175.885   3.5426  183.026   4.0362 -7.140472 5.370355 
1 1 1    9    9   17 o  429.275   3.6122  3801.63   63.119  3777.48   82.714  3835.31   97.667  427.699   4.6889  430.851   5.4961 -3.152161 7.224492 
1 1 1    9    9   18 o  125.566   2.8308  325.704   14.034  326.215   17.487  324.779   23.522  125.724   3.3724  125.408   4.5476 0.3162308 5.661579 
1 1 1    9    9   19 f  350.227   3.0623  2537.50   42.907  2551.06   54.499  2515.39   69.589  351.523   3.7590  348.931   4.8354 2.592102 6.124615 
1 1 1    9    9   20 o  167.495   3.0256  579.327   20.899  591.529   29.820  567.548   29.298  169.229   4.2723  165.762   4.2854 3.466660 6.051227 
1 1 1    9    9   21 o  384.418   5.1452  2992.53   56.761  2964.74   61.117  3166.94  153.094  378.851   3.9114  389.985   9.5180 -11.13348 10.29031 
1 1 1    9    9   22 o  169.480   3.0354  593.465   21.214  590.264   29.675  596.810   30.337  169.015   4.2570  169.944   4.3281 -0.9288940 6.070776 
1 1 1    9    9   23 o  131.545   3.1278  358.034   16.886  361.785   22.838  353.510   25.079  132.321   4.1846  130.769   4.6499 1.552261 6.255590 
1 1 1    9    9   24 o  105.579   3.4403  230.532   14.969  242.992   21.356  218.497   20.988  108.388   4.7773  102.769   4.9517 5.619720 6.880515 
1 1 1    9    9   25 o  268.892   3.5446  1493.09   38.877  1476.22   51.177  1516.11   59.781  267.164   4.6444  270.620   5.3560 -3.456482 7.089242 
1 1 1    9    9   26 o  192.722   2.9676  765.678   23.449  747.916   31.332  788.292   35.354  190.213   3.9937  195.231   4.3906 -5.018234 5.935254 
1 1 1    9    9   27 o  116.191   3.5826  280.240   17.122  293.307   23.734  266.061   24.724  119.043   4.8340  113.339   5.2890 5.704147 7.165273 
1 1 1    9    9   28 o  141.430   3.5852  413.448   20.859  424.647   30.794  403.953   28.354  143.180   5.2146  139.681   4.9217 3.498489 7.170432 
1 1 1    9    9   29 o  191.553   3.1185  758.241   24.496  749.748   32.838  768.897   36.782  190.379   4.1821  192.728   4.6272 -2.349228 6.237052 
1 1 1    9    9   30 o  111.416   4.1047  259.063   18.658  246.808   28.165  268.647   24.907  108.996   6.2652  113.835   5.3050 -4.838249 8.209461 
1 1 1    9    9   31 o   77.921   7.4209  115.466   21.806   99.009   25.401  161.572   42.516   68.677   8.9676   87.166   11.826 -18.48918 14.84171 
1 1 1    9    9   32 o   69.839   5.8880  103.110   16.752   84.541   23.608  121.944   23.776   63.351   9.0351   76.328   7.5525 -12.97610 11.77591 
1 1 1    9    9   33 o   50.562   7.9807   56.821   16.254   49.726   22.984   63.920   22.991   47.235   11.825   53.889   10.721 -6.654202 15.96139 
1 1 1    9    9   34 o  153.145   4.0972  487.280   25.686  511.512   39.151  468.967   34.035  156.372   6.0704  149.917   5.5044 6.455368 8.194416 
1 1 1    9    9   35 o   46.049   8.3302   48.307   15.904   45.301   22.595   51.259   22.391   44.597   12.014   47.501   11.542 -2.904327 16.66047 
1 1 1    9    9   36 f   35.782   8.9704   26.466   16.586   24.578   23.114   28.471   23.814   34.894   12.570   36.669   12.801 -1.774963 17.94074 
1 1 1    9    9   37 f   91.940   4.7773  179.143   18.088  166.651   25.379  192.041   25.787   88.612   6.9441   95.267   6.5629 -6.655220 9.554647 
1 1 1    9    9   38 f   24.526   7.6961  -3.5771   15.519  -4.8789   21.559  -2.1774   22.355   23.961   10.699   25.091   11.066 -1.129877 15.39214 
1 1 1    9    9   39 o   56.107   9.1271   77.012   20.487   80.476   26.734   72.083   31.890   58.520   11.486   53.693   14.187 4.827057 18.25424 
1 1 1    9    9   40 o   23.835   7.3995 -11.8408   15.537   13.403   22.025 -36.8451   21.920   29.544   11.855   18.126   8.8584 11.41821 14.79908 
1 1 1    9    9   41 o   68.200   7.9601  113.564   20.801   87.219   31.826  133.210   27.483   58.939   13.396   77.461   8.6024 -18.52128 15.92023 
1 1 1    9    9   42 o   43.025   8.5166   46.001   16.347   30.729   22.885   61.913   23.359   35.819   12.546   50.232   11.520 -14.41247 17.03312 
1 1 1    9    9   43 o   65.617   6.4156   98.754   17.216  113.399   24.549   84.580   24.150   70.883   8.3969   60.351   9.7021 10.53233 12.83113 
1 1 1    9    9   44 o   34.338   8.4680   27.749   16.559   5.6100   24.632   46.005   22.368   26.863   11.738   41.813   12.209 -14.94939 16.93597 
1 1 1    9    9   45 o   40.771   9.1374   46.873   17.618   55.742   24.431   37.264   25.430   44.889   12.652   36.653   13.187 8.236256 18.27471 
1 1 1    9    9   46 o   32.144   9.1186   11.795   23.268   54.280   30.653 -45.9695   35.743   41.882   14.529   22.405   11.023 19.47721 18.23724 
1 1 1    9    9   47 o   31.861   9.1937   16.735   22.770 -27.5507   33.414   55.126   31.111   23.046   11.190   40.676   14.591 -17.62943 18.38735 
1 1 1    9    9   48 o   25.335   8.4049  -3.4767   22.128  -2.3682   32.847  -4.3978   29.942   25.890   12.148   24.781   11.618 1.109060 16.80972 
1 1 1    9    9   49 o   26.063   8.5354   6.6068   21.731   5.9304   31.948   7.1894   29.646   26.179   12.184   25.947   11.957 0.2318974 17.07086 
1 1 1    9   10    0 o  285.664   3.5198  1684.97   58.607  1684.97   58.607  1684.97   58.607  285.664   4.9777  285.664   4.9777 0.000000 0.000000 
1 1 1    9   10    1 o  157.138   3.1429  507.328   16.408  505.850   18.374  513.140   36.452  156.601   2.8448  157.674   5.6052 -1.073471 6.285783 
1 1 1    9   10    2 o  209.788   2.6365  904.011   21.436  896.544   26.115  919.433   37.529  208.479   3.0371  211.097   4.3104 -2.617569 5.272927 
1 1 1    9   10    3 o  149.930   2.5840  468.994   15.765  505.065   21.178  424.158   23.611  156.474   3.2815  143.385   3.9926 13.08951 5.168086 
1 1 1    9   10    4 o  124.217   2.4718  313.908   11.698  307.088   13.994  329.724   21.312  122.017   2.7808  126.418   4.0875 -4.401741 4.943699 
1 1 1    9   10    5 o  259.167   2.5714  1386.97   27.311  1373.68   40.898  1397.67   36.692  258.040   3.8428  260.294   3.4177 -2.253937 5.142769 
1 1 1    9   10    6 o  696.350   5.2357 10024.02  149.232  9945.71  224.874 10085.64  199.492  693.849   7.8579  698.852   6.9211 -5.002747 10.47132 
1 1 1    9   10    7 o  404.543   3.3567  3382.85   55.721  3319.11   82.681  3435.89   75.422  401.031   4.9988  408.055   4.4814 -7.024109 6.713454 
1 1 1    9   10    8 o  402.456   3.1910  3353.71   51.770  3287.69   82.021  3397.43   66.745  399.124   4.9826  405.787   3.9880 -6.663300 6.382031 
1 1 1    9   10    9 o  410.467   3.4017  3480.83   57.218  3442.86   85.692  3511.39   76.863  408.427   5.0870  412.507   4.5177 -4.080139 6.803481 
1 1 1    9   10   10 o  337.694   3.1969  2353.10   44.521  2342.51   62.416  2364.06   63.522  336.922   4.4916  338.466   4.5503 -1.543549 6.393736 
1 1 1    9   10   11 o  436.362   3.5723  3918.75   63.249  3993.95   99.193  3867.24   82.106  439.844   5.4678  432.879   4.5988 6.965118 7.144643 
1 1 1    9   10   12 o  410.521   3.1800  3477.21   53.826  3519.19   77.235  3437.57   75.055  412.926   4.5350  408.115   4.4589 4.810730 6.359906 
1 1 1    9   10   13 o  245.784   3.0985  1236.74   29.107  1220.29   34.981  1273.77   52.477  243.188   3.4876  248.379   5.1226 -5.191574 6.197083 
1 1 1    9   10   14 o  280.948   2.8135  1626.43   32.143  1613.67   41.996  1644.48   49.945  279.638   3.6412  282.259   4.2902 -2.620941 5.627065 
1 1 1    9   10   15 o  221.651   2.9585  1006.87   25.710  991.181   31.644  1037.35   44.100  219.160   3.5007  224.142   4.7703 -4.981567 5.917034 
1 1 1    9   10   16 o  533.188   4.2235  5884.27   92.378  5963.74  124.803  5787.96  137.385  537.241   5.6324  529.136   6.2952 8.104797 8.447054 
1 1 1    9   10   17 o  261.609   2.7967  1408.52   29.757  1387.61   38.832  1438.27   46.314  259.285   3.6312  263.933   4.2545 -4.648376 5.593410 
1 1 1    9   10   18 o  233.914   2.7725  1132.64   26.625  1164.70   36.267  1095.17   39.211  237.528   3.7020  230.300   4.1281 7.227570 5.544903 
1 1 1    9   10   19 o  381.121   3.2322  2987.61   48.672  2955.64   60.525  3046.12   81.882  378.341   3.8787  383.901   5.1714 -5.559326 6.464322 
1 1 1    9   10   20 o   64.735   4.9939   86.727   13.298   95.920   19.197   78.246   18.438   68.038   6.8411   61.431   7.2771 6.606575 9.987810 
1 1 1    9   10   21 o  179.936   3.1789  669.428   22.467  670.039   27.823  668.282   38.088  180.115   3.7454  179.757   5.1374 0.3579102 6.357713 
1 1 1    9   10   22 o  211.280   3.3181  930.399   27.104  945.140   33.151  900.679   47.071  213.916   3.7574  208.644   5.4699 5.272781 6.636130 
1 1 1    9   10   23 o   93.170   3.3334  175.883   12.025  169.375   14.543  189.948   21.380   90.541   3.8945   95.798   5.4111 -5.257164 6.666852 
1 1 1    9   10   24 o  168.275   2.9419  585.492   20.343  587.735   27.638  582.841   30.052  168.644   3.9735  167.907   4.3394 0.7371826 5.883849 
1 1 1    9   10   25 o  173.160   3.2361  620.864   23.054  567.021   32.441  675.798   32.768  165.547   4.7513  180.773   4.3950 -15.22563 6.472293 
1 1 1    9   10   26 o   65.582   5.2386   91.483   13.586  122.620   19.383   61.411   19.049   76.893   6.1118   54.272   8.5098 22.62043 10.47715 
1 1 1    9   10   27 o   51.481   6.7797   56.688   14.037   63.810   19.795   49.483   19.909   55.290   8.6803   47.672   10.417 7.617828 13.55943 
1 1 1    9   10   28 o   37.008   8.4607   28.423   14.727   23.106   23.338   31.941   18.983   35.455   12.646   38.562   11.244 -3.106792 16.92140 
1 1 1    9   10   29 o   86.367   4.5413  155.208   16.146  150.706   23.353  159.332   22.349   85.142   6.6501   87.592   6.1863 -2.450310 9.082624 
1 1 1    9   10   30 o  106.057   6.1469  242.894   25.144  258.861   31.164  213.114   42.561  111.522   6.7752  100.593   10.258 10.92874 12.29373 
1 1 1    9   10   31 o  157.038   3.9874  513.233   25.624  519.031   34.279  505.891   38.577  158.123   5.2561  155.954   5.9975 2.169235 7.974760 
1 1 1    9   10   32 o   97.064   4.4678  196.602   17.824  218.104   25.479  175.993   24.944  102.312   6.0380   91.817   6.5869 10.49574 8.935545 
1 1 1    9   10   33 o  188.880   4.0026  743.276   31.140  794.853   44.427  693.461   43.661  195.371   5.5134  182.389   5.8040 12.98141 8.005240 
1 1 1    9   10   34 o   44.666   8.0153   43.156   16.245   72.845   23.735   16.994   22.281   57.347   10.419   31.984   12.183 25.36335 16.03065 
1 1 1    9   10   35 o   97.363   4.4548  199.405   17.886  203.885   25.547  195.098   25.050   98.437   6.2923   96.288   6.3077 2.149368 8.909564 
1 1 1    9   10   36 o   44.109   8.6543   45.108   16.281   44.880   22.349   45.367   23.767   44.034   11.985   44.185   12.488 -0.1509705 17.30853 
1 1 1    9   10   37 o   37.060   9.0883   30.110   16.940   28.385   25.316   31.508   22.795   36.614   13.159   37.507   12.539 -0.8925095 18.17662 
1 1 1    9   10   38 o   47.670   8.8753   54.823   17.793   47.645   25.209   61.949   25.119   44.392   12.961   50.947   12.129 -6.554585 17.75060 
1 1 1    9   10   39 o   49.452   8.3904   55.629   17.179   83.128   26.876   36.634   22.337   59.572   11.353   39.333   12.357 20.23932 16.78084 
1 1 1    9   10   40 o   36.288   8.8981   30.014   16.447   22.848   22.809   37.776   23.738   33.090   12.388   39.486   12.776 -6.395870 17.79624 
1 1 1    9   10   41 o   38.020   9.5208   34.544   19.610   18.057   30.745   45.851   25.461   33.321   13.766   42.720   13.156 -9.399841 19.04170 
1 1 1    9   10   42 o   37.034   7.8071   26.097   16.361   63.870   23.588  -8.9253   22.713   50.991   11.491   23.076   10.572 27.91503 15.61428 
1 1 1    9   10   43 o   38.968   8.7972   39.010   16.473   50.748   23.360   27.400   23.232   44.129   12.348   33.807   12.533 10.32232 17.59444 
1 1 1    9   10   44 o   31.343   8.4229   18.584   16.178   38.590   23.832   1.4841   22.033   38.015   12.821   24.671   10.928 13.34398 16.84589 
1 1 1    9   10   45 o   54.024   8.3247   77.826   18.498   94.793   26.118   60.750   26.202   61.921   10.227   46.127   13.138 15.79355 16.64945 
1 1 1    9   10   46 f   26.986   8.4472   1.9022   18.655   25.080   29.511 -13.5241   24.075   32.175   13.406   21.797   10.281 10.37807 16.89432 
1 1 1    9   10   47 o   36.862   10.148   42.593   22.880   64.609   34.068   24.503   30.881   42.601   15.270   31.124   13.371 11.47732 20.29625 
1 1 1    9   10   48 o   20.490   7.1622 -40.2710   22.015 -34.4352   32.480 -45.2305   29.943   21.474   10.554   19.505   9.6851 1.968975 14.32444 
1 1 1    9   10   49 o   25.639   8.4540   4.5076   22.036  -3.5480   33.735   10.502   29.102   24.953   11.886   26.325   12.025 -1.372244 16.90804 
1 1 1    9   11    0 o  535.188   4.4578  5912.51  139.116  5912.51  139.116  5912.51  139.116  535.188   6.3043  535.188   6.3043 0.000000 0.000000 
1 1 1    9   11    1 o  220.441   2.5281  1002.47   22.985  1006.09   32.574  998.885   32.437  220.837   3.5763  220.045   3.5741 0.7924957 5.056118 
1 1 1    9   11    2 o  360.841   3.0955  2683.26   45.494  2665.52   59.705  2707.82   70.250  359.436   4.0274  362.246   4.7019 -2.810364 6.190948 
1 1 1    9   11    3 o  264.649   2.5745  1440.60   27.690  1420.12   36.074  1469.96   43.204  262.376   3.3335  266.923   3.9244 -4.547577 5.149096 
1 1 1    9   11    4 o  508.949   4.2790  5346.56   89.799  5299.88  125.343  5395.78  128.713  506.673   5.9980  511.226   6.1044 -4.553528 8.558043 
1 1 1    9   11    5 o  326.199   3.2824  2198.25   41.882  2188.06   71.586  2203.55   51.643  325.588   5.3308  326.809   3.8313 -1.221008 6.564826 
1 1 1    9   11    6 o  401.278   3.9504  3333.99   64.602  3392.11   85.449  3256.45   98.699  405.405   5.1104  397.151   6.0255 8.253601 7.900784 
1 1 1    9   11    7 o  335.093   3.4959  2323.79   47.691  2358.70   62.864  2276.46   73.203  338.087   4.5082  332.098   5.3443 5.989166 6.991847 
1 1 1    9   11    8 o  358.947   3.3063  2658.65   48.942  2641.66   68.623  2676.24   69.823  357.782   4.6504  360.113   4.7010 -2.331482 6.612509 
1 1 1    9   11    9 o  666.319   6.0527  9150.60  161.837  9057.11  205.781  9302.17  262.018  662.062   7.5360  670.576   9.4737 -8.513611 12.10544 
1 1 1    9   11   10 o  353.749   3.1162  2576.26   44.937  2623.14   69.313  2542.26   59.022  356.500   4.7140  350.998   4.0770 5.501495 6.232461 
1 1 1    9   11   11 o  341.673   2.8747  2414.45   39.446  2385.80   63.282  2432.65   50.445  339.984   4.5129  343.363   3.5620 -3.378693 5.749310 
1 1 1    9   11   12 o  208.548   2.8477  892.883   24.362  1034.00   35.773  770.821   33.270  223.841   3.8749  193.255   4.1740 30.58597 5.695355 
1 1 1    9   11   13 o  373.166   3.1237  2866.14   46.235  2844.22   57.820  2905.01   76.996  371.243   3.7762  375.089   4.9770 -3.846771 6.247375 
1 1 1    9   11   14 o  208.794   2.8358  906.695   23.337  923.781   29.150  876.198   38.944  211.583   3.3404  206.005   4.5835 5.578323 5.671590 
1 1 1    9   11   15 o  175.429   3.1836  618.258   20.785  596.856   24.376  675.266   39.783  170.061   3.4753  180.796   5.3351 -10.73489 6.367170 
1 1 1    9   11   16 f  314.697   3.0024  2044.19   38.587  2040.88   51.096  2048.58   58.867  314.427   3.9401  314.968   4.5315 -0.5410461 6.004863 
1 1 1    9   11   17 o  121.035   2.9090  306.175   14.293  328.099   19.046  277.907   21.627  126.072   3.6628  115.998   4.5203 10.07344 5.818032 
1 1 1    9   11   18 o  157.829   3.0765  514.744   19.987  510.556   29.137  518.466   27.469  157.214   4.4936  158.444   4.2034 -1.229752 6.153092 
1 1 1    9   11   19 o  341.911   3.0281  2405.04   40.980  2379.55   51.075  2451.09   68.659  339.464   3.6480  344.358   4.8342 -4.894196 6.056149 
1 1 1    9   11   20 o  115.887   2.9780  280.211   13.431  285.951   16.554  269.153   22.977  117.679   3.4106  114.094   4.8827 3.585197 5.955942 
1 1 1    9   11   21 o  116.538   3.3454  273.894   14.943  262.895   17.896  299.218   27.156  112.817   3.8462  120.259   5.4749 -7.441986 6.690884 
1 1 1    9   11   22 o  169.341   3.3050  588.164   19.614  583.961   22.409  601.927   40.554  168.173   3.2307  170.509   5.7666 -2.336594 6.609915 
1 1 1    9   11   23 o  181.684   2.6703  668.638   18.956  641.994   23.123  723.244   33.103  176.322   3.1796  187.045   4.2910 -10.72290 5.340643 
1 1 1    9   11   24 f  132.884   3.5617  367.384   19.347  349.015   28.945  382.220   26.012  129.830   5.4054  135.938   4.6395 -6.107895 7.123457 
1 1 1    9   11   25 o   89.307   4.1147  164.610   15.099  157.673   20.329  173.146   22.551   87.230   5.6503   91.384   5.9830 -4.153633 8.229390 
1 1 1    9   11   26 o   72.042   4.9433  107.913   13.914  159.157   20.801   66.412   18.719   87.622   5.7558   56.461   8.0385 31.16045 9.886649 
1 1 1    9   11   27 o  129.309   3.4295  343.491   18.210  318.401   24.393  375.072   27.368  124.025   4.7686  134.594   4.9301 -10.56841 6.858965 
1 1 1    9   11   28 o   44.054   8.3013   43.075   15.378   36.061   23.867   48.054   20.109   41.208   12.745   46.899   10.640 -5.690781 16.60267 
1 1 1    9   11   29 o  143.509   3.2875  426.499   19.455  429.690   27.319  423.214   27.712  144.060   4.5978  142.958   4.7000 1.102509 6.574950 
1 1 1    9   11   30 o  106.402   4.4469  235.377   19.503  231.320   27.024  239.787   28.174  105.457   6.2132  107.347   6.3635 -1.890373 8.893721 
1 1 1    9   11   31 o  198.354   3.4831  816.636   28.487  793.128   40.243  840.248   40.332  195.476   4.9915  201.233   4.8594 -5.756943 6.966263 
1 1 1    9   11   32 o  145.896   4.8687  434.415   28.740  393.808   36.608  499.651   46.399  137.343   6.4625  154.448   7.2838 -17.10507 9.737421 
1 1 1    9   11   33 o   40.030   9.5742   34.139   18.754   26.535   30.718   38.656   23.679   38.316   14.371   41.744   12.655 -3.427235 19.14844 
1 1 1    9   11   34 o  163.364   3.5006  554.682   23.475  538.324   31.508  575.093   35.195  160.737   4.7526  165.991   5.1408 -5.254074 7.001135 
1 1 1    9   11   35 o   82.184   5.0945  143.327   17.263  144.778   24.766  141.956   24.077   82.566   7.2724   81.802   7.1363 0.7646790 10.18896 
1 1 1    9   11   36 o  111.151   4.2035  259.313   19.205  250.788   25.948  269.639   28.560  109.207   5.7609  113.096   6.1227 -3.888649 8.406901 
1 1 1    9   11   37 f   48.105   8.7021   54.886   17.204   58.071   26.309   52.506   22.740   49.087   12.846   47.123   11.743 1.963718 17.40426 
1 1 1    9   11   38 o   30.168   8.5545   12.378   16.759   0.8994   24.218   22.926   23.215   26.771   11.669   33.566   12.512 -6.794722 17.10899 
1 1 1    9   11   39 o   26.783   8.1911   2.2422   16.375   4.9295   25.463   0.3471   21.383   28.388   12.167   25.177   10.970 3.211481 16.38225 
1 1 1    9   11   40 o   25.627   8.1103  -7.9284   18.872   9.8810   22.993 -44.6882   33.034   28.446   11.841   22.809   11.086 5.636909 16.22064 
1 1 1    9   11   41 o   62.725   6.5746   89.144   17.001   88.142   24.307   90.104   23.787   62.279   9.4630   63.171   9.1299 -0.8917999 13.14923 
1 1 1    9   11   42 o   24.516   7.7062  -1.4665   15.677   2.1211   22.233  -5.0141   22.109   25.452   11.135   23.580   10.656 1.872913 15.41243 
1 1 1    9   11   43 o   25.739   7.9891   3.3552   16.302   3.3328   23.252   3.3768   22.861   25.813   11.338   25.665   11.258 0.1477489 15.97815 
1 1 1    9   11   44 o   30.991   8.9359   20.249   18.098   23.890   24.145   15.581   27.340   31.964   12.546   30.017   12.728 1.946392 17.87173 
1 1 1    9   11   45 o   21.875   7.2704 -13.0049   16.804  -8.9575   23.365 -17.3416   24.185   22.445   10.437   21.304   10.124 1.140413 14.54072 
1 1 1    9   11   46 o   25.524   8.2162  -3.9926   18.799   18.733   29.908 -18.8360   24.171   30.240   13.075   20.809   9.9531 9.431107 16.43235 
1 1 1    9   11   47 o   26.823   9.1332 -12.0435   27.709 -19.6278   33.912   3.1904   48.062   23.929   11.534   29.718   14.165 -5.789358 18.26641 
1 1 1    9   11   48 f   29.056   9.8020   3.7952   28.739 -13.7792   34.117   46.733   53.327   24.090   11.601   34.022   15.803 -9.932409 19.60399 
1 1 1    9   11   49 o   25.262   8.3711   0.1209   22.735 -21.9872   34.397   17.270   30.295   22.774   11.123   27.751   12.513 -4.977257 16.74219 
1 1 1    9   12    0 o  359.518   3.2914  2667.74   68.995  2667.74   68.995  2667.74   68.995  359.518   4.6547  359.518   4.6547 0.000000 0.000000 
1 1 1    9   12    1 o  271.598   2.5926  1521.82   28.734  1521.64   37.972  1522.06   43.952  271.588   3.3899  271.608   3.9235 -0.2032471E-01 5.185134 
1 1 1    9   12    2 o  294.226   2.7105  1789.02   32.655  1811.57   43.781  1760.74   49.024  296.327   3.5822  292.124   4.0689 4.203400 5.421061 
1 1 1    9   12    3 o  124.080   2.1066  317.836   10.667  319.323   14.114  315.855   16.289  124.422   2.7504  123.739   3.1916 0.6826706 4.213227 
1 1 1    9   12    4 o  195.418   2.4357  786.168   19.606  756.364   26.904  819.916   28.630  191.477   3.4068  199.358   3.4819 -7.880478 4.871307 
1 1 1    9   12    5 o  118.924   2.2852  291.480   11.203  303.557   16.119  280.194   15.582  121.305   3.2218  116.544   3.2418 4.761810 4.570431 
1 1 1    9   12    6 o  294.270   3.2098  1795.08   38.774  1906.82   53.460  1671.07   56.321  303.987   4.2639  284.553   4.7989 19.43430 6.419555 
1 1 1    9   12    7 o  173.723   2.2592  623.966   16.139  602.028   23.509  643.518   22.194  170.826   3.3367  176.620   3.0467 -5.794144 4.518407 
1 1 1    9   12    8 o  492.785   4.6112  5034.73   93.178  5218.18  126.573  4817.69  137.672  502.671   6.1051  482.899   6.9123 19.77142 9.222370 
1 1 1    9   12    9 o  179.395   2.5452  659.720   17.792  677.144   30.881  651.062   21.768  181.141   4.1335  177.649   2.9710 3.492126 5.090396 
1 1 1    9   12   10 o   88.606   2.6426  158.010   9.3021  176.575   15.754  148.073   11.526   92.497   4.1294   84.715   3.2987 7.781693 5.285246 
1 1 1    9   12   11 o  150.545   2.4205  464.061   14.970  424.875   20.138  512.466   22.382  143.496   3.4026  157.594   3.4434 -14.09775 4.840989 
1 1 1    9   12   12 o  157.790   2.9573  515.802   18.767  522.619   24.094  505.287   29.923  159.137   3.6709  156.443   4.6375 2.693802 5.914550 
1 1 1    9   12   13 o  192.353   2.9931  767.555   23.615  811.252   32.363  717.791   34.536  198.249   3.9579  186.456   4.4909 11.79352 5.986114 
1 1 1    9   12   14 o  145.666   2.8762  427.488   16.659  400.860   20.670  476.845   28.141  139.365   3.5959  151.967   4.4898 -12.60153 5.752312 
1 1 1    9   12   15 o  265.785   2.6599  1465.23   28.435  1491.15   36.558  1425.53   45.243  268.804   3.2974  262.765   4.1747 6.038727 5.319866 
1 1 1    9   12   16 o  108.823   3.1218  244.676   14.006  239.302   19.943  249.906   19.674  107.640   4.4921  110.005   4.3362 -2.364815 6.243549 
1 1 1    9   12   17 o  155.258   2.5621  497.891   15.862  498.630   20.028  496.648   25.980  155.434   3.1241  155.082   4.0617 0.3524017 5.124167 
1 1 1    9   12   18 o   85.850   4.1076  155.074   14.286  134.012   21.348  172.156   19.226   80.450   6.4339   91.251   5.1083 -10.80152 8.215259 
1 1 1    9   12   19 o  166.824   2.7764  573.200   19.000  559.430   25.439  590.572   28.572  164.577   3.7476  169.070   4.0974 -4.493271 5.552823 
1 1 1    9   12   20 o  295.974   3.2833  1795.80   35.734  1778.00   41.830  1843.88   68.743  293.437   3.4563  298.512   5.5834 -5.074615 6.566623 
1 1 1    9   12   21 o   76.001   4.6738  116.902   14.477  141.438   22.593   99.809   18.857   82.607   6.6312   69.396   6.5883 13.21140 9.347681 
1 1 1    9   12   22 o  177.042   3.2763  622.453   19.787  603.511   22.235  694.559   43.383  170.959   3.1534  183.125   5.7439 -12.16597 6.552569 
1 1 1    9   12   23 o   44.227   5.8091   41.146   9.2414   40.731   10.819   42.264   17.774   44.338   5.9161   44.117   9.9992 0.2207794 11.61829 
1 1 1    9   12   24 o   71.607   5.5684  109.384   16.030   87.457   23.710  127.849   21.757   64.741   8.8793   78.472   6.7222 -13.73099 11.13686 
1 1 1    9   12   25 o  106.967   3.5740  236.022   15.739  220.049   21.530  254.353   23.065  103.094   5.0634  110.841   5.0454 -7.746330 7.148050 
1 1 1    9   12   26 o  127.749   3.4159  337.321   17.969  329.376   24.602  346.404   26.306  126.150   4.7285  129.349   4.9310 -3.199257 6.831784 
1 1 1    9   12   27 o   43.739   6.4475   37.530   14.366  -8.0665   19.952   86.628   20.704   23.000   10.280   64.478   7.7851 -41.47854 12.89492 
1 1 1    9   12   28 o   29.529   8.1129   11.768   14.183   13.967   20.323   9.6807   19.804   30.496   11.631   28.562   11.314 1.934175 16.22590 
1 1 1    9   12   29 o   24.363   7.5091  -5.3930   14.758 -21.1254   23.057   5.5240   19.207   22.067   10.297   26.660   10.932 -4.593040 15.01814 
1 1 1    9   12   30 o   42.671   8.2356   38.469   15.148   53.848   23.046   26.770   20.101   49.361   11.528   35.980   11.764 13.38066 16.47119 
1 1 1    9   12   31 o   32.549   8.7199   16.330   16.623   3.8208   25.656   25.381   21.824   29.439   12.398   35.659   12.265 -6.219778 17.43976 
1 1 1    9   12   32 o  135.253   4.2232  373.315   22.822  350.085   28.526  414.626   38.041  129.693   5.3328  140.814   6.5499 -11.12123 8.446343 
1 1 1    9   12   33 o  121.874   4.2952  306.803   21.282  287.139   27.510  336.112   33.586  117.193   5.6915  126.555   6.4345 -9.361473 8.590411 
1 1 1    9   12   34 o   26.435   7.9014   1.2480   15.271  -9.2741   21.594   11.775   21.599   23.304   10.531   29.567   11.782 -6.263180 15.80277 
1 1 1    9   12   35 o   60.179   6.5198   78.584   16.144   72.941   22.903   84.157   22.760   57.910   9.5889   62.448   8.8365 -4.537983 13.03953 
1 1 1    9   12   36 o   74.672   5.4340  119.543   16.721  113.885   23.629  125.217   23.665   72.834   7.8659   76.509   7.4995 -3.675087 10.86807 
1 1 1    9   12   37 o   47.096   8.6180   54.122   17.222   40.436   25.617   65.409   23.263   41.204   13.266   52.989   11.004 -11.78523 17.23605 
1 1 1    9   12   38 o   66.058   6.2284   96.259   16.814   81.486   23.608  111.465   23.952   60.587   9.4475   71.529   8.1188 -10.94109 12.45676 
1 1 1    9   12   39 o   32.616   8.6216   21.873   15.625   20.001   22.815   23.526   21.444   32.079   12.302   33.152   12.082 -1.072865 17.24323 
1 1 1    9   12   40 f   61.508   10.238   91.269   25.206   67.163   31.584  133.551   41.831   50.804   14.409   72.212   14.548 -21.40738 20.47570 
1 1 1    9   12   41 o   40.274   6.9411   31.446   16.472 -19.1707   23.615   79.404   22.986   21.555   10.172   58.993   9.4473 -37.43775 13.88227 
1 1 1    9   12   42 o   54.807   7.8110   73.787   17.028   76.963   24.809   70.958   23.414   55.859   11.159   53.755   10.933 2.104416 15.62195 
1 1 1    9   12   43 f   28.123   8.2563   12.778   15.788   15.471   22.177   10.010   22.481   28.949   11.795   27.297   11.556 1.652788 16.51256 
1 1 1    9   12   44 o   28.498   8.7417   10.680   18.972   3.9178   25.392   19.225   28.544   26.136   11.645   30.859   13.041 -4.723167 17.48346 
1 1 1    9   12   45 f   22.912   7.5618 -10.3743   17.715  -3.9255   24.590 -17.3323   25.543   23.941   10.980   21.883   10.401 2.057894 15.12367 
1 1 1    9   12   46 o   29.662   9.4004   13.635   24.953 -20.5109   45.606   28.225   29.811   27.071   13.127   32.252   13.459 -5.181337 18.80073 
1 1 1    9   12   47 o   27.903   9.6096 -17.8970   35.641   6.5262   50.901 -41.3889   49.921   30.165   14.432   25.641   12.692 4.523815 19.21916 
1 1 1    9   12   48 o   29.477   9.2816   10.973   24.617 -26.7570   33.482   55.366   36.318   22.196   10.869   36.758   15.049 -14.56293 18.56314 
1 1 1    9   13    0 o  666.513   5.3826  9173.70  209.195  9173.70  209.195  9173.70  209.195  666.513   7.6121  666.513   7.6121 0.000000 0.000000 
1 1 1    9   13    1 o  261.957   2.5450  1417.31   27.244  1427.58   36.229  1403.95   41.331  263.058   3.3392  260.855   3.8416 2.202087 5.090006 
1 1 1    9   13    2 f  336.950   2.9477  2343.23   40.544  2346.19   53.650  2339.28   61.910  337.212   3.8574  336.687   4.4583 0.5257263 5.895423 
1 1 1    9   13    3 o  368.095   3.1407  2796.50   47.259  2793.26   71.753  2798.99   62.806  367.890   4.7289  368.301   4.1346 -0.4107361 6.281499 
1 1 1    9   13    4 o  333.880   2.9391  2299.13   40.041  2308.46   61.330  2292.20   52.862  334.455   4.4460  333.305   3.8453 1.149963 5.878250 
1 1 1    9   13    5 o  279.150   2.5257  1616.76   28.513  1560.33   44.558  1655.89   37.104  274.987   3.9287  283.312   3.1753 -8.324036 5.051461 
1 1 1    9   13    6 o  490.994   3.8900  4982.99   78.254  4929.01  117.289  5026.29  105.054  488.560   5.8207  493.428   5.1621 -4.868652 7.779943 
1 1 1    9   13    7 o  357.894   3.0933  2648.30   45.517  2578.70   66.568  2709.42   62.377  353.457   4.5663  362.332   4.1740 -8.875000 6.186519 
1 1 1    9   13    8 o   96.325   2.6071  193.620   9.9818  262.827   14.506  131.372   13.757  112.868   3.1160   79.783   4.1807 33.08513 5.214182 
1 1 1    9   13    9 o  313.510   3.0690  2026.94   39.663  2084.65   57.254  1973.69   54.998  317.795   4.3681  309.225   4.3122 8.569672 6.138029 
1 1 1    9   13   10 o  307.707   2.6926  1962.68   33.430  1911.34   52.728  1997.19   43.228  304.302   4.2012  311.111   3.3689 -6.809082 5.385126 
1 1 1    9   13   11 o  268.111   2.5275  1492.30   27.460  1433.93   42.588  1533.83   35.924  263.578   3.9176  272.645   3.1947 -9.066528 5.055036 
1 1 1    9   13   12 f  128.717   2.2198  341.811   11.782  353.112   16.780  330.823   16.546  130.816   3.1100  126.619   3.1684 4.197250 4.439679 
1 1 1    9   13   13 o  232.333   2.8661  1110.20   27.409  1048.81   37.354  1181.81   40.343  225.403   4.0180  239.263   4.0881 -13.86058 5.732112 
1 1 1    9   13   14 o  398.417   3.8409  3280.56   59.649  3281.38   73.245  3278.95  102.781  398.623   4.4550  398.210   6.2580 0.4127808 7.681763 
1 1 1    9   13   15 o   67.936   5.3944   93.163   14.620   86.614   18.206  105.057   24.535   64.691   6.8234   71.182   8.3570 -6.490990 10.78880 
1 1 1    9   13   16 o  257.572   3.1295  1376.73   31.650  1391.38   39.275  1349.58   53.451  259.603   3.6681  255.541   5.0714 4.061676 6.258900 
1 1 1    9   13   17 o  143.631   3.0552  435.280   17.555  470.458   22.808  384.153   27.496  150.939   3.6636  136.322   4.8904 14.61679 6.110481 
1 1 1    9   13   18 o  248.423   3.0549  1275.29   31.296  1246.61   44.128  1304.30   44.391  245.609   4.3562  251.237   4.2840 -5.627487 6.109769 
1 1 1    9   13   19 f  140.119   3.1120  409.237   17.508  421.958   22.526  389.829   27.823  142.929   3.8212  137.309   4.9129 5.620514 6.224062 
1 1 1    9   13   20 o   65.374   4.8100   90.632   11.045   92.577   12.728   84.701   22.226   66.920   4.6115   63.828   8.4426 3.091667 9.619944 
1 1 1    9   13   21 o  173.990   3.0771  625.578   21.396  624.799   27.089  626.869   34.888  173.900   3.7768  174.081   4.8591 -0.1819153 6.154286 
1 1 1    9   13   22 o  205.770   2.8966  877.071   24.526  932.552   34.373  819.530   35.005  212.433   3.9231  199.108   4.2626 13.32564 5.793169 
1 1 1    9   13   23 o   85.003   4.8017  151.454   13.110  152.325   14.562  147.727   30.126   85.837   4.1131   84.169   8.6781 1.667686 9.603491 
1 1 1    9   13   24 o  113.271   3.2975  255.425   14.049  242.104   16.539  289.943   26.623  108.238   3.7048  118.305   5.4562 -10.06747 6.595071 
1 1 1    9   13   25 o  124.198   3.1490  326.874   15.217  344.536   18.935  294.659   25.572  129.124   3.5554  119.273   5.1983 9.850044 6.297903 
1 1 1    9   13   26 o  133.422   3.3504  368.620   18.372  370.169   24.990  366.798   27.103  133.748   4.5302  133.095   4.9374 0.6530762 6.700754 
1 1 1    9   13   27 o   38.361   7.1323   32.402   10.828   33.834   12.876   28.947   20.007   39.557   8.1631   37.165   11.698 2.391571 14.26466 
1 1 1    9   13   28 f  183.781   2.9164  693.258   21.021  681.116   25.874  716.835   36.054  181.524   3.4559  186.038   4.6988 -4.514282 5.832882 
1 1 1    9   13   29 o   86.526   5.6690  158.050   20.027  144.293   29.661  169.575   27.149   82.927   8.6720   90.124   7.3039 -7.196999 11.33804 
1 1 1    9   13   30 o  115.524   3.7333  277.484   17.772  264.649   25.166  290.255   25.102  112.836   5.4075  118.212   5.1485 -5.376183 7.466507 
1 1 1    9   13   31 o  151.935   3.7758  481.415   23.594  456.117   34.063  504.744   32.711  148.029   5.5793  155.841   5.0891 -7.812332 7.551622 
1 1 1    9   13   32 o  102.357   5.8588  221.117   24.689  206.294   33.782  238.111   36.172   98.684   8.3000  106.031   8.2712 -7.346992 11.71760 
1 1 1    9   13   33 o   88.426   4.8432  165.279   17.563  144.862   24.759  185.961   24.919   82.798   7.2502   94.055   6.4236 -11.25674 9.686476 
1 1 1    9   13   34 o   81.415   5.0578  140.483   16.972  134.598   23.495  146.904   24.542   79.635   7.1534   83.196   7.1522 -3.561081 10.11557 
1 1 1    9   13   35 o   83.621   4.8938  148.356   16.872  146.165   24.056  150.478   23.671   82.976   7.0293   84.265   6.8108 -1.289154 9.787650 
1 1 1    9   13   36 o   60.967   6.7129   82.793   16.396   71.386   22.695   95.248   23.714   55.908   10.219   66.027   8.7079 -10.11914 13.42571 
1 1 1    9   13   37 o   41.843   9.3189   42.144   17.963   43.435   24.983   40.761   25.847   42.434   13.026   41.251   13.330 1.182549 18.63787 
1 1 1    9   13   38 o   46.510   8.2406   51.053   16.098   67.209   23.508   36.785   22.090   53.618   10.999   39.402   12.274 14.21621 16.48125 
1 1 1    9   13   39 o   33.861   8.7144   25.333   15.764   25.668   22.597   25.015   22.002   34.049   12.404   33.674   12.244 0.3741074 17.42878 
1 1 1    9   13   40 o   86.038   5.6046  163.537   19.809  165.253   26.961  161.525   29.200   86.804   7.5307   85.272   8.3026 1.531570 11.20918 
1 1 1    9   13   41 o   48.610   8.2902   58.731   16.454   64.113   23.562   53.609   22.987   51.007   11.477   46.213   11.966 4.793324 16.58043 
1 1 1    9   13   42 o   33.083   8.7548   25.486   16.409   17.589   23.436   33.082   22.983   30.157   12.184   36.009   12.575 -5.852083 17.50955 
1 1 1    9   13   43 o   24.996   7.8370  -2.8386   17.539   14.725   21.904 -34.2192   29.278   28.455   11.672   21.536   10.461 6.919064 15.67390 
1 1 1    9   13   44 o   31.253   9.1167   22.128   19.202   15.592   29.431   26.973   25.338   29.922   12.954   32.583   12.832 -2.660862 18.23341 
1 1 1    9   13   45 o   34.582   9.8437   12.266   21.387   79.944   40.516 -13.8780   25.181   47.010   16.673   22.153   10.469 24.85668 19.68737 
1 1 1    9   13   46 o   37.015   10.640   47.415   25.401   40.189   34.432   56.042   37.624   35.093   14.539   38.936   15.540 -3.842762 21.28053 
1 1 1    9   13   47 o   26.966   9.3158 -24.9611   28.207 -51.9754   33.424   41.873   52.574   20.102   10.022   33.831   15.707 -13.72928 18.63159 
1 1 1    9   13   48 o   28.485   8.9465   7.4646   22.096   52.634   34.459 -24.0778   28.796   36.069   14.700   20.901   10.201 15.16832 17.89296 
1 1 1    9   14    0 o  362.494   3.3095  2712.39   69.949  2712.39   69.949  2712.39   69.949  362.494   4.6803  362.494   4.6803 0.000000 0.000000 
1 1 1    9   14    1 o  100.187   2.1262  207.536   8.6783  210.142   11.453  204.024   13.298  100.930   2.7514   99.444   3.2422 1.486305 4.252314 
1 1 1    9   14    2 o   94.131   2.2991  183.033   8.9026  199.486   12.645  166.861   12.536   98.333   3.1178   89.930   3.3799 8.402954 4.598273 
1 1 1    9   14    3 o  328.807   2.9098  2235.46   39.278  2184.09   58.053  2278.82   53.340  325.304   4.3268  332.310   3.8917 -7.005402 5.819536 
1 1 1    9   14    4 o  282.659   2.8371  1629.67   32.744  1780.01   50.782  1522.68   42.838  293.678   4.1925  271.640   3.8236 22.03802 5.674210 
1 1 1    9   14    5 o  415.842   3.2685  3573.68   54.474  3552.54   88.007  3586.82   69.357  414.794   5.1442  416.890   4.0337 -2.095917 6.537067 
1 1 1    9   14    6 o  189.302   2.1812  738.860   16.580  741.438   26.714  737.244   21.146  189.560   3.4169  189.043   2.7121 0.5172882 4.362403 
1 1 1    9   14    7 o  513.044   4.0258  5446.11   84.952  5295.53  123.839  5579.96  116.754  506.299   5.9304  519.789   5.4460 -13.49020 8.051628 
1 1 1    9   14    8 o  195.878   2.4779  791.664   20.016  809.893   28.452  773.803   28.163  198.111   3.4821  193.645   3.5262 4.465897 4.955723 
1 1 1    9   14    9 f  172.935   2.5175  617.140   17.905  616.653   24.415  617.706   26.338  172.866   3.4243  173.004   3.6911 -0.1383514 5.034935 
1 1 1    9   14   10 o  324.544   2.7880  2173.79   36.186  2175.64   58.885  2172.68   45.870  324.617   4.3981  324.471   3.4276 0.1465149 5.575970 
1 1 1    9   14   11 f  242.195   2.5676  1210.00   25.463  1216.23   38.431  1205.12   33.996  242.739   3.8386  241.651   3.4109 1.088394 5.135121 
1 1 1    9   14   12 o  359.225   2.9347  2662.10   43.444  2616.62   60.007  2712.20   62.979  356.009   4.0867  362.440   4.2130 -6.431122 5.869436 
1 1 1    9   14   13 o  141.559   2.8766  413.807   16.482  414.053   21.352  413.445   25.926  141.627   3.6554  141.490   4.4427 0.1370697 5.753187 
1 1 1    9   14   14 o   85.597   2.9209  151.901   9.7976  153.248   12.125  149.367   16.630   86.164   3.4120   85.029   4.7419 1.135033 5.841849 
1 1 1    9   14   15 o   89.172   2.8923  159.528   10.246  147.948   12.676  181.354   17.403   84.651   3.6306   93.693   4.5034 -9.041672 5.784656 
1 1 1    9   14   16 o  126.555   2.7967  330.685   14.537  329.261   19.665  332.402   21.587  126.264   3.7761  126.847   4.1262 -0.5824509 5.593307 
1 1 1    9   14   17 f  172.843   2.6907  617.480   19.077  621.118   25.709  613.022   28.457  173.425   3.5942  172.262   4.0053 1.163406 5.381485 
1 1 1    9   14   18 o  141.274   2.6114  415.658   14.651  425.514   18.503  399.093   23.989  143.568   3.1248  138.980   4.1849 4.587463 5.222850 
1 1 1    9   14   19 o  175.717   2.9726  631.947   20.209  620.792   24.527  655.529   35.662  173.385   3.4298  178.049   4.8562 -4.663773 5.945251 
1 1 1    9   14   20 o   78.312   3.5799  126.165   11.356  123.159   14.653  130.686   17.969   77.173   4.6035   79.450   5.4836 -2.277313 7.159750 
1 1 1    9   14   21 o   32.832   5.3517   25.307   9.1849   44.096   11.435  -8.8509   15.418   46.131   6.0103   19.534   8.8566 26.59632 10.70342 
1 1 1    9   14   22 o  263.134   3.4854  1422.23   36.956  1384.39   47.165  1482.43   59.480  258.724   4.4199  267.543   5.3903 -8.818268 6.970704 
1 1 1    9   14   23 o  102.955   5.9642  193.300   15.637  186.556   16.425  258.552   51.090   94.986   4.1926  110.925   11.167 -15.93930 11.92830 
1 1 1    9   14   24 o  119.245   3.1999  307.233   14.624  334.764   18.145  256.205   24.703  127.287   3.4564  111.203   5.3861 16.08451 6.399748 
1 1 1    9   14   25 o  153.677   3.3562  484.259   20.753  468.814   26.386  509.313   33.605  150.551   4.2493  156.803   5.1962 -6.252289 6.712475 
1 1 1    9   14   26 o  201.248   3.6057  834.552   29.793  793.950   39.924  885.582   44.758  195.782   4.9441  206.714   5.2497 -10.93172 7.211374 
1 1 1    9   14   27 o   80.979   4.1307  135.841   12.863  135.365   15.582  136.858   22.791   80.851   4.6728   81.107   6.8130 -0.2560883 8.261422 
1 1 1    9   14   28 o  136.831   3.6654  388.353   20.671  368.808   29.004  408.527   29.467  133.318   5.2748  140.343   5.0907 -7.025101 7.330734 
1 1 1    9   14   29 o   80.695   4.6096  122.774   14.159  104.691   16.605  170.952   27.103   70.956   5.6739   90.434   7.2665 -19.47777 9.219278 
1 1 1    9   14   30 o  156.110   4.3902  521.364   25.751  541.959   30.994  475.468   46.268  161.600   4.6502  150.621   7.4479 10.97920 8.780415 
1 1 1    9   14   31 o   62.238   6.1866   81.999   15.843   83.095   23.281   81.054   21.622   62.572   9.0210   61.903   8.4686 0.6693230 12.37319 
1 1 1    9   14   32 o   31.459   9.5409   0.8834   19.673   16.326   38.579  -4.5435   22.870   37.572   15.461   25.345   11.184 12.22635 19.08186 
1 1 1    9   14   33 o   49.415   9.2692   49.724   18.704   33.702   22.646   84.110   33.176   38.912   12.467   59.918   13.720 -21.00544 18.53846 
1 1 1    9   14   34 o   27.391   8.0185   6.8852   14.784   6.8395   21.416   6.9269   20.433   27.620   11.457   27.161   11.222 0.4588547 16.03704 
1 1 1    9   14   35 o   42.260   8.5589   41.787   15.808   35.466   22.397   48.063   22.316   39.234   12.380   45.285   11.821 -6.051216 17.11772 
1 1 1    9   14   36 o   38.749   8.6157   34.613   15.761   45.345   22.503   24.277   22.083   43.588   12.092   33.910   12.276 9.678520 17.23144 
1 1 1    9   14   37 o   43.667   8.3069   44.264   17.451   13.908   24.684   74.595   24.674   30.758   12.477   56.575   10.970 -25.81699 16.61377 
1 1 1    9   14   38 o   59.174   7.7326   88.696   17.562   49.914   26.773  117.990   23.269   44.745   13.432   73.603   7.6649 -28.85800 15.46520 
1 1 1    9   14   39 o   49.703   9.0730   63.062   18.269   55.843   31.747   66.636   22.338   46.256   14.755   53.149   10.562 -6.892281 18.14599 
1 1 1    9   14   40 o   56.907   8.0256   80.076   18.069   66.891   27.968   89.522   23.673   50.975   13.199   62.838   9.1341 -11.86269 16.05114 
1 1 1    9   14   41 o   27.769   8.6199   2.0399   18.511  -6.8568   23.435   16.800   30.185   23.649   10.798   31.888   13.439 -8.239079 17.23986 
1 1 1    9   14   42 f   29.104   7.8894   10.177   15.739 -17.5036   22.579   36.342   21.952   20.891   9.8853   37.316   12.298 -16.42519 15.77873 
1 1 1    9   14   43 o   27.775   8.2208   5.7421   17.275 -16.6465   23.755   30.870   25.167   21.327   10.106   34.222   12.969 -12.89529 16.44153 
1 1 1    9   14   44 o   43.016   8.0014   48.798   17.823   88.656   25.154   8.6085   25.258   58.939   10.743   27.092   11.860 31.84737 16.00279 
1 1 1    9   14   45 o   29.124   8.8219   17.530   18.873   16.229   28.336   18.567   25.303   29.080   12.650   29.169   12.300 -0.8835793E-01 17.64378 
1 1 1    9   14   46 o   31.022   9.2431   14.759   21.921   54.883   33.383 -15.6553   29.065   39.222   14.920   22.821   10.915 16.40121 18.48613 
1 1 1    9   14   47 o   31.909   10.122   31.847   25.706   43.386   49.603   27.610   30.058   33.315   15.392   30.503   13.148 2.812099 20.24359 
1 1 1    9   14   48 o   23.487   8.0048 -18.3071   22.843   13.214   34.400 -43.1687   30.551   27.487   12.741   19.486   9.6936 8.000891 16.00968 
1 1 1    9   15    0 o  195.659   2.0931  790.185   23.875  790.185   23.875  790.185   23.875  195.659   2.9601  195.659   2.9601 0.000000 0.000000 
1 1 1    9   15    1 o   83.410   2.2109  144.620   7.4961  150.617   9.9200  136.638   11.445   85.445   2.8149   81.375   3.4100 4.069290 4.421726 
1 1 1    9   15    2 o  174.996   2.2275  633.347   15.995  615.680   23.666  648.203   21.702  172.739   3.3218  177.253   2.9685 -4.513428 4.454903 
1 1 1    9   15    3 o  176.821   2.1232  650.560   15.165  616.307   23.653  674.466   19.760  172.826   3.3183  180.815   2.6497 -7.989014 4.246418 
1 1 1    9   15    4 o  384.029   3.0939  3042.15   47.436  3053.00   77.574  3035.67   59.951  384.528   4.8913  383.529   3.7900 0.9985962 6.187775 
1 1 1    9   15    5 o  106.625   2.2352  230.856   9.7512  269.065   14.934  202.457   12.875  114.194   3.1708   99.056   3.1513 15.13773 4.470378 
1 1 1    9   15    6 o  177.378   2.1609  638.750   15.231  687.340   25.594  612.107   18.952  182.506   3.4001  172.250   2.6676 10.25601 4.321709 
1 1 1    9   15    7 o  189.381   2.2875  742.788   17.773  709.562   26.171  771.227   24.213  185.429   3.4220  193.333   3.0365 -7.903885 4.574996 
1 1 1    9   15    8 o  429.463   3.5304  3799.94   61.661  3865.14   95.906  3753.99   80.505  432.543   5.3759  426.383   4.5778 6.160645 7.060897 
1 1 1    9   15    9 o  161.527   2.5164  538.505   16.684  538.722   22.520  538.241   24.840  161.569   3.3795  161.484   3.7295 0.8488464E-01 5.032895 
1 1 1    9   15   10 o  125.331   2.3193  323.081   11.933  334.885   17.890  313.621   16.016  127.383   3.4051  123.280   3.1498 4.103653 4.638559 
1 1 1    9   15   11 o  442.048   3.4591  4024.72   60.746  4081.16  100.793  3992.53   76.125  444.374   5.4994  439.723   4.1974 4.651215 6.918197 
1 1 1    9   15   12 o  210.780   2.4605  917.286   21.218  915.442   32.093  918.717   28.280  210.579   3.6951  210.981   3.2499 -0.4020081 4.920937 
1 1 1    9   15   13 o  401.157   3.7208  3319.79   55.585  3311.05   65.706  3341.77  104.242  400.430   3.9784  401.884   6.2890 -1.453552 7.441690 
1 1 1    9   15   14 o   89.715   2.9530  169.701   10.591  182.656   13.726  150.635   16.652   94.056   3.5382   85.375   4.7289 8.681725 5.906034 
1 1 1    9   15   15 o  122.195   2.6033  311.353   12.603  319.543   15.878  297.408   20.720  124.414   3.0944  119.976   4.1872 4.438416 5.206506 
1 1 1    9   15   16 o  202.139   2.4929  845.216   20.056  849.308   25.277  838.262   32.950  202.837   3.0215  201.441   3.9659 1.395905 4.985753 
1 1 1    9   15   17 o   94.652   3.2031  185.934   12.448  195.876   17.114  174.766   18.138   97.362   4.2618   91.943   4.7830 5.419632 6.406216 
1 1 1    9   15   18 o  241.154   2.6028  1202.20   25.013  1205.04   31.562  1197.42   41.015  241.587   3.1675  240.722   4.1311 0.8651276 5.205665 
1 1 1    9   15   19 o  125.767   3.0766  321.362   15.049  310.645   18.294  343.791   26.465  122.628   3.6171  128.906   4.9777 -6.277481 6.153104 
1 1 1    9   15   20 o  138.542   2.6622  393.853   14.685  386.398   18.412  406.884   24.343  136.786   3.2636  140.299   4.2068 -3.513123 5.324320 
1 1 1    9   15   21 f   36.340   6.2809   26.695   8.7321   23.552   10.396   34.228   16.093   32.994   7.7678   39.685   9.8723 -6.690762 12.56190 
1 1 1    9   15   22 o   52.839   4.8713   57.795   9.8489   57.465   11.874   58.523   17.633   52.668   5.4661   53.010   8.0647 -0.3422318 9.742532 
1 1 1    9   15   23 o  134.854   5.0423  362.055   24.789  345.075   28.643  412.715   49.476  129.057   5.3812  140.650   8.5289 -11.59241 10.08458 
1 1 1    9   15   24 o  199.990   2.9250  825.041   23.956  810.146   31.896  844.315   36.283  197.956   3.9067  202.025   4.3544 -4.069931 5.850043 
1 1 1    9   15   25 o  115.575   3.5783  275.676   17.022  253.900   23.317  300.523   24.907  110.701   5.1068  120.448   5.0136 -9.745979 7.156574 
1 1 1    9   15   26 o   61.560   4.9093   79.366   11.690   80.361   14.297   77.360   20.303   62.244   5.5693   60.875   8.0863 1.368286 9.818571 
1 1 1    9   15   27 f  119.516   3.5315  300.683   16.881  316.809   21.737  276.178   26.796  123.703   4.2604  115.329   5.6333 8.373306 7.062908 
1 1 1    9   15   28 o  106.939   4.3607  235.881   19.082  221.735   25.170  255.002   29.262  103.244   5.9108  110.634   6.4129 -7.389839 8.721393 
1 1 1    9   15   29 o   79.728   5.1061  148.655   14.138  167.561   16.773  102.261   26.274   89.875   4.5248   69.581   9.1552 20.29352 10.21229 
1 1 1    9   15   30 f  144.566   4.9597  446.567   27.727  464.652   34.186  411.803   47.397  149.355   5.5496  139.776   8.2216 9.579788 9.919339 
1 1 1    9   15   31 o   87.068   4.6986  167.322   14.333  175.642   16.649  143.493   28.174   91.914   4.3917   82.223   8.3078 9.691017 9.397201 
1 1 1    9   15   32 o   64.192   7.2490   90.387   18.490   72.317   25.424  110.677   26.939   56.593   11.288   71.790   9.0982 -15.19752 14.49806 
1 1 1    9   15   33 o   67.587   8.9400  106.159   20.951  107.904   24.225  100.979   41.732   70.917   8.2824   64.256   15.846 6.660599 17.88008 
1 1 1    9   15   34 o   43.423   8.5373   44.598   16.059   34.853   24.740   51.694   21.112   39.382   13.060   47.464   11.000 -8.082214 17.07470 
1 1 1    9   15   35 o   61.270   6.9057   85.210   16.750   76.750   25.082   92.020   22.503   57.558   10.966   64.981   8.3963 -7.423378 13.81133 
1 1 1    9   15   36 o   29.596   8.2196   7.6626   16.112 -11.7747   21.928   30.467   23.752   22.486   10.333   36.707   12.786 -14.22170 16.43922 
1 1 1    9   15   37 o   32.371   8.6807   19.446   16.294   10.672   22.863   28.503   23.229   28.987   11.912   35.755   12.631 -6.768227 17.36146 
1 1 1    9   15   38 o   54.167   9.2606   76.318   20.505   86.981   26.257   59.650   32.828   60.703   10.887   47.630   14.983 13.07318 18.52125 
1 1 1    9   15   39 o   47.648   10.092   61.705   21.451   49.277   37.763   67.626   26.065   43.194   15.986   52.103   12.323 -8.908875 20.18393 
1 1 1    9   15   40 o   32.392   8.7649   19.494   16.915   36.019   25.476   6.4656   22.621   37.924   13.240   26.860   11.489 11.06326 17.52972 
1 1 1    9   15   41 o   39.654   10.122   39.643   19.370   34.874   22.553   53.053   37.818   36.784   12.472   42.524   15.946 -5.740189 20.24387 
1 1 1    9   15   42 o   17.717   6.0876 -30.6190   14.381 -48.0786   21.004 -15.2132   19.730   15.773   7.8769   19.660   9.2838 -3.886778 12.17514 
1 1 1    9   15   43 o   31.280   8.7558   23.420   16.990   29.261   23.325   16.817   24.798   33.306   12.516   29.255   12.247 4.051710 17.51154 
1 1 1    9   15   44 o   40.572   9.2967   47.832   17.906   57.956   26.398   39.205   24.369   44.290   13.347   36.854   12.945 7.436119 18.59346 
1 1 1    9   15   45 o   34.590   10.238   38.179   24.611   41.709   33.098   33.813   36.808   35.619   14.448   33.561   14.508 2.057636 20.47515 
1 1 1    9   15   46 o   26.202   8.5900  -0.0302   21.975   21.100   33.674 -15.7044   29.002   29.876   13.354   22.528   10.809 7.348532 17.18002 
1 1 1    9   15   47 o   24.630   8.3752 -11.4853   25.967 -70.3568   51.112   8.9955   30.147   23.035   11.609   26.225   12.075 -3.190891 16.75046 
1 1 1    9   16    0 o   40.488   2.9409   34.880   6.7773   34.880   6.7773   34.880   6.7773   40.488   4.1591   40.488   4.1591 0.000000 0.000000 
1 1 1    9   16    1 o  313.961   2.8458  2029.23   36.380  2068.51   56.368  2001.19   47.627  316.535   4.3177  311.386   3.7084 5.148834 5.691622 
1 1 1    9   16    2 o  205.842   2.3359  873.029   19.662  884.362   29.909  864.402   26.093  207.008   3.5031  204.676   3.0910 2.332764 4.671797 
1 1 1    9   16    3 o  178.934   2.1334  658.755   15.276  668.354   24.903  652.964   19.343  179.965   3.3551  177.904   2.6361 2.060944 4.266824 
1 1 1    9   16    4 o  267.621   2.4834  1477.14   26.576  1482.04   43.287  1474.18   33.669  267.952   3.9168  267.290   3.0541 0.6619873 4.966772 
1 1 1    9   16    5 o  284.389   2.5767  1663.31   29.216  1692.32   48.102  1646.35   36.777  286.318   4.0733  282.461   3.1568 3.857239 5.153417 
1 1 1    9   16    6 o  261.344   2.4554  1412.76   25.805  1395.25   41.249  1424.01   33.077  259.989   3.8467  262.700   3.0528 -2.711731 4.910880 
1 1 1    9   16    7 f  215.460   2.3731  961.403   21.000  913.053   30.658  1004.14   28.823  210.330   3.5341  220.590   3.1680 -10.25955 4.746128 
1 1 1    9   16    8 o  306.955   2.8089  1938.14   35.007  1984.60   54.840  1906.19   45.479  310.020   4.2888  303.889   3.6285 6.130585 5.617871 
1 1 1    9   16    9 o  407.776   3.6411  3435.39   61.233  3475.17   87.262  3396.80   85.947  410.100   5.1591  405.453   5.1395 4.647217 7.282226 
1 1 1    9   16   10 o  120.821   2.2776  300.028   11.297  313.786   16.955  289.043   15.150  123.298   3.3341  118.344   3.1039 4.953972 4.555282 
1 1 1    9   16   11 o  116.074   2.5080  274.117   11.888  226.396   15.866  335.197   17.950  104.718   3.6736  127.429   3.4153 -22.71152 5.015952 
1 1 1    9   16   12 o  314.161   2.9030  2042.19   37.414  2001.82   55.574  2075.65   50.599  311.289   4.3286  317.033   3.8696 -5.744019 5.806088 
1 1 1    9   16   13 o  109.770   2.7621  254.669   11.598  265.237   14.152  233.058   20.238  113.354   3.0271  106.187   4.6209 7.167381 5.524110 
1 1 1    9   16   14 o   57.841   3.5479   69.803   8.1234   71.478   10.217   66.925   13.394   58.816   4.2118   56.866   5.7107 1.950504 7.095886 
1 1 1    9   16   15 o   77.638   3.0143  123.939   9.3202  122.241   11.705  126.883   15.407   76.934   3.6887   78.342   4.7683 -1.408188 6.028563 
1 1 1    9   16   16 o  128.480   2.5451  341.514   12.980  343.159   16.299  338.661   21.460  128.930   3.0652  128.031   4.0640 0.8985443 5.090282 
1 1 1    9   16   17 o  252.059   2.7674  1313.43   28.532  1318.43   38.025  1306.99   43.163  252.639   3.6493  251.478   4.1614 1.161194 5.534839 
1 1 1    9   16   18 o  140.543   2.7880  406.130   16.061  390.908   21.388  425.815   24.322  137.551   3.7699  143.536   4.1084 -5.984940 5.575954 
1 1 1    9   16   19 o   60.108   5.5322   77.609   12.562   47.415   17.279  111.462   18.296   46.881   9.2646   73.336   6.0488 -26.45507 11.06444 
1 1 1    9   16   20 o  127.291   3.3286  335.432   17.355  333.629   26.078  336.865   23.253  126.959   4.9802  127.623   4.4175 -0.6643372 6.657115 
1 1 1    9   16   21 o  164.264   2.6095  556.972   17.106  555.131   21.600  560.070   28.016  163.943   3.1945  164.585   4.1272 -0.6421356 5.219040 
1 1 1    9   16   22 o   28.199   6.2509   9.8042   8.6507  -0.2398   10.464   31.495   15.377   18.325   7.8252   38.072   9.7500 -19.74715 12.50185 
1 1 1    9   16   23 o  219.024   3.4010  983.384   30.384  932.078   39.692  1055.99   47.220  212.238   4.5344  225.810   5.0701 -13.57246 6.801933 
1 1 1    9   16   24 o  179.204   3.6077  653.659   24.435  636.848   29.030  694.506   45.253  175.480   4.0111  182.928   5.9979 -7.448441 7.215470 
1 1 1    9   16   25 o   31.773   6.9759   19.528   9.4064   16.862   11.169   26.031   17.445   28.377   8.7094   35.170   10.900 -6.792540 13.95185 
1 1 1    9   16   26 o   81.495   3.8847  133.844   12.154  127.377   14.556  148.739   22.090   78.423   4.5001   84.567   6.3334 -6.143570 7.769341 
1 1 1    9   16   27 f   32.001   6.8453   13.997   9.7302   4.5019   11.346   40.398   18.919   21.161   8.5026   42.840   10.730 -21.67925 13.69060 
1 1 1    9   16   28 o   44.090   7.4143   41.052   15.758   6.4182   22.403   74.968   22.169   28.571   11.772   59.609   9.0171 -31.03838 14.82868 
1 1 1    9   16   29 o  121.732   3.4311  308.576   16.584  310.604   20.849  305.082   27.364  122.400   4.1299  121.063   5.4803 1.336815 6.862195 
1 1 1    9   16   30 o   48.944   6.5558   54.696   11.422   57.949   13.445   46.259   21.653   52.597   6.1976   45.291   11.554 7.306160 13.11162 
1 1 1    9   16   31 o   49.877   6.8930   54.213   11.989   53.874   13.769   55.278   24.380   50.589   6.5992   49.165   12.104 1.423748 13.78596 
1 1 1    9   16   32 o   36.092   7.2766   20.111   10.286   11.571   11.599   51.559   22.258   24.822   8.9085   47.362   11.508 -22.54002 14.55316 
1 1 1    9   16   33 o   39.056   9.2203   26.501   11.716   24.577   12.305   45.164   38.324   33.173   8.8356   44.939   16.186 -11.76586 18.44066 
1 1 1    9   16   34 f   18.127   6.0146  -7.2922   9.1911  -2.1826   9.9170 -38.4142   24.475   16.721   7.3725   19.533   9.5053 -2.811796 12.02929 
1 1 1    9   16   35 o   31.284   9.4391   9.9777   20.431   20.710   22.387 -43.5032   49.976   32.503   12.253   30.065   14.362 2.437405 18.87820 
1 1 1    9   16   36 o   73.571   6.6280  115.299   19.706  151.945   31.480   91.687   25.269   82.901   9.2069   64.240   9.5371 18.66103 13.25605 
1 1 1    9   16   37 o   28.537   8.5081   8.3964   16.903   9.3268   26.315   7.7429   22.054   29.624   12.520   27.450   11.524 2.173645 17.01629 
1 1 1    9   16   38 o   69.229   6.6368  108.349   18.847  110.880   25.610  105.359   27.838   70.465   8.8120   67.992   9.9267 2.472740 13.27367 
1 1 1    9   16   39 o   41.518   9.3036   44.120   17.909   40.800   25.285   47.461   25.370   40.070   13.199   42.965   13.116 -2.894871 18.60721 
1 1 1    9   16   40 o   33.004   8.9955   24.562   17.232   25.684   25.904   23.672   23.079   33.593   13.047   32.415   12.387 1.177952 17.99095 
1 1 1    9   16   41 o   43.593   9.2219   53.882   19.012   66.637   24.414   34.228   30.304   50.793   11.868   36.393   14.119 14.39985 18.44382 
1 1 1    9   16   42 o   41.938   8.2377   45.629   16.620   19.249   22.725   75.965   24.369   29.755   12.006   54.120   11.283 -24.36558 16.47546 
1 1 1    9   16   43 o   36.821   9.2154   38.468   17.588   34.504   25.324   42.161   24.445   35.233   13.080   38.410   12.985 -3.176838 18.43089 
1 1 1    9   16   44 o   24.491   7.8567   0.7733   17.352  -6.2014   25.230   7.0337   23.903   23.282   10.833   25.699   11.383 -2.417175 15.71347 
1 1 1    9   16   45 o   26.887   8.8833  -0.1346   24.345 -10.3724   33.169   11.822   35.845   24.849   11.822   28.926   13.262 -4.076881 17.76663 
1 1 1    9   16   46 o   37.969   10.258   58.738   26.432   17.898   47.262   77.327   31.885   29.943   14.207   45.996   14.799 -16.05215 20.51510 
1 1 1    9   16   47 o   30.638   9.8981   28.206   25.156   37.160   55.634   25.905   28.203   31.727   15.155   29.549   12.737 2.178518 19.79616 
1 1 1    9   17    0 o   12.576   5.3252   3.3356   6.9717   3.3356   6.9717   3.3356   6.9717   12.576   7.5310   12.576   7.5310 0.000000 0.000000 
1 1 1    9   17    1 o  217.398   2.5200  975.473   22.596  975.731   31.928  975.214   31.982  217.427   3.5603  217.369   3.5674 0.5805969E-01 5.040041 
1 1 1    9   17    2 o  268.339   2.6105  1486.80   28.679  1481.89   43.222  1490.67   38.334  267.927   3.9113  268.750   3.4583 -0.8230286 5.220964 
1 1 1    9   17    3 o  387.612   3.1150  3099.76   48.191  3113.14   78.879  3091.79   60.873  388.215   4.9263  387.010   3.8136 1.205139 6.229959 
1 1 1    9   17    4 o  102.594   2.2770  218.044   9.5576  184.829   13.421  252.218   13.614   94.632   3.4387  110.556   2.9855 -15.92491 4.553913 
1 1 1    9   17    5 o  212.023   2.2587  931.855   19.344  906.864   30.407  948.845   25.072  209.607   3.5173  214.438   2.8348 -4.830734 4.517416 
1 1 1    9   17    6 f   99.494   2.2760  195.193   9.1020  270.572   14.605  147.323   11.639  114.503   3.0926   84.486   3.3401 30.01687 4.551932 
1 1 1    9   17    7 o  238.919   2.4729  1177.19   24.116  1185.98   36.922  1170.66   31.847  239.679   3.7350  238.158   3.2422 1.520584 4.945893 
1 1 1    9   17    8 o  157.084   2.2506  510.806   14.537  474.720   20.832  545.061   20.297  151.654   3.3304  162.514   3.0281 -10.86032 4.501229 
1 1 1    9   17    9 o  117.817   2.1392  288.864   10.143  275.152   16.018  298.043   13.105  115.452   3.3638  120.182   2.6439 -4.729340 4.278481 
1 1 1    9   17   10 o  225.790   2.8372  1053.38   26.310  1184.37   37.724  929.321   36.713  239.479   3.8193  212.101   4.1967 27.37820 5.674452 
1 1 1    9   17   11 o  176.037   2.6004  629.486   17.999  674.308   30.952  606.585   22.124  180.659   4.1540  171.415   3.1294 9.243515 5.200848 
1 1 1    9   17   12 o  293.820   2.6104  1783.02   31.633  1790.23   44.673  1775.77   44.800  294.417   3.6789  293.223   3.7044 1.194000 5.220790 
1 1 1    9   17   13 o  112.761   2.6929  263.543   11.682  265.185   14.188  260.085   20.586  113.341   3.0350  112.181   4.4493 1.159927 5.385823 
1 1 1    9   17   14 o   59.322   3.4206   74.155   8.0285   78.199   10.182   67.508   13.053   61.525   4.0126   57.119   5.5409 4.405910 6.841208 
1 1 1    9   17   15 o   63.022   4.1283   84.133   10.126   51.380   13.982  120.257   14.684   49.778   6.8102   76.265   4.6682 -26.48699 8.256567 
1 1 1    9   17   16 o  198.352   2.6454  813.328   21.476  816.881   28.686  808.796   32.395  198.868   3.4973  197.836   3.9701 1.032043 5.290826 
1 1 1    9   17   17 o  171.431   2.6556  604.955   18.643  589.359   24.784  625.284   28.295  168.911   3.5575  173.950   3.9438 -5.038651 5.311248 
1 1 1    9   17   18 o  194.939   2.9844  781.248   23.034  770.213   28.694  801.240   38.623  193.081   3.6032  196.797   4.7585 -3.716522 5.968776 
1 1 1    9   17   19 o  210.270   3.1861  914.712   27.270  913.660   42.090  915.473   35.800  210.114   4.8569  210.426   4.1250 -0.3121948 6.372166 
1 1 1    9   17   20 o  306.120   3.0104  1939.73   37.650  1951.56   50.020  1924.26   57.189  307.258   3.9471  304.982   4.5464 2.276001 6.020753 
1 1 1    9   17   21 o  118.877   2.8523  291.954   13.408  291.341   16.726  293.058   22.428  118.747   3.4150  119.008   4.5694 -0.2608490 5.704533 
1 1 1    9   17   22 f  183.810   3.5293  711.006   26.068  643.354   40.667  758.192   33.963  176.170   5.5968  191.450   4.3011 -15.28050 7.058638 
1 1 1    9   17   23 o   33.020   6.3917   25.524   9.1254   31.315   10.867   11.670   16.807   38.187   7.1626   27.854   10.588 10.33292 12.78339 
1 1 1    9   17   24 o  160.025   3.6161  548.102   20.707  567.219   24.164  495.263   40.172  165.653   3.5367  154.397   6.3085 11.25624 7.232229 
1 1 1    9   17   25 o  280.359   3.0804  1623.59   35.279  1600.08   46.619  1655.10   53.968  278.062   4.0650  282.655   4.6293 -4.593567 6.160706 
1 1 1    9   17   26 o   59.011   6.0044   91.082   11.505  116.486   14.117   40.832   19.854   74.967   4.5655   43.055   11.107 31.91225 12.00871 
1 1 1    9   17   27 o   94.104   3.6177  177.566   13.082  167.240   15.648  201.527   23.837   89.829   4.2236   98.379   5.8748 -8.550140 7.235464 
1 1 1    9   17   28 o   63.372   5.0471   86.349   12.009   89.880   14.457   78.492   21.567   65.732   5.3325   61.011   8.5707 4.721039 10.09418 
1 1 1    9   17   29 o   68.039   5.8464   98.759   16.246   84.044   23.131  113.085   22.823   62.852   8.9227   73.225   7.5569 -10.37309 11.69283 
1 1 1    9   17   30 o   64.715   7.2867   98.546   17.618   59.683   26.348  129.979   23.696   51.007   12.598   78.423   7.3258 -27.41642 14.57348 
1 1 1    9   17   31 o  157.458   4.1658  515.705   26.787  423.512   36.098  628.687   39.961  141.814   6.1715  173.103   5.5971 -31.28851 8.331584 
1 1 1    9   17   32 o   38.752   6.8615   45.183   11.931   55.451   12.719 -30.0501   34.427   51.310   6.0101   26.195   12.337 25.11486 13.72304 
1 1 1    9   17   33 o   96.858   4.1121  202.694   15.538  213.686   19.417  183.123   25.909  101.005   4.6610   92.710   6.7758 8.294823 8.224139 
1 1 1    9   17   34 o   81.466   6.7794  137.623   21.337  121.454   25.456  175.820   39.125   74.681   8.2643   88.251   10.749 -13.56976 13.55886 
1 1 1    9   17   35 o  105.353   4.4291  236.461   19.146  206.189   26.612  268.946   27.567   98.194   6.5710  112.513   5.9406 -14.31908 8.858219 
1 1 1    9   17   36 o   72.531   4.9510  117.042   13.211  122.148   15.742  104.885   24.292   76.068   5.0176   68.994   8.5366 7.073608 9.902001 
1 1 1    9   17   37 o   43.885   8.7325   47.544   16.540   42.369   23.247   52.850   23.537   41.435   12.534   46.335   12.162 -4.900272 17.46508 
1 1 1    9   17   38 o   28.188   8.6330  -2.4617   18.631   24.550   30.416 -18.6841   23.571   34.739   13.934   21.636   10.196 13.10313 17.26603 
1 1 1    9   17   39 o   71.500   6.3042  115.901   18.211  118.847   28.834  113.946   23.488   71.579   9.7670   71.422   7.9735 0.1571045 12.60835 
1 1 1    9   17   40 o   22.812   7.4729 -13.1592   17.411 -41.3381   29.601   1.7464   21.529   20.991   10.266   24.634   10.862 -3.642502 14.94578 
1 1 1    9   17   41 o   26.483   8.3208   1.2979   18.023   15.065   28.231  -8.1741   23.417   30.064   12.846   22.902   10.579 7.162245 16.64160 
1 1 1    9   17   42 o   27.935   8.0386   6.4613   17.004 -23.7557   24.490   34.586   23.627   20.441   9.8397   35.430   12.714 -14.98948 16.07716 
1 1 1    9   17   43 o   29.670   8.4652   17.742   16.839   33.852   24.146   2.4873   23.496   34.618   12.788   24.723   11.095 9.894835 16.93045 
1 1 1    9   17   44 o   27.615   8.7780   10.405   20.834   7.3029   31.988   12.690   27.457   27.537   12.590   27.694   12.236 -0.1564865 17.55598 
1 1 1    9   17   45 o   29.634   9.3973   18.987   23.787   8.0595   32.162   32.183   35.343   27.085   12.471   32.182   14.061 -5.097330 18.79461 
1 1 1    9   17   46 o   31.848   9.4353   31.659   24.604 -15.9448   41.989   56.550   30.363   25.164   12.290   38.533   14.319 -13.36854 18.87052 
1 1 1    9   18    0 f   68.837   2.4339   98.497   9.7168   98.497   9.7168   98.497   9.7168   68.837   3.4421   68.837   3.4421 0.000000 0.000000 
1 1 1    9   18    1 o  200.367   2.3184  829.580   19.045  819.803   28.449  837.520   25.636  199.286   3.4612  201.448   3.0855 -2.161819 4.636851 
1 1 1    9   18    2 o  117.846   2.1888  287.134   10.602  279.789   15.539  293.532   14.502  116.430   3.2359  119.263   2.9482 -2.833839 4.377542 
1 1 1    9   18    3 f  198.946   2.2042  814.572   17.571  826.480   28.550  807.312   22.293  200.095   3.4594  197.797   2.7326 2.297623 4.408478 
1 1 1    9   18    4 o   85.274   2.2550  154.123   7.6744  131.123   11.938  170.323   10.019   79.695   3.6319   90.853   2.6737 -11.15784 4.509921 
1 1 1    9   18    5 o  109.020   2.1081  247.839   9.2537  232.822   14.533  258.080   12.001  106.203   3.3178  111.836   2.6018 -5.632988 4.216274 
1 1 1    9   18    6 o  122.543   2.1757  311.515   10.919  294.477   16.166  325.810   14.808  119.438   3.2816  125.647   2.8574 -6.208672 4.351329 
1 1 1    9   18    7 o  298.904   2.7519  1848.91   33.858  1754.02   48.552  1938.73   47.241  291.406   4.0396  306.402   3.7382 -14.99533 5.503864 
1 1 1    9   18    8 o  243.602   2.5235  1224.99   25.186  1229.22   37.893  1221.64   33.710  243.960   3.7659  243.244   3.3601 0.7156067 5.047041 
1 1 1    9   18    9 o  156.995   2.1948  499.504   13.906  552.709   22.532  466.767   17.674  163.612   3.3390  150.379   2.8496 13.23225 4.389668 
1 1 1    9   18   10 o   67.551   2.5075   95.641   6.7436   88.548   10.861  100.090   8.6027   65.469   4.0223   69.633   2.9954 -4.163788 5.015089 
1 1 1    9   18   11 o  357.800   3.7470  2644.49   54.420  2668.81   85.021  2627.61   70.831  359.097   5.7405  356.503   4.8172 2.593658 7.493946 
1 1 1    9   18   12 o  242.284   3.0971  1198.52   29.686  1163.21   36.819  1264.10   50.184  237.313   3.7617  247.254   4.9211 -9.941101 6.194149 
1 1 1    9   18   13 o  147.092   2.5825  442.592   15.491  420.116   20.226  474.484   24.093  142.632   3.4382  151.553   3.8545 -8.921494 5.165048 
1 1 1    9   18   14 o  153.607   2.3994  482.836   14.593  471.779   18.145  503.088   24.557  151.170   2.9102  156.044   3.8156 -4.874573 4.798765 
1 1 1    9   18   15 o  274.878   2.8456  1556.67   31.831  1532.58   41.596  1590.70   49.444  272.365   3.7029  277.391   4.3217 -5.026154 5.691101 
1 1 1    9   18   16 o  176.335   2.4662  645.098   17.261  652.832   21.714  631.823   28.449  177.817   2.9608  174.852   3.9448 2.965240 4.932338 
1 1 1    9   18   17 o  231.701   2.5670  1115.60   23.783  1135.96   30.290  1082.86   38.405  234.531   3.1313  228.870   4.0685 5.661118 5.134036 
1 1 1    9   18   18 o  144.369   3.0857  422.603   17.746  400.277   22.113  462.992   29.742  139.164   3.8526  149.574   4.8211 -10.41081 6.171357 
1 1 1    9   18   19 o  204.004   2.7443  861.621   22.992  875.751   31.252  844.950   33.946  205.854   3.6809  202.154   4.0714 3.700439 5.488617 
1 1 1    9   18   20 o  133.439   2.6784  366.067   14.185  360.867   17.728  375.321   23.650  132.169   3.2521  134.708   4.2566 -2.538055 5.356761 
1 1 1    9   18   21 o  100.634   3.2756  213.446   13.288  232.528   17.555  187.841   20.335  106.043   4.0137   95.225   5.1777 10.81830 6.551242 
1 1 1    9   18   22 o  235.479   3.0251  1139.79   26.743  1129.29   31.739  1165.50   49.659  233.780   3.2917  237.178   5.0764 -3.398270 6.050210 
1 1 1    9   18   23 o   58.453   4.7259   74.881   10.580   83.641   13.247   59.456   17.580   63.532   5.0556   53.374   7.9860 10.15872 9.451768 
1 1 1    9   18   24 o  130.172   2.9707  351.603   15.306  353.765   19.157  347.788   25.452  130.797   3.5510  129.547   4.7635 1.250092 5.941429 
1 1 1    9   18   25 o  179.655   3.7767  676.721   25.930  687.928   31.409  652.735   45.951  182.254   4.1784  177.055   6.2925 5.199738 7.553435 
1 1 1    9   18   26 o  106.675   3.8011  236.579   16.724  235.587   23.593  237.581   23.710  106.451   5.3737  106.900   5.3775 -0.4490814 7.602243 
1 1 1    9   18   27 f   81.851   4.2261  131.399   12.729  122.298   14.728  158.268   25.306   76.756   4.6522   86.946   7.0567 -10.19017 8.452223 
1 1 1    9   18   28 o   28.099   6.3729   16.542   9.8634   26.529   11.530 -10.7069   19.045   34.740   8.1821   21.458   9.7729 13.28160 12.74586 
1 1 1    9   18   29 o  143.312   4.3023  420.167   23.319  405.005   27.674  457.301   43.308  139.407   4.8130  147.218   7.1325 -7.811066 8.604520 
1 1 1    9   18   30 o   57.416   6.4426   83.213   12.945  106.607   16.311   43.404   21.278   71.306   5.5462   43.526   11.631 27.77948 12.88524 
1 1 1    9   18   31 f  124.000   4.0875  325.180   20.773  289.621   29.771  358.920   29.000  117.193   6.1593  130.807   5.3753 -13.61373 8.174980 
1 1 1    9   18   32 o   41.967   8.6108   41.236   15.756   39.117   23.721   42.908   21.076   41.015   12.710   42.919   11.621 -1.904041 17.22150 
1 1 1    9   18   33 o   27.191   7.3191   10.117   9.7253   6.8392   10.982   22.034   20.939   21.667   8.4731   32.715   11.937 -11.04763 14.63826 
1 1 1    9   18   34 f   24.708   7.8454   1.1753   9.6861   0.9343   10.122   3.7927   33.356   18.159   7.7241   31.256   13.658 -13.09663 15.69070 
1 1 1    9   18   35 o   30.123   7.5919   18.587   10.482   19.279   11.709   15.799   23.513   29.332   8.9007   30.914   12.301 -1.581562 15.18381 
1 1 1    9   18   36 o   37.584   7.1911   34.745   10.654   37.191   12.196   26.868   21.887   40.738   7.5360   34.430   12.250 6.308548 14.38225 
1 1 1    9   18   37 o   44.237   7.0857   51.567   11.633   57.826   13.398   32.392   23.451   51.806   6.2704   36.669   12.709 15.13746 14.17141 
1 1 1    9   18   38 f   35.289   9.0792   27.081   17.838   12.713   24.256   44.006   26.325   29.358   12.186   41.220   13.462 -11.86164 18.15834 
1 1 1    9   18   39 o   32.735   7.7534   18.729   10.871   11.453   12.288   44.928   23.318   24.174   9.0847   41.295   12.567 -17.12135 15.50686 
1 1 1    9   18   40 o   50.889   6.9333   67.198   12.091   72.279   14.009   52.360   23.939   57.616   5.8951   44.162   12.551 13.45398 13.86662 
1 1 1    9   18   41 o   67.153   6.6494  107.911   18.354  119.799   27.230   98.014   24.847   70.570   9.3556   63.737   9.4516 6.832077 13.29885 
1 1 1    9   18   42 o   28.779   9.3896   2.9278   20.828  -2.1387   23.286   23.198   46.577   23.744   10.811   33.815   15.355 -10.07087 18.77926 
1 1 1    9   18   43 o   32.681   9.0381   30.419   17.791   33.714   23.739   26.197   26.871   33.976   12.655   31.386   12.908 2.589733 18.07612 
1 1 1    9   18   44 o   34.017   9.7822   36.899   21.439   36.776   33.097   36.987   28.141   33.837   14.156   34.196   13.505 -0.3583031 19.56441 
1 1 1    9   18   45 f   21.396   7.3447 -19.5123   19.751 -22.7570   32.363 -17.5864   24.933   22.320   10.876   20.472   9.8733 1.847216 14.68940 
1 1 1    9   19    0 o  105.992   2.0950  232.321   12.929  232.321   12.929  232.321   12.929  105.992   2.9627  105.992   2.9627 0.000000 0.000000 
1 1 1    9   19    1 o  203.647   2.3302  855.335   19.415  863.030   29.441  849.414   25.826  204.443   3.4915  202.851   3.0869 1.591217 4.660406 
1 1 1    9   19    2 o  286.346   2.6973  1692.57   31.571  1700.28   48.012  1686.69   41.905  286.892   4.0576  285.800   3.5550 1.091919 5.394620 
1 1 1    9   19    3 o  196.781   2.2676  803.055   18.307  754.963   26.796  845.155   25.071  191.217   3.3976  202.344   3.0041 -11.12701 4.535254 
1 1 1    9   19    4 o  293.626   2.5892  1792.80   30.868  1706.40   47.427  1856.29   40.659  287.405   4.0010  299.847   3.2877 -12.44220 5.178490 
1 1 1    9   19    5 o  266.958   2.7518  1450.46   29.926  1606.71   46.937  1343.44   38.845  278.871   4.0808  255.044   3.6928 23.82727 5.503630 
1 1 1    9   19    6 o   76.576   2.3476  117.002   7.2787  153.276   11.486   92.660   9.4092   86.163   3.2321   66.989   3.4055 19.17407 4.695102 
1 1 1    9   19    7 o  140.338   2.0829  408.240   11.763  398.629   18.711  414.521   15.126  138.952   3.2648  141.725   2.5876 -2.773315 4.165897 
1 1 1    9   19    8 o  331.460   2.9484  2270.96   40.006  2261.91   60.315  2278.06   53.457  330.832   4.4203  332.089   3.9029 -1.256958 5.896776 
1 1 1    9   19    9 o  361.484   2.9654  2712.01   43.318  2637.82   67.984  2762.72   56.205  357.231   4.6142  365.738   3.7260 -8.507172 5.930708 
1 1 1    9   19   10 o  148.190   2.1481  453.616   12.803  452.117   20.502  454.573   16.392  147.973   3.3594  148.408   2.6780 -0.4358215 4.296175 
1 1 1    9   19   11 o  171.204   2.7792  603.635   19.496  622.140   29.492  589.271   25.983  173.512   4.1210  168.897   3.7300 4.614166 5.558374 
1 1 1    9   19   12 o  224.712   2.8912  1025.80   24.771  998.164   29.622  1090.07   45.176  219.853   3.2667  229.571   4.7712 -9.718292 5.782358 
1 1 1    9   19   13 f  109.813   3.3038  232.106   12.047  221.271   13.359  279.258   27.870  103.518   3.1290  116.109   5.8198 -12.59153 6.607598 
1 1 1    9   19   14 o   36.236   4.9598   29.114   7.0196   33.856   9.1035   22.160   11.025   40.437   5.4584   32.036   8.2826 8.400383 9.919505 
1 1 1    9   19   15 f  110.311   2.6260  251.497   11.499  251.636   14.424  251.254   19.045  110.383   3.1683  110.239   4.1886 0.1440964 5.251947 
1 1 1    9   19   16 o  166.711   2.4568  571.594   16.239  564.910   20.278  583.543   27.114  165.399   2.9726  168.023   3.9125 -2.623672 4.913644 
1 1 1    9   19   17 f  182.894   2.7875  700.452   19.216  714.152   23.039  669.134   34.834  185.963   3.0038  179.826   4.6966 6.136765 5.575072 
1 1 1    9   19   18 o  173.495   3.1316  624.672   22.181  608.178   33.624  637.379   29.513  171.419   4.7558  175.570   4.0756 -4.151657 6.263255 
1 1 1    9   19   19 o  338.150   3.0279  2357.67   40.691  2337.41   51.016  2393.09   67.463  336.293   3.6781  340.007   4.8107 -3.714325 6.055701 
1 1 1    9   19   20 o   64.048   4.0239   90.710   9.8520  105.018   12.493   67.182   16.021   71.250   4.2514   56.847   6.8331 14.40267 8.047718 
1 1 1    9   19   21 o  122.050   3.2253  308.808   16.202  331.613   22.903  285.965   22.922  126.585   4.3867  117.516   4.7292 9.068565 6.450512 
1 1 1    9   19   22 o  143.906   3.0293  425.327   16.617  420.149   19.936  437.113   30.078  142.577   3.3902  145.235   5.0212 -2.657410 6.058556 
1 1 1    9   19   23 o   81.353   3.5539  132.272   11.582  117.899   14.450  158.089   19.367   75.431   4.6447   87.275   5.3803 -11.84422 7.107774 
1 1 1    9   19   24 o   29.023   6.3227   18.730   8.9650   25.450   10.609   1.9421   16.768   34.216   7.7029   23.830   10.029 10.38606 12.64546 
1 1 1    9   19   25 o  100.431   4.7269  202.148   14.731  197.901   16.105  223.896   36.443   97.739   3.9951  103.122   8.5683 -5.383003 9.453896 
1 1 1    9   19   26 o   80.991   6.0922  134.406   18.495  129.101   21.798  148.045   34.950   78.574   6.7262   83.408   10.160 -4.833679 12.18434 
1 1 1    9   19   27 o   46.543   6.6752   59.540   12.060   78.464   14.488   16.855   21.760   61.286   5.7318   31.799   12.057 29.48744 13.35044 
1 1 1    9   19   28 o   82.830   3.9611  140.699   12.704  135.600   15.376  151.667   22.552   80.698   4.6198   84.961   6.4357 -4.263519 7.922154 
1 1 1    9   19   29 o   54.319   7.3995   71.784   15.808   35.806   23.797  100.200   21.148   39.959   12.778   68.679   7.4660 -28.72017 14.79905 
1 1 1    9   19   30 o   18.218   6.0481 -10.4946   9.8901  -7.7653   11.275 -19.6018   20.596   16.099   7.4021   20.336   9.5669 -4.237135 12.09620 
1 1 1    9   19   31 o   51.966   5.9351   58.503   11.282   57.660   13.438   60.515   20.766   52.213   6.2402   51.719   10.097 0.4941368 11.87011 
1 1 1    9   19   32 o   23.712   6.8376   6.8932   9.6121   8.0467   11.100   3.4341   19.221   22.382   8.5816   25.041   10.647 -2.658937 13.67510 
1 1 1    9   19   33 o   35.193   7.1111   20.661   9.9089   12.406   11.269   48.804   20.806   24.919   8.7979   45.467   11.175 -20.54800 14.22228 
1 1 1    9   19   34 o   26.132   6.8921   13.230   9.7913   17.978   10.821  -8.2103   22.996   28.401   8.5427   23.863   10.818 4.538368 13.78426 
1 1 1    9   19   35 o   56.916   6.7209   94.565   12.550  119.883   15.016   35.890   22.859   75.342   4.8321   38.489   12.543 36.85359 13.44186 
1 1 1    9   19   36 o   33.192   7.3326   26.100   10.394   27.774   11.820   20.394   21.827   34.757   8.3500   31.628   12.056 3.128731 14.66521 
1 1 1    9   19   37 o   48.567   6.9970   58.497   12.306   62.806   14.515   47.487   23.202   53.813   6.5399   43.320   12.372 10.49281 13.99394 
1 1 1    9   19   38 o   32.310   8.6103   23.185   15.961   31.620   22.621   14.822   22.525   35.524   12.472   29.095   11.874 6.429108 17.22068 
1 1 1    9   19   39 o   37.579   7.0392   38.241   11.287   44.042   12.943   19.821   23.064   44.516   7.0493   30.641   12.187 13.87442 14.07848 
1 1 1    9   19   40 o   25.645   7.3529   6.9440   10.277   1.7437   11.573   26.342   22.352   18.972   8.1684   32.319   12.229 -13.34689 14.70588 
1 1 1    9   19   41 o   23.025   7.2308  -2.1102   10.411  -6.5755   11.441   19.397   25.109   15.975   7.3848   30.074   12.434 -14.09937 14.46163 
1 1 1    9   19   42 o   29.841   8.2986   21.603   12.017   23.427   12.484  -1.4036   44.335   30.477   9.1776   29.205   13.829 1.272167 16.59718 
1 1 1    9   19   43 o   22.522   6.7640   5.9999   11.646   14.375   13.148 -24.5076   25.093   24.973   9.3947   20.070   9.7337 4.902946 13.52791 
1 1 1    9   19   44 o   31.421   8.3050   28.548   13.470   29.226   14.969   25.664   30.881   32.564   10.097   30.279   13.188 2.285454 16.60999 
1 1 1    9   19   45 o   29.817   9.3452   26.266   22.772   28.351   33.504   24.475   31.047   30.274   13.439   29.360   12.990 0.9139881 18.69046 
1 1 1    9   20    0 o  121.164   2.2737  303.559   16.043  303.559   16.043  303.559   16.043  121.164   3.2155  121.164   3.2155 0.000000 0.000000 
1 1 1    9   20    1 o  196.898   2.3165  798.520   18.671  815.674   28.324  785.339   24.828  198.750   3.4553  195.045   3.0864 3.705261 4.632989 
1 1 1    9   20    2 o   67.949   2.5254   96.091   7.0208   84.527   10.121  106.816   9.7473   63.971   3.8360   71.927   3.2857 -7.956703 5.050819 
1 1 1    9   20    3 o  120.311   2.1952  299.499   10.867  284.277   15.638  313.716   15.113  117.342   3.2312  123.280   2.9723 -5.936974 4.390383 
1 1 1    9   20    4 o   82.257   2.1501  137.933   7.1222  147.534   11.546  132.036   9.0489   84.531   3.3117   79.983   2.7430 4.547974 4.300168 
1 1 1    9   20    5 o  210.114   2.3379  913.049   20.118  898.216   30.168  924.930   26.999  208.559   3.5071  211.669   3.0926 -3.110504 4.675879 
1 1 1    9   20    6 o  155.933   2.1005  507.211   13.232  473.581   20.536  531.089   17.304  151.449   3.2876  160.417   2.6153 -8.967621 4.200936 
1 1 1    9   20    7 o  379.853   3.4483  2915.08   52.803  2682.70   66.838  3300.94   86.126  360.254   4.4983  399.452   5.2276 -39.19724 6.896544 
1 1 1    9   20    8 o  321.073   2.9103  2129.97   38.257  2133.31   57.726  2127.35   51.087  321.257   4.3567  320.888   3.8600 0.3682861 5.820699 
1 1 1    9   20    9 f  170.045   2.1646  601.102   14.864  576.151   23.285  618.260   19.309  167.024   3.3801  173.066   2.7051 -6.041992 4.329289 
1 1 1    9   20   10 o  175.589   2.4733  637.070   16.536  636.245   29.789  637.438   19.880  175.452   4.1166  175.726   2.7429 -0.2735596 4.946693 
1 1 1    9   20   11 o   80.076   2.4306  131.944   8.0014  147.906   11.680  117.827   10.984   84.626   3.3462   75.526   3.5260 9.099663 4.861108 
1 1 1    9   20   12 o  202.203   2.3939  843.940   19.814  840.042   26.418  848.953   29.957  201.689   3.1758  202.717   3.5829 -1.028488 4.787764 
1 1 1    9   20   13 o   84.941   2.8820  149.855   9.7801  152.054   12.427  146.276   15.852   85.790   3.5121   84.092   4.5706 1.698479 5.764095 
1 1 1    9   20   14 o   47.794   3.9937   48.638   7.5487   52.740   9.6620   42.212   12.094   50.489   4.6398   45.099   6.5016 5.389889 7.987436 
1 1 1    9   20   15 o  110.138   2.6489  253.127   11.620  260.547   14.758  241.023   18.848  112.315   3.1859  107.961   4.2329 4.354172 5.297849 
1 1 1    9   20   16 o  132.289   2.5033  363.164   13.169  367.555   16.610  355.730   21.610  133.407   3.0187  131.172   3.9943 2.235046 5.006693 
1 1 1    9   20   17 o   99.192   3.0515  201.475   11.621  198.014   14.010  209.112   20.808   97.893   3.4699  100.491   5.0205 -2.598114 6.102915 
1 1 1    9   20   18 o   37.600   6.6182   29.748   10.002   35.593   16.328   26.238   12.654   40.422   9.8774   34.778   8.8113 5.644787 13.23636 
1 1 1    9   20   19 o  123.620   3.0666  314.631   15.592  295.315   21.107  337.828   23.131  119.470   4.2836  127.770   4.3893 -8.299683 6.133133 
1 1 1    9   20   20 o  247.093   2.7206  1260.42   26.680  1254.74   33.421  1270.41   44.301  246.418   3.2884  247.768   4.3351 -1.350357 5.441181 
1 1 1    9   20   21 o  103.964   3.2780  217.854   13.593  201.851   16.912  247.051   22.844   98.761   4.1519  109.166   5.0736 -10.40536 6.555950 
1 1 1    9   20   22 o   86.046   3.6641  157.641   12.561  172.740   16.307  135.615   19.696   91.325   4.3294   80.768   5.9127 10.55734 7.328247 
1 1 1    9   20   23 o   67.891   6.0211   87.350   12.396   83.234   13.405  111.630   32.558   63.315   5.1334   72.467   10.893 -9.152935 12.04214 
1 1 1    9   20   24 o  103.352   4.4268  220.295   18.023  231.171   30.705  214.578   22.261  105.114   7.0824  101.590   5.3128 3.523102 8.853590 
1 1 1    9   20   25 o   42.156   6.3663   38.361   10.281   38.507   12.458   38.049   18.202   42.874   7.0454   41.439   10.606 1.434856 12.73262 
1 1 1    9   20   26 o   99.852   6.5257  142.297   20.486  111.124   21.978  348.847   56.574   72.616   7.3382  127.088   10.793 -54.47146 13.05139 
1 1 1    9   20   27 o   19.995   5.9670   0.3287   8.8413   7.4550   10.386 -18.4324   16.851   21.906   8.3242   18.083   8.5516 3.822557 11.93408 
1 1 1    9   20   28 o   79.049   3.8537  121.086   11.836  103.796   14.150  161.356   21.595   70.492   4.8669   87.607   5.9765 -17.11553 7.707470 
1 1 1    9   20   29 o   31.280   7.1074   17.139   10.177   9.5943   12.271   33.762   18.214   24.027   9.0681   38.532   10.947 -14.50576 14.21478 
1 1 1    9   20   30 o   69.266   5.6853  102.993   16.018   82.064   22.044  126.408   23.316   61.585   8.6784   76.947   7.3468 -15.36214 11.37059 
1 1 1    9   20   31 f   27.779   7.0288   15.328   9.5495   15.860   11.206   13.917   18.249   27.105   8.7791   28.453   10.979 -1.348602 14.05758 
1 1 1    9   20   32 o   35.009   7.2231   25.546   10.154   21.731   11.887   35.843   19.531   31.000   8.8562   39.017   11.413 -8.017027 14.44614 
1 1 1    9   20   33 o   63.628   5.1095   88.657   12.205   90.965   14.660   83.443   22.034   65.596   5.4186   61.659   8.6641 3.936710 10.21903 
1 1 1    9   20   34 o   17.637   6.0357 -15.7679   8.6955 -17.5556   9.4806  -6.2952   21.824   11.821   5.7875   23.452   10.594 -11.63120 12.07143 
1 1 1    9   20   35 o   27.445   8.5256  -1.7819   9.6582  -4.4075   10.004   34.255   37.062   15.835   7.1609   39.054   15.475 -23.21864 17.05115 
1 1 1    9   20   36 o   17.224   5.7218  -8.1404   9.0059  -3.3023   10.009 -28.7143   20.640   16.182   7.2531   18.266   8.8514 -2.084299 11.44356 
1 1 1    9   20   37 o   59.116   6.2984   75.784   12.960   70.966   14.862   91.074   26.475   57.116   6.3089   61.116   10.903 -3.999996 12.59674 
1 1 1    9   20   38 o   45.618   7.6716   51.979   15.778   25.037   21.947   80.798   22.699   32.474   12.153   58.762   9.3657 -26.28745 15.34328 
1 1 1    9   20   39 o   66.329   5.3329  101.814   12.703  104.626   14.920   94.402   24.221   69.606   5.1971   63.052   9.3139 6.553608 10.66575 
1 1 1    9   20   40 o   28.235   7.5632   16.738   10.592   14.984   12.015   22.851   22.436   25.625   9.0805   30.846   12.098 -5.220463 15.12646 
1 1 1    9   20   41 o   27.907   7.7529   15.125   10.744   12.682   11.905   25.843   24.935   24.117   8.9658   31.697   12.651 -7.580610 15.50572 
1 1 1    9   20   42 o   30.426   7.9115   22.586   11.377   20.628   12.784   30.045   24.952   28.473   9.3850   32.379   12.739 -3.906151 15.82296 
1 1 1    9   20   43 o   23.511   7.1786   8.8237   11.855   13.388   12.886 -16.3265   30.246   24.187   9.2528   22.835   10.978 1.352160 14.35713 
1 1 1    9   20   44 o   28.392   8.0463   21.115   12.507   20.897   13.722   22.185   30.407   27.841   9.7172   28.943   12.828 -1.101807 16.09258 
1 1 1    9   21    0 o  276.735   2.4858  1581.26   40.109  1581.26   40.109  1581.26   40.109  276.735   3.5154  276.735   3.5154 0.000000 0.000000 
1 1 1    9   21    1 o   53.348   2.7986   59.016   6.1298   56.110   8.9715   61.561   8.3950   52.106   4.1746   54.590   3.7286 -2.483849 5.597247 
1 1 1    9   21    2 o   84.302   2.3140  146.524   8.0297  150.243   11.792  143.309   10.965   85.295   3.3519   83.309   3.1911 1.986145 4.627992 
1 1 1    9   21    3 o  129.707   2.0786  346.327   11.104  325.133   15.248  370.256   16.202  125.494   2.9459  133.920   2.9332 -8.426041 4.157177 
1 1 1    9   21    4 o  136.068   2.4916  386.508   13.834  428.096   18.974  339.312   20.213  143.985   3.1951  128.152   3.8242 15.83363 4.983243 
1 1 1    9   21    5 o  181.497   2.2384  680.441   16.603  678.534   25.226  681.898   22.053  181.257   3.3743  181.738   2.9420 -0.4812469 4.476783 
1 1 1    9   21    6 o  167.553   2.1244  585.036   14.374  551.435   22.404  608.543   18.739  163.404   3.3243  171.703   2.6461 -8.298676 4.248847 
1 1 1    9   21    7 o  323.921   3.1106  2160.94   41.400  2079.38   55.756  2261.17   61.807  317.160   4.2623  330.682   4.5317 -13.52179 6.221226 
1 1 1    9   21    8 o   51.097   3.1971   61.013   5.9059   35.882   9.7148   75.745   7.4382   41.624   5.6588   60.569   2.9775 -18.94529 6.394293 
1 1 1    9   21    9 o  122.592   2.2369  297.445   11.062  379.103   18.067  248.479   13.991  135.487   3.2332  109.696   3.0923 25.79113 4.473891 
1 1 1    9   21   10 f   64.287   2.9800   90.998   6.9507   73.384   12.772   98.409   8.2850   59.536   5.2014   69.037   2.9097 -9.501091 5.959946 
1 1 1    9   21   11 o  317.575   2.9093  2080.11   37.608  2054.71   49.215  2115.75   58.304  315.313   3.7844  319.838   4.4198 -4.524963 5.818590 
1 1 1    9   21   12 o  168.415   2.2092  585.847   15.343  598.136   21.702  573.568   21.694  170.184   3.0919  166.647   3.1563 3.536743 4.418384 
1 1 1    9   21   13 o   51.848   3.2948   56.879   6.8798   44.705   10.024   67.720   9.4596   46.461   5.2310   57.234   4.0073 -10.77245 6.589535 
1 1 1    9   21   14 o   52.326   6.5807   62.647   9.4523   64.356   10.209   52.391   25.012   55.776   4.4380   48.876   12.391 6.899227 13.16141 
1 1 1    9   21   15 o   57.208   3.5961   68.446   8.2375   70.755   10.561   64.859   13.163   58.483   4.3783   55.933   5.7060 2.550442 7.192228 
1 1 1    9   21   16 o   67.911   3.3420   97.230   8.9803  102.334   11.384   88.821   14.612   70.353   3.9233   65.468   5.4114 4.885086 6.683951 
1 1 1    9   21   17 f  237.425   3.5325  1160.90   33.544  1140.65   42.358  1194.97   54.933  234.786   4.3742  240.064   5.5481 -5.278061 7.065070 
1 1 1    9   21   18 o   70.711   3.5007  104.832   9.8888  109.023   12.656   98.263   15.845   72.590   4.2273   68.831   5.5813 3.759064 7.001492 
1 1 1    9   21   19 o  203.654   3.3845  858.681   26.201  858.013   31.452  860.195   47.360  203.700   3.7436  203.609   5.6396 0.9074402E-01 6.769008 
1 1 1    9   21   20 o   71.077   3.9045  106.673   11.248  120.656   15.291   90.181   16.605   76.294   4.8593   65.860   6.1130 10.43324 7.809052 
1 1 1    9   21   21 o   59.547   4.3759   74.383   10.416   76.288   13.292   71.351   16.767   60.615   5.3166   58.480   6.9517 2.135178 8.751713 
1 1 1    9   21   22 o   42.789   7.9928   37.835   13.157   46.951   25.216   34.425   15.423   45.983   12.816   39.595   9.5540 6.388062 15.98563 
1 1 1    9   21   23 o  180.199   3.0345  670.973   22.473  647.568   30.326  699.484   33.471  176.754   4.1599  183.643   4.4190 -6.888840 6.068945 
1 1 1    9   21   24 o   21.997   6.1491  -2.1376   8.5520 -10.8745   10.313   17.099   15.302   14.400   6.7727   29.594   10.265 -15.19415 12.29825 
1 1 1    9   21   25 o   78.729   3.6873  126.586   11.570  119.378   14.421  139.607   19.382   75.745   4.6161   81.712   5.7512 -5.966553 7.374581 
1 1 1    9   21   26 o   44.484   8.1913   59.051   12.265   64.619   12.656 -27.0151   49.757   55.575   5.5213   33.393   15.424 22.18225 16.38253 
1 1 1    9   21   27 o   46.998   5.4580   40.873   9.5946   30.337   11.251   68.966   18.372   37.131   7.6024   56.864   7.8333 -19.73214 10.91591 
1 1 1    9   21   28 o   69.502   4.2578  103.818   11.338  107.723   13.858   95.911   19.719   71.809   4.6789   67.195   7.1151 4.614510 8.515629 
1 1 1    9   21   29 o   89.836   3.8324  166.024   13.807  154.883   17.350  185.262   22.800   85.977   4.8928   93.696   5.9000 -7.719414 7.664794 
1 1 1    9   21   30 o   31.196   7.7656   14.823   13.546   36.770   21.012  -0.7851   17.720   39.535   11.907   22.857   9.9721 16.67747 15.53113 
1 1 1    9   21   31 o   68.416   4.4364   98.326   11.642   95.907   14.021  103.697   20.893   67.473   5.0382   69.359   7.3036 -1.885704 8.872725 
1 1 1    9   21   32 o   51.921   5.8291   59.556   10.918   59.548   12.945   59.578   20.324   52.947   5.9278   50.895   10.039 2.051514 11.65827 
1 1 1    9   21   33 o   31.644   7.1039   22.758   9.7650   23.505   11.354   20.635   19.137   32.037   8.4657   31.252   11.410 0.7852230 14.20779 
1 1 1    9   21   34 o   20.016   6.1928  -0.0603   9.3640   5.7428   10.489 -22.8371   20.781   20.612   8.2118   19.420   9.2721 1.192019 12.38569 
1 1 1    9   21   35 o   92.573   6.0532  192.919   20.850  194.315   24.828  189.580   38.403   94.818   6.3488   90.327   10.308 4.490585 12.10643 
1 1 1    9   21   36 o   27.521   6.3956   17.338   10.402   28.015   11.805 -19.7493   22.000   34.643   8.3579   20.399   9.6829 14.24415 12.79116 
1 1 1    9   21   37 o   36.013   7.0199   35.004   11.037   40.438   12.438   14.883   23.936   42.698   7.0629   29.328   12.134 13.36945 14.03987 
1 1 1    9   21   38 o   37.596   7.4180   36.198   11.055   37.254   12.630   32.740   22.858   39.893   7.9550   35.299   12.523 4.593674 14.83590 
1 1 1    9   21   39 o   24.523   6.3560   11.750   10.285   22.148   11.627 -25.6412   22.049   30.112   8.8051   18.934   9.1686 11.17864 12.71194 
1 1 1    9   21   40 o   86.273   4.5240  156.852   14.397  145.794   16.726  188.471   28.283   82.074   4.9411   90.472   7.5796 -8.398048 9.047945 
1 1 1    9   21   41 o   51.453   7.0176   66.040   12.619   64.313   14.568   71.231   25.255   53.155   6.6449   49.750   12.363 3.405586 14.03530 
1 1 1    9   21   42 o   46.002   7.5021   61.590   12.930   66.053   14.878   47.813   26.138   53.607   6.7291   38.397   13.411 15.21023 15.00419 
1 1 1    9   21   43 o   13.176   6.4734 -20.0790   12.186 -20.0790   12.186   0.0000   0.0000   13.176   6.4734  ?   ?       ?      ? 
1 1 1    9   22    0 f  360.646   2.8885  2686.27   60.744  2686.27   60.744  2686.27   60.744  360.646   4.0849  360.646   4.0849 0.000000 0.000000 
1 1 1    9   22    1 o  211.858   2.3656  927.688   20.545  920.567   30.735  933.441   27.624  211.105   3.5300  212.612   3.1502 -1.507019 4.731244 
1 1 1    9   22    2 o  293.623   2.5551  1780.88   30.941  1795.22   44.089  1766.96   43.432  294.786   3.6263  292.461   3.6006 2.325623 5.110205 
1 1 1    9   22    3 o   79.596   2.2699  130.804   7.4510  128.175   10.449  133.524   10.628   78.782   3.2158   80.410   3.2045 -1.627342 4.539830 
1 1 1    9   22    4 o  103.488   2.2691  222.466   9.6079  233.489   12.998  209.189   14.265  106.341   2.9636  100.634   3.4369 5.706879 4.538156 
1 1 1    9   22    5 o  124.742   2.2302  318.359   11.328  303.702   14.742  339.493   17.703  121.280   2.9472  128.204   3.3479 -6.924599 4.460305 
1 1 1    9   22    6 f  211.732   2.2691  911.743   18.997  974.876   32.250  878.193   23.509  217.219   3.5997  206.246   2.7637 10.97263 4.538248 
1 1 1    9   22    7 o  170.404   2.3764  598.499   16.682  571.729   22.931  628.595   24.314  166.367   3.3419  174.441   3.3795 -8.074341 4.752810 
1 1 1    9   22    8 o   28.952   4.1849   22.116   4.7713   6.0569   8.3942   29.781   5.7992   19.941   7.5057   37.962   3.7039 -18.02079 8.369855 
1 1 1    9   22    9 o   78.614   2.7731  138.020   8.0235  103.221   14.053  154.850   9.7730   70.624   4.8245   86.605   2.7360 -15.98096 5.546294 
1 1 1    9   22   10 o  114.061   2.3956  266.325   10.316  274.818   19.017  262.784   12.279  115.298   3.9990  112.823   2.6388 2.474434 4.791226 
1 1 1    9   22   11 o   36.098   4.3571   26.235   6.2115   35.727   10.003   20.276   7.9246   41.511   5.8424   30.685   6.4656 10.82542 8.714178 
1 1 1    9   22   12 o  131.625   2.2338  356.700   12.107  331.998   16.611  384.691   17.682  126.778   3.1767  136.471   3.1414 -9.692909 4.467649 
1 1 1    9   22   13 o   25.369   4.9592   14.117   5.7979   5.7024   8.9814   20.129   7.5917   20.138   7.7199   30.599   6.2273 -10.46019 9.918455 
1 1 1    9   22   14 o  211.725   2.2647  925.101   19.643  918.084   26.246  934.034   29.615  210.834   3.0183  212.616   3.3771 -1.782410 4.529393 
1 1 1    9   22   15 o  118.128   3.6940  298.227   14.179  304.204   15.862  274.466   31.629  121.346   3.1693  114.910   6.6736 6.435776 7.387973 
1 1 1    9   22   16 o  107.760   2.9760  228.563   12.211  211.687   14.453  270.653   22.825  101.205   3.4626  114.315   4.8411 -13.11028 5.951985 
1 1 1    9   22   17 o  208.677   3.7121  910.662   31.574  1062.37   44.437  755.977   44.871  226.482   4.7572  190.872   5.6997 35.60997 7.424140 
1 1 1    9   22   18 o  165.273   2.6992  560.028   18.004  541.799   23.015  588.773   28.901  161.885   3.4470  168.660   4.1546 -6.775925 5.398393 
1 1 1    9   22   19 o  133.873   3.0401  371.217   16.785  367.297   23.779  375.110   23.696  133.164   4.3295  134.581   4.2690 -1.417038 6.080260 
1 1 1    9   22   20 o   73.638   4.9397  106.635   14.016  131.944   25.785   96.020   16.699   79.352   7.8785   67.924   5.9608 11.42850 9.879347 
1 1 1    9   22   21 o  112.388   3.1163  267.190   13.717  280.071   17.158  244.377   22.833  116.324   3.5763  108.452   5.1046 7.871483 6.232697 
1 1 1    9   22   22 o   70.774   3.8845  109.439   10.737  126.920   13.917   83.741   16.875   78.228   4.3135   63.320   6.4614 14.90820 7.768963 
1 1 1    9   22   23 o   27.774   6.6263   15.156   8.7341   14.112   10.915   17.014   14.563   26.305   8.6722   29.243   10.021 -2.938072 13.25265 
1 1 1    9   22   24 o   63.031   4.1379   82.119   10.480   78.768   13.275   87.666   17.077   61.437   5.2388   64.625   6.4067 -3.188808 8.275858 
1 1 1    9   22   25 o   29.934   6.1430   21.308   8.8179   28.784   10.420   2.4483   16.549   36.294   7.2153   23.574   9.9441 12.71947 12.28599 
1 1 1    9   22   26 o   84.372   3.7018  150.499   12.284  153.934   15.335  144.348   20.519   85.935   4.3266   82.808   6.0079 3.127213 7.403678 
1 1 1    9   22   27 o   85.075   5.8397  170.709   14.347  178.332   15.731  133.010   34.984   92.529   4.1221   77.620   10.928 14.90875 11.67935 
1 1 1    9   22   28 o   88.729   3.5819  163.517   12.527  159.385   15.491  171.326   21.295   87.346   4.3001   90.111   5.7297 -2.764626 7.163824 
1 1 1    9   22   29 o   20.300   6.2788  -0.7018   8.6356  -1.5120   9.9068   1.8618   17.621   16.962   7.4266   23.638   10.126 -6.676880 12.55757 
1 1 1    9   22   30 o   55.483   6.3181   67.578   14.414   70.579   21.389   65.082   19.510   56.511   9.1767   54.455   8.6867 2.055710 12.63611 
1 1 1    9   22   31 o   53.211   5.1050   54.455   10.442   44.062   12.329   80.829   19.640   45.387   6.5859   61.034   7.8018 -15.64665 10.20991 
1 1 1    9   22   32 o   66.397   5.5965   96.711   15.319   96.064   21.952   97.325   21.387   66.112   8.0505   66.683   7.7764 -0.5703812 11.19301 
1 1 1    9   22   33 o   57.256   5.4915   66.665   11.365   61.410   13.020   83.483   23.291   53.595   5.8899   60.916   9.2702 -7.321209 10.98306 
1 1 1    9   22   34 o   63.222   5.1034   89.465   12.142   92.815   14.676   82.196   21.616   65.955   5.3950   60.489   8.6645 5.466217 10.20683 
1 1 1    9   22   35 o   44.109   6.4862   59.567   11.446   76.007   13.313   12.975   22.411   59.565   5.4188   28.654   11.786 30.91106 12.97241 
1 1 1    9   22   36 o   48.129   8.8679   73.368   14.191   77.077   14.680   20.496   55.429   59.556   5.9764   36.701   16.699 22.85557 17.73584 
1 1 1    9   22   37 o   62.794   5.3466   92.828   12.265   98.916   14.712   78.952   22.210   67.720   5.2672   57.867   9.3059 9.853214 10.69314 
1 1 1    9   22   38 o   37.982   6.9137   39.919   11.035   45.610   12.785   23.290   21.854   45.033   6.8833   30.931   11.992 14.10185 13.82740 
1 1 1    9   22   39 o   35.350   7.9640   31.323   15.081   8.2868   21.302   54.472   21.354   25.637   11.060   45.064   11.462 -19.42741 15.92796 
1 1 1    9   22   40 o   48.211   6.8896   56.522   11.966   53.543   13.919   64.961   23.426   48.312   6.9854   48.111   11.877 0.2011642 13.77914 
1 1 1    9   22   41 o   42.713   7.5029   52.331   12.741   56.025   14.791   41.706   25.085   48.980   7.3216   36.445   13.098 12.53456 15.00584 
1 1 1    9   22   42 o   41.528   8.6223   51.304   14.545   48.900   16.680   58.934   29.716   42.830   9.6709   40.227   14.278 2.603519 17.24463 
1 1 1    9   22   43 o   20.648   8.8228   5.8598   13.316   5.8598   13.316   0.0000   0.0000   20.648   8.8228  ?   ?       ?      ? 
1 1 1    9   23    0 o   75.917   2.3755  119.651   10.472  119.651   10.472  119.651   10.472   75.917   3.3595   75.917   3.3595 0.000000 0.000000 
1 1 1    9   23    1 o  162.800   2.2213  548.287   14.851  537.059   21.924  557.806   20.187  161.245   3.2966  164.355   2.9780 -3.109726 4.442519 
1 1 1    9   23    2 o  160.708   2.1133  532.175   13.992  507.981   19.247  559.291   20.376  156.843   2.9753  164.572   3.0019 -7.728668 4.226600 
1 1 1    9   23    3 f  147.821   2.0782  451.019   12.665  469.024   18.098  433.737   17.731  150.713   2.9115  144.929   2.9663 5.783936 4.156365 
1 1 1    9   23    4 o   78.572   2.4613  127.810   7.9309  130.180   10.717  124.940   11.792   79.388   3.2730   77.757   3.6769 1.630722 4.922642 
1 1 1    9   23    5 o  295.997   2.5766  1809.49   31.434  1785.54   43.529  1835.58   45.441  293.961   3.5903  298.033   3.6967 -4.072662 5.153215 
1 1 1    9   23    6 o  169.848   2.1436  594.581   14.989  577.521   20.470  614.299   22.008  167.232   2.9678  172.465   3.0940 -5.232574 4.287269 
1 1 1    9   23    7 o  157.627   2.2414  514.550   14.523  493.386   21.159  533.398   19.968  154.542   3.3196  160.712   3.0125 -6.169022 4.482759 
1 1 1    9   23    8 o  126.284   2.1133  326.821   10.696  339.884   17.466  318.983   13.529  128.268   3.3015  124.300   2.6390 3.967270 4.226587 
1 1 1    9   23    9 f   57.906   2.9212   68.151   6.2698   72.058   11.990   66.680   7.3555   58.995   4.9277   56.818   3.1388 2.177490 5.842494 
1 1 1    9   23   10 o  171.288   2.6420  577.650   17.966  508.432   22.084  713.116   30.895  156.868   3.4133  185.709   4.0335 -28.84131 5.283972 
1 1 1    9   23   11 o  165.846   2.6909  573.020   17.392  582.458   21.443  554.871   29.734  167.926   3.0960  163.767   4.4022 4.158676 5.381842 
1 1 1    9   23   12 o  123.990   2.2525  317.588   11.518  322.128   16.332  313.095   16.247  124.872   3.1711  123.107   3.1998 1.765099 4.504940 
1 1 1    9   23   13 o   70.480   2.9205  101.252   8.3232  110.166   13.368   95.608   10.636   72.959   4.4423   68.001   3.7924 4.958542 5.840973 
1 1 1    9   23   14 o   55.178   3.2787   62.778   7.3694   64.649   11.425   61.445   9.6436   55.863   4.9588   54.492   4.2908 1.370888 6.557463 
1 1 1    9   23   15 o  204.090   2.8536  860.408   24.002  896.022   34.777  828.012   33.168  208.115   4.0516  200.066   4.0196 8.049103 5.707251 
1 1 1    9   23   16 o  121.587   5.4708  318.131   18.685  321.763   20.150  295.845   49.917  124.707   3.9176  118.467   10.216 6.240433 10.94155 
1 1 1    9   23   17 o  125.752   2.7881  328.932   14.107  335.018   18.153  319.654   22.414  127.281   3.4579  124.224   4.3747 3.056488 5.576294 
1 1 1    9   23   18 o  145.116   2.6816  433.044   15.409  425.970   19.191  445.880   25.852  143.530   3.2419  146.702   4.2726 -3.172134 5.363259 
1 1 1    9   23   19 o   76.230   3.5016  122.468   10.843  138.221   14.812  104.278   15.916   81.647   4.3985   70.814   5.4494 10.83279 7.003113 
1 1 1    9   23   20 o   93.068   3.7750  179.898   14.437  159.546   20.018  201.957   20.841   87.559   5.5431   98.576   5.1260 -11.01717 7.549902 
1 1 1    9   23   21 o  124.057   2.8793  318.272   14.221  315.733   17.877  322.647   23.467  123.475   3.5103  124.639   4.5650 -1.164154 5.758623 
1 1 1    9   23   22 o   78.251   3.4669  129.409   10.824  135.709   13.868  119.588   17.314   80.832   4.1596   75.670   5.5476 5.162277 6.933859 
1 1 1    9   23   23 o  142.765   3.1519  421.876   18.507  393.068   25.060  456.434   27.448  137.444   4.4207  148.087   4.4939 -10.64284 6.303813 
1 1 1    9   23   24 o   86.738   4.3517  159.118   15.144  154.412   24.205  162.145   19.412   85.469   6.8665   88.007   5.3480 -2.537094 8.703431 
1 1 1    9   23   25 o   85.077   4.8340  158.191   16.354  116.274   23.875  195.245   22.447   73.757   7.8483   96.398   5.6459 -22.64063 9.668037 
1 1 1    9   23   26 o   68.614   3.9603   96.616   10.836   90.419   13.504  107.821   18.160   65.729   4.9814   71.500   6.1580 -5.770699 7.920541 
1 1 1    9   23   27 o   66.785   6.1848   83.453   11.990   78.335   12.829  118.800   33.717   61.042   5.0956   72.527   11.271 -11.48552 12.36962 
1 1 1    9   23   28 o   36.646   6.3683   32.665   9.7866   39.394   11.979   19.157   16.971   42.910   6.7685   30.383   10.789 12.52744 12.73663 
1 1 1    9   23   29 o   66.059   4.4466   87.167   11.152   78.905   13.138  108.476   21.098   61.151   5.2089   70.968   7.2080 -9.816799 8.893133 
1 1 1    9   23   30 o   51.860   5.3128   49.685   10.162   30.977   12.065   95.349   18.850   37.067   8.1169   66.652   6.8570 -29.58562 10.62561 
1 1 1    9   23   31 o   23.884   7.1574  -0.9950   13.465 -20.7348   20.303   14.504   17.991   19.529   9.2793   28.239   10.900 -8.710232 14.31472 
1 1 1    9   23   32 o   36.690   6.3302   36.132   10.143   45.986   11.942   10.615   19.217   46.266   6.2583   27.115   11.005 19.15079 12.66044 
1 1 1    9   23   33 o   44.994   6.7135   43.949   10.948   39.542   12.736   56.418   21.426   41.814   7.6677   48.173   11.022 -6.359772 13.42699 
1 1 1    9   23   34 o   74.463   5.6495  126.254   16.488   83.440   23.063  171.006   23.580   60.270   9.2780   88.657   6.4485 -28.38627 11.29893 
1 1 1    9   23   35 o   51.519   5.8900   57.225   11.082   52.138   12.991   70.817   21.237   48.778   6.4575   54.260   9.8524 -5.481785 11.78003 
1 1 1    9   23   36 o   41.591   7.1615   60.260   12.930   68.798   13.480 -37.9533   45.720   56.221   5.8135   26.961   13.090 29.26024 14.32296 
1 1 1    9   23   37 o   66.019   4.9486   96.462   12.214   93.968   14.467  102.653   22.794   65.742   5.3355   66.297   8.3360 -0.5549393 9.897266 
1 1 1    9   23   38 o   44.578   6.8645   54.300   11.580   61.304   13.746   37.185   21.489   52.485   6.3502   36.671   12.172 15.81422 13.72891 
1 1 1    9   23   39 o   37.278   8.4341   39.491   15.150   50.876   21.606   28.481   21.248   42.387   11.881   32.169   11.974 10.21806 16.86823 
1 1 1    9   23   40 o   28.569   7.3447   21.437   11.115   24.338   12.833   12.724   22.240   30.687   9.3195   26.451   11.355 4.235987 14.68944 
1 1 1    9   23   41 o   37.701   7.8285   37.995   11.982   33.267   14.084   50.381   22.796   35.309   9.4744   40.094   12.465 -4.785378 15.65699 
1 1 1    9   23   42 o   41.676   7.8012   57.361   14.911   65.670   17.417   34.562   28.852   51.455   8.2069   31.897   13.269 19.55767 15.60230 
1 1 1    9   24    0 o   14.553   5.6116   6.1539   6.7611   6.1539   6.7611   6.1539   6.7611   14.553   7.9360   14.553   7.9360 0.000000 0.000000 
1 1 1    9   24    1 o   69.069   2.5310   98.907   7.1848   93.333   10.412  103.975   9.9272   67.197   3.7567   70.940   3.3929 -3.742447 5.062092 
1 1 1    9   24    2 o   26.123   4.6129   14.782   4.9759   12.819   7.1622   16.613   6.9182   24.491   6.8320   27.756   6.1998 -3.265148 9.225705 
1 1 1    9   24    3 o  154.168   2.0984  490.877   13.341  492.920   18.737  488.777   19.000  154.495   2.9405  153.840   2.9945 0.6545715 4.196862 
1 1 1    9   24    4 o   80.341   2.4485  133.991   8.0542  139.319   10.887  127.549   11.971   82.124   3.2141   78.557   3.6947 3.566933 4.897094 
1 1 1    9   24    5 o  251.236   2.3832  1304.03   24.695  1319.87   35.037  1288.40   34.810  252.753   3.3610  249.719   3.3798 3.033661 4.766500 
1 1 1    9   24    6 o  200.352   2.2168  829.204   18.314  850.779   25.947  807.783   25.855  202.954   3.0997  197.751   3.1700 5.201996 4.433597 
1 1 1    9   24    7 o  139.981   2.5366  405.724   14.617  424.850   20.396  385.530   20.958  143.390   3.4488  136.571   3.7207 6.818710 5.073245 
1 1 1    9   24    8 o  103.279   2.5309  223.423   9.7163  213.543   18.035  227.464   11.533  101.598   4.3040  104.960   2.6641 -3.361786 5.061825 
1 1 1    9   24    9 o  161.050   3.1763  560.102   16.711  498.752   36.701  576.149   18.770  155.063   5.7386  167.037   2.7245 -11.97409 6.352520 
1 1 1    9   24   10 o  101.050   3.8646  224.277   12.668  191.455   27.742  232.924   14.239   95.925   7.0120  106.175   3.2517 -10.25042 7.729253 
1 1 1    9   24   11 o  198.343   2.8642  818.823   23.029  784.673   35.638  843.305   30.174  194.710   4.4378  201.975   3.6222 -7.265717 5.728348 
1 1 1    9   24   12 o  163.426   2.3525  549.807   15.746  534.779   20.940  569.365   23.888  160.883   3.1557  165.969   3.4897 -5.085953 4.704914 
1 1 1    9   24   13 o   88.156   2.5049  161.307   9.0713  148.801   13.051  172.996   12.618   84.825   3.7303   91.487   3.3439 -6.661942 5.009717 
1 1 1    9   24   14 o  161.560   2.2943  539.066   15.278  527.517   21.148  551.672   22.095  159.756   3.2096  163.365   3.2793 -3.608536 4.588589 
1 1 1    9   24   15 o   77.973   3.1526  128.954   9.6729  137.087   12.220  115.306   15.829   81.404   3.6396   74.541   5.1488 6.863503 6.305258 
1 1 1    9   24   16 o  107.634   2.7932  235.192   12.020  221.961   15.051  258.488   19.971  103.580   3.5230  111.688   4.3354 -8.107132 5.586353 
1 1 1    9   24   17 o  109.285   4.4102  262.747   14.415  269.568   15.808  229.067   35.127  114.150   3.3576  104.419   8.1563 9.731682 8.820333 
1 1 1    9   24   18 o  136.434   2.9615  382.750   16.589  353.811   22.205  419.302   24.956  130.656   4.1206  142.212   4.2547 -11.55569 5.922995 
1 1 1    9   24   19 f   26.937   5.7084   14.606   7.5687   24.014   10.475   4.3283   10.949   33.148   7.7929   20.725   8.3436 12.42293 11.41687 
1 1 1    9   24   20 o  114.239   3.3625  267.301   15.718  231.720   20.812  314.542   23.980  105.523   4.7818  122.955   4.7287 -17.43250 6.725049 
1 1 1    9   24   21 o   45.542   5.9949   44.216   10.709   47.669   17.531   42.160   13.526   46.397   9.4814   44.687   7.3388 1.709465 11.98973 
1 1 1    9   24   22 o   97.131   3.1814  200.423   12.370  215.834   16.079  178.068   19.365  101.933   3.8245   92.330   5.0853 9.602966 6.362900 
1 1 1    9   24   23 o   37.559   5.7331   30.696   8.4279   28.856   10.686   33.724   13.708   36.233   7.4011   38.884   8.7576 -2.651417 11.46611 
1 1 1    9   24   24 o   59.335   4.3511   76.653   10.199   85.047   13.172   64.082   16.119   63.745   5.0098   54.925   7.1155 8.820869 8.702207 
1 1 1    9   24   25 o  109.200   3.2430  248.317   14.475  242.622   19.131  255.942   22.137  107.828   4.3018  110.572   4.8542 -2.743202 6.486047 
1 1 1    9   24   26 o   97.498   3.9720  203.475   15.758  175.088   23.034  228.448   21.604   90.786   6.1515  104.209   5.0266 -13.42239 7.944008 
1 1 1    9   24   27 o  113.664   3.1580  268.927   14.278  263.723   17.887  278.065   23.704  112.394   3.8586  114.934   5.0003 -2.540543 6.316012 
1 1 1    9   24   28 o   40.128   9.8689   20.330   10.951   16.998   11.286   73.969   45.283   27.814   8.7898   52.442   17.673 -24.62822 19.73790 
1 1 1    9   24   29 o   33.400   6.7736   23.412   9.1870   19.587   10.939   32.565   16.923   29.483   8.5177   37.317   10.534 -7.833830 13.54718 
1 1 1    9   24   30 o   52.089   5.0389   54.763   10.109   48.087   12.014   70.947   18.707   47.370   6.1495   56.808   7.9840 -9.438423 10.07776 
1 1 1    9   24   31 o   43.251   7.7910   45.332   13.903   43.292   20.883   46.956   18.633   42.055   11.643   44.447   10.356 -2.391438 15.58196 
1 1 1    9   24   32 o   29.875   6.2201   22.227   9.6108   32.043   11.407  -1.7912   17.843   37.561   7.6235   22.189   9.8307 15.37265 12.44026 
1 1 1    9   24   33 f   31.820   7.2054   23.418   10.085   22.751   11.980   25.041   18.685   31.104   8.8926   32.536   11.340 -1.432108 14.41089 
1 1 1    9   24   34 o   45.594   6.5882   51.010   11.103   53.816   13.255   44.411   20.326   49.537   6.4877   41.650   11.468 7.887215 13.17638 
1 1 1    9   24   35 o   24.634   7.1500   9.0372   10.628   8.1956   12.455   11.291   20.384   22.441   8.9459   26.826   11.156 -4.384953 14.29994 
1 1 1    9   24   36 o   31.923   7.2752   25.300   10.166   25.209   11.787   25.562   20.088   32.133   8.6862   31.713   11.673 0.4199238 14.55038 
1 1 1    9   24   37 o   25.805   6.2368   14.610   10.153   26.204   11.763 -19.2555   20.104   32.749   8.5986   18.861   9.0363 13.88773 12.47365 
1 1 1    9   24   38 o   40.867   6.7955   46.971   10.953   52.979   12.838   30.900   20.996   48.492   6.4190   33.241   11.980 15.25118 13.59096 
1 1 1    9   24   39 o   21.625   6.7378   4.0876   10.524   5.6410   11.994  -1.1085   21.936   20.427   8.5316   22.823   10.431 -2.395391 13.47558 
1 1 1    9   24   40 o   18.396   6.1530  -7.2313   10.150  -8.1335   11.540  -4.1499   21.328   15.259   7.1731   21.532   9.9991 -6.272854 12.30590 
1 1 1    9   24   41 o   32.768   7.5946   32.692   12.164   36.214   14.419   23.995   22.657   36.602   9.4767   28.933   11.870 7.668375 15.18917 
1 1 1    9   25    0 o   96.914   2.4062  194.604   13.564  194.604   13.564  194.604   13.564   96.914   3.4029   96.914   3.4029 0.000000 0.000000 
1 1 1    9   25    1 o  219.548   2.4233  996.399   21.818  993.019   32.616  999.136   29.352  219.186   3.6079  219.910   3.2361 -0.7231750 4.846584 
1 1 1    9   25    2 o   65.344   2.5629   88.262   6.9012   83.420   9.6953   93.235   9.8255   63.524   3.7005   67.164   3.5469 -3.639812 5.125833 
1 1 1    9   25    3 o   74.503   2.9385  117.136   8.8473   95.864   13.004  135.468   12.072   68.050   4.6333   80.955   3.6155 -12.90516 5.876972 
1 1 1    9   25    4 o  148.105   2.8234  454.132   17.211  418.740   24.267  489.947   24.412  142.277   4.1354  153.932   3.8452 -11.65456 5.646872 
1 1 1    9   25    5 o   49.311   3.1851   51.027   6.2529   68.220   9.0231   35.142   8.6731   57.440   3.8087   41.183   5.1062 16.25737 6.370174 
1 1 1    9   25    6 o  195.738   2.7476  797.568   21.068  775.255   35.671  809.520   26.107  193.535   4.4688  197.942   3.1979 -4.407547 5.495135 
1 1 1    9   25    7 o   84.965   3.9547  140.582   12.028  132.151   13.727  168.466   24.963   79.923   4.1642   90.007   6.7244 -10.08423 7.909370 
1 1 1    9   25    8 o  168.530   3.3851  593.582   23.160  622.630   30.632  554.818   35.387  173.459   4.2817  163.600   5.2444 9.858978 6.770251 
1 1 1    9   25    9 o   53.701   4.3581   60.394   9.5447   56.117   14.305   63.827   12.814   51.939   6.6778   55.463   5.6017 -3.524441 8.716137 
1 1 1    9   25   10 o  172.840   2.4555  617.351   17.499  627.304   25.126  607.975   24.386  174.189   3.4973  171.491   3.4477 2.698441 4.911040 
1 1 1    9   25   11 o  123.034   2.6640  314.711   13.056  307.013   21.311  319.336   16.519  121.772   4.2433  124.297   3.2223 -2.524216 5.328062 
1 1 1    9   25   12 o  181.370   2.7064  682.995   19.522  671.916   32.057  689.526   24.612  180.112   4.3153  182.627   3.2675 -2.514511 5.412793 
1 1 1    9   25   13 o  167.686   2.7138  576.102   18.632  536.094   24.613  629.803   28.515  160.957   3.7075  174.416   3.9639 -13.45866 5.427542 
1 1 1    9   25   14 f   77.448   2.7280  125.423   8.6146  105.545   12.337  144.339   12.034   71.371   4.1910   83.524   3.4934 -12.15254 5.456034 
1 1 1    9   25   15 o  103.487   2.7510  216.983   11.508  163.744   15.193  288.647   17.627   88.888   4.1441  118.085   3.6192 -29.19780 5.502049 
1 1 1    9   25   16 o  117.480   2.7496  286.028   13.027  286.496   16.760  285.313   20.704  117.657   3.4538  117.302   4.2793 0.3547592 5.499199 
1 1 1    9   25   17 f   38.569   4.7852   31.758   7.3972   32.872   10.035   30.433   10.947   39.677   6.1320   37.460   7.3478 2.217731 9.570374 
1 1 1    9   25   18 o   60.980   7.3227   80.705   14.762   80.299   16.703   82.155   31.552   61.876   6.5448   60.083   13.102 1.793449 14.64549 
1 1 1    9   25   19 o  118.384   2.9118  290.107   14.049  284.504   18.422  297.896   21.720  117.084   3.8148  119.684   4.4001 -2.599228 5.823534 
1 1 1    9   25   20 o  109.500   3.0320  247.455   12.973  243.257   15.910  255.783   22.409  108.275   3.5626  110.724   4.9071 -2.448586 6.063923 
1 1 1    9   25   21 o  120.947   3.1797  304.306   15.800  268.803   21.813  343.494   22.917  113.493   4.6600  128.400   4.3274 -14.90694 6.359398 
1 1 1    9   25   22 o  127.866   3.1473  338.822   16.538  304.742   22.410  379.582   24.508  120.838   4.4964  134.894   4.4050 -14.05638 6.294557 
1 1 1    9   25   23 o   93.876   3.1879  186.006   11.965  193.016   15.330  175.078   19.140   96.316   3.8590   91.436   5.0753 4.879753 6.375803 
1 1 1    9   25   24 o   43.585   5.0416   39.354   8.8332   35.273   11.097   46.410   14.592   40.710   6.6093   46.461   7.6150 -5.750744 10.08320 
1 1 1    9   25   25 f   77.435   3.6136  123.735   11.414  109.253   14.864  144.546   17.819   72.058   5.0015   82.811   5.2170 -10.75329 7.227169 
1 1 1    9   25   26 o   24.233   6.2140   11.045   8.3609   15.856   10.419   2.3428   14.012   26.908   8.4372   21.558   9.1250 5.350256 12.42791 
1 1 1    9   25   27 f   37.239   6.1295   32.729   9.3090   38.165   11.722   23.446   15.318   42.213   6.7327   32.264   10.245 9.949329 12.25903 
1 1 1    9   25   28 o   21.862   6.2473   6.2372   8.2508   7.9025   9.7322   1.9815   15.558   21.432   8.0788   22.293   9.5313 -0.8615246 12.49450 
1 1 1    9   25   29 o   87.164   3.6795  168.997   12.376  189.929   15.668  134.268   20.181   95.187   3.9908   79.140   6.1828 16.04688 7.358909 
1 1 1    9   25   30 o   41.970   6.0679   40.031   9.6340   40.152   11.639   39.767   17.169   43.099   6.5476   40.840   10.218 2.258904 12.13586 
1 1 1    9   25   31 o   21.138   6.3250   3.7804   8.5764   4.6375   9.8911   1.1835   17.216   19.558   7.9104   22.719   9.8717 -3.161797 12.65010 
1 1 1    9   25   32 o   55.012   5.2732   61.351   11.037   52.971   12.964   83.418   21.039   49.317   6.3737   60.708   8.4024 -11.39164 10.54632 
1 1 1    9   25   33 o   19.221   6.1351  -3.8447   9.0739  -5.8892   10.583   1.8306   17.632   15.659   7.1893   22.783   9.9435 -7.124450 12.27022 
1 1 1    9   25   34 o   44.381   6.4812   46.151   10.614   45.028   12.529   49.005   19.980   45.051   6.7428   43.711   11.071 1.339993 12.96241 
1 1 1    9   25   35 o   31.848   7.3106   26.324   10.570   28.429   12.042   19.255   22.063   34.199   8.5581   29.497   11.855 4.702627 14.62128 
1 1 1    9   25   36 f   19.441   6.2356  -3.0392   9.1634  -4.9454   10.492   3.0879   18.811   15.694   7.1880   23.188   10.191 -7.494618 12.47116 
1 1 1    9   25   37 o   26.847   8.0625   4.3550   10.465  -0.5438   11.141   41.120   30.520   17.561   7.7747   36.134   14.127 -18.57310 16.12490 
1 1 1    9   25   38 o   30.044   7.3322   21.794   10.115   18.536   11.857   30.503   19.385   27.217   9.0416   32.871   11.545 -5.653978 14.66444 
1 1 1    9   25   39 o   24.087   6.9331  -1.1597   9.8146 -10.9336   11.050   35.359   21.360   14.191   6.7716   33.983   12.100 -19.79243 13.86617 
1 1 1    9   25   40 o   27.475   8.2478   18.303   16.663   8.5643   23.920   27.484   23.225   24.832   11.165   30.117   12.142 -5.284546 16.49566 
1 1 1    9   26    0 o  129.913   2.6973  349.440   20.399  349.440   20.399  349.440   20.399  129.913   3.8146  129.913   3.8146 0.000000 0.000000 
1 1 1    9   26    1 o  221.727   2.8583  1009.40   25.562  1053.03   41.040  981.755   32.673  225.544   4.4118  217.910   3.6354 7.634354 5.716616 
1 1 1    9   26    2 o   29.819   6.5820   19.937   7.2453   21.924   7.6297   1.7002   23.119   31.981   6.0048   27.658   11.715 4.323040 13.16401 
1 1 1    9   26    3 o  113.918   2.7878  279.938   12.005  300.296   14.652  238.346   20.943  120.568   2.9464  107.268   4.7336 13.30031 5.575685 
1 1 1    9   26    4 o   62.029   2.7927   80.699   7.0313   94.983   9.8029   65.563   10.091   67.782   3.5065   56.276   4.3474 11.50536 5.585309 
1 1 1    9   26    5 o  234.818   2.5446  1141.81   24.494  1124.94   36.575  1155.53   32.982  233.206   3.8026  236.430   3.3823 -3.224075 5.089157 
1 1 1    9   26    6 o   57.552   3.6955   68.472   8.7532   65.202   11.911   72.313   12.907   56.068   5.1506   59.036   5.3008 -2.968121 7.390989 
1 1 1    9   26    7 o   86.397   4.0559  155.253   10.730  155.344   11.750  154.794   26.339   86.687   3.2863   86.107   7.4164 0.5793152 8.111868 
1 1 1    9   26    8 o   68.363   3.3887   99.589   9.2532  111.220   12.152   83.538   14.275   73.300   4.0195   63.426   5.4569 9.873974 6.777466 
1 1 1    9   26    9 o   24.995   5.5342   13.011   6.6984   17.845   8.6859   5.9163   10.522   28.686   7.3178   21.303   8.3041 7.382793 11.06837 
1 1 1    9   26   10 o   75.078   3.2294  120.243   9.2929  126.783   11.405  107.324   16.029   78.284   3.5323   71.873   5.4074 6.411140 6.458883 
1 1 1    9   26   11 o   74.570   2.6093  116.039   7.9126   93.383   11.145  139.064   11.236   67.144   4.0245   81.995   3.3223 -14.85052 5.218660 
1 1 1    9   26   12 o  114.152   2.3913  266.947   11.187  292.915   17.037  247.268   14.831  118.974   3.4721  109.331   3.2891 9.643150 4.782599 
1 1 1    9   26   13 o   79.807   2.6042  132.814   8.5084  120.952   12.434  143.259   11.668   76.409   3.9455   83.206   3.4000 -6.797073 5.208316 
1 1 1    9   26   14 o   27.217   5.1998   16.412   5.7789   13.658   10.291   17.681   6.9841   25.852   8.4157   28.582   6.1097 -2.729445 10.39966 
1 1 1    9   26   15 o   90.515   2.7901  170.090   10.287  168.750   15.808  171.074   13.549   90.165   4.2509   90.866   3.6152 -0.7005081 5.580297 
1 1 1    9   26   16 o  111.553   2.7317  260.231   12.338  269.825   16.161  246.824   19.103  114.109   3.4338  108.997   4.2493 5.111893 5.463316 
1 1 1    9   26   17 o   79.380   3.0417  129.936   9.7638  125.771   12.534  136.365   15.572   77.832   3.9043   80.928   4.6653 -3.095688 6.083469 
1 1 1    9   26   18 o   20.328   5.1714   3.5855   6.4935   14.957   9.4365  -6.6420   8.9492   26.390   7.9863   14.265   6.5722 12.12483 10.34290 
1 1 1    9   26   19 o  140.982   5.0475  421.014   17.898  420.971   18.926  421.377   55.044  142.472   3.2208  139.493   9.5673 2.979065 10.09492 
1 1 1    9   26   20 o   98.455   3.3694  203.121   13.629  183.143   19.302  222.986   19.248   93.548   5.0028  103.363   4.5149 -9.815598 6.738835 
1 1 1    9   26   21 o   64.525   3.4766   86.636   9.1266   84.409   11.897   89.820   14.228   63.591   4.5359   65.460   5.2699 -1.868824 6.953105 
1 1 1    9   26   22 o   31.579   6.8945   20.415   9.5196   28.830   16.415   16.151   11.685   35.634   10.474   27.525   8.9681 8.109703 13.78890 
1 1 1    9   26   23 o   80.044   3.3716  135.061   10.885  137.156   14.067  131.936   17.182   80.978   4.2119   79.110   5.2661 1.868301 6.743239 
1 1 1    9   26   24 o   23.658   6.0676   10.617   7.7288   13.473   9.8122   5.9495   12.545   25.152   8.2190   22.163   8.9281 2.988565 12.13521 
1 1 1    9   26   25 o   39.867   5.4736   34.955   8.5083   34.724   10.690   35.355   14.054   40.327   6.4269   39.408   8.8619 0.9196472 10.94710 
1 1 1    9   26   26 o   23.050   6.2025   9.0558   8.0642   10.928   10.021   5.6145   13.585   23.500   8.2964   22.600   9.2225 0.8998337 12.40499 
1 1 1    9   26   27 o   26.234   6.4098   12.662   8.4279   7.2298   10.635   21.834   13.819   21.519   8.3594   30.948   9.7190 -9.429377 12.81952 
1 1 1    9   26   28 o   72.620   3.7454  108.619   10.830   99.967   13.436  124.668   18.298   68.823   4.7334   76.417   5.8057 -7.594093 7.490759 
1 1 1    9   26   29 o   74.437   6.6100  130.369   13.271  132.152   14.376  120.083   34.525   79.163   4.4029   69.711   12.465 9.452034 13.21994 
1 1 1    9   26   30 o   77.911   4.7134  135.719   14.486   93.721   20.705  175.989   20.275   65.069   7.7151   90.753   5.4167 -25.68375 9.426744 
1 1 1    9   26   31 o   36.556   6.5295   29.783   9.1812   26.230   10.900   38.460   17.034   33.566   7.9889   39.546   10.330 -5.980843 13.05891 
1 1 1    9   26   32 o   74.876   5.4481  131.242   15.891   90.594   23.398  166.047   21.651   62.421   9.0883   87.331   6.0111 -24.90931 10.89629 
1 1 1    9   26   33 o   34.386   6.1335   31.926   9.5456   40.942   11.461   11.508   17.247   43.048   6.4550   25.724   10.431 17.32457 12.26695 
1 1 1    9   26   34 o   29.005   7.0100   15.982   9.8492   7.8568   11.800   34.646   17.884   21.743   8.6940   36.267   10.999 -14.52456 14.02007 
1 1 1    9   26   35 o   33.463   7.2289   28.378   10.348   28.159   12.253   28.925   19.325   33.867   8.7200   33.058   11.532 0.8087654 14.45777 
1 1 1    9   26   36 o   62.656   5.2135   93.582   12.381   99.542   15.240   82.015   21.231   67.210   5.4979   58.102   8.8598 9.107746 10.42701 
1 1 1    9   26   37 o   20.497   6.3885   2.8466   9.4279   3.5134   10.848   0.7878   19.062   18.881   8.0124   22.113   9.9526 -3.231220 12.77701 
1 1 1    9   26   38 f   33.433   8.8236   27.800   11.462   26.056   11.928   48.833   41.420   31.713   8.8059   35.153   15.293 -3.440010 17.64719 
1 1 1    9   26   39 o   27.424   7.5639   15.384   10.745   9.4917   12.242   35.147   22.420   21.806   8.8073   33.042   12.300 -11.23588 15.12784 
1 1 1    9   27    0 o   72.404   2.5934  109.113   10.888  109.113   10.888  109.113   10.888   72.404   3.6677   72.404   3.6677 0.000000 0.000000 
1 1 1    9   27    1 o  168.748   2.1458  588.551   14.934  596.128   21.157  581.027   21.083  169.832   3.0205  167.663   3.0488 2.168381 4.291645 
1 1 1    9   27    2 o  164.378   2.1598  558.104   14.634  547.990   20.277  569.098   21.141  162.829   3.0193  165.927   3.0892 -3.097717 4.319643 
1 1 1    9   27    3 o  119.483   2.4752  294.663   12.180  306.871   17.823  283.965   16.684  121.795   3.5480  117.171   3.4523 4.624016 4.950412 
1 1 1    9   27    4 o   94.343   2.9600  169.962   10.421  218.800   20.490  152.921   12.103  102.700   4.8372   85.985   3.4128 16.71445 5.919950 
1 1 1    9   27    5 o   66.516   3.0030   91.787   8.0894   91.034   12.676   92.305   10.507   66.255   4.6386   66.776   3.8151 -0.5214310 6.005986 
1 1 1    9   27    6 f  230.886   4.1611  1133.79   29.035  1145.64   31.777  1073.85   71.451  235.359   3.2735  226.413   7.6514 8.945602 8.322264 
1 1 1    9   27    7 o   63.706   3.5491   91.450   8.4056  105.406   10.421   65.457   14.221   71.369   3.5401   56.044   6.1525 15.32462 7.098286 
1 1 1    9   27    8 o   84.737   3.1601  139.956   10.581  119.897   12.904  181.129   18.487   76.064   4.1132   93.409   4.7987 -17.34527 6.320278 
1 1 1    9   27    9 o   26.764   7.6418   10.088   8.0662   11.200   8.3317  -6.5306   32.209   23.428   7.5680   30.100   13.278 -6.672621 15.28352 
1 1 1    9   27   10 o   92.269   5.5649  184.556   12.546  186.028   13.241  171.634   39.234   94.814   3.3860   89.724   10.602 5.090317 11.12973 
1 1 1    9   27   11 o   65.987   3.3170   90.193   8.5400   89.703   10.485   91.160   14.720   65.795   3.8638   66.178   5.3928 -0.3827133 6.634073 
1 1 1    9   27   12 o  108.291   2.7220  243.680   11.493  244.818   14.136  241.459   19.742  108.761   3.1513  107.822   4.4393 0.9389954 5.444092 
1 1 1    9   27   13 o  139.071   2.4721  399.046   14.148  370.420   19.283  432.424   20.822  133.692   3.4971  144.449   3.4950 -10.75708 4.944121 
1 1 1    9   27   14 o  169.189   2.6470  586.521   18.228  551.444   23.642  637.934   28.623  163.090   3.5147  175.289   3.9591 -12.19904 5.294096 
1 1 1    9   27   15 o   87.586   2.5027  159.114   9.0151  159.219   13.261  159.024   12.292   87.594   3.6707   87.578   3.4030 0.1519775E-01 5.005471 
1 1 1    9   27   16 o   65.755   3.4036   90.573   9.1912   82.469   13.153   98.307   12.849   62.826   5.0760   68.684   4.5357 -5.858013 6.807213 
1 1 1    9   27   17 o   67.646   7.0601  122.661   11.716  130.774   12.651   73.829   31.039   79.300   3.8681   55.992   13.580 23.30741 14.12019 
1 1 1    9   27   18 o   76.354   3.2360  121.069   10.163  111.853   13.794  132.011   15.031   73.194   4.5694   79.514   4.5835 -6.319466 6.472026 
1 1 1    9   27   19 o   79.110   3.1497  127.491   10.026  117.495   12.649  144.383   16.443   75.111   4.0829   83.108   4.7971 -7.997231 6.299395 
1 1 1    9   27   20 o   67.308   7.1764  113.508   11.974  117.856   12.848   84.791   33.021   75.162   4.1446   59.455   13.741 15.70660 14.35278 
1 1 1    9   27   21 o   41.898   4.7724   37.071   7.8174   25.733   10.278   52.634   12.042   33.952   7.5362   49.844   5.8573 -15.89236 9.544751 
1 1 1    9   27   22 o   95.464   3.4428  192.974   13.448  169.609   19.335  214.867   18.716   89.687   5.2270  101.241   4.4821 -11.55417 6.885509 
1 1 1    9   27   23 o   57.408   4.8768   71.476   11.374   65.204   17.135   76.416   15.207   54.904   7.5669   59.912   6.1542 -5.007881 9.753625 
1 1 1    9   27   24 o   95.609   3.7000  194.967   14.401  176.219   21.485  210.261   19.406   91.181   5.7131  100.036   4.7034 -8.855553 7.400079 
1 1 1    9   27   25 o   74.988   3.4726  117.214   10.468  112.499   13.273  124.972   17.027   73.185   4.3971   76.791   5.3759 -3.605797 6.945148 
1 1 1    9   27   26 o   56.909   6.4364   76.975   13.102   63.975   23.391   82.918   15.816   51.619   11.300   62.198   6.1652 -10.57848 12.87277 
1 1 1    9   27   27 o   94.430   3.6457  188.456   13.890  185.517   17.827  192.996   22.158   93.764   4.6097   95.096   5.6493 -1.331238 7.291350 
1 1 1    9   27   28 o   72.886   3.7466  109.678   10.834  100.996   13.377  126.235   18.473   69.078   4.6951   76.693   5.8400 -7.614410 7.493254 
1 1 1    9   27   29 o   50.998   4.7113   52.742   9.4807   43.773   11.532   71.446   16.653   44.959   6.2191   57.037   7.0788 -12.07841 9.422681 
1 1 1    9   27   30 o   75.242   5.8607  116.272   12.797  111.387   13.766  147.346   34.718   72.369   4.6121   78.115   10.776 -5.745590 11.72136 
1 1 1    9   27   31 o   26.965   6.7470   13.843   8.7594   9.5214   10.394   24.435   16.273   22.260   8.3571   31.670   10.595 -9.410450 13.49390 
1 1 1    9   27   32 o   24.691   6.0717   12.834   8.9010   21.958   10.878  -5.6505   15.483   30.236   8.4146   19.146   8.7555 11.08961 12.14346 
1 1 1    9   27   33 o   27.234   7.6268   15.455   12.770   12.926   18.472   17.770   17.673   26.372   10.757   28.096   10.815 -1.724066 15.25358 
1 1 1    9   27   34 o   45.816   6.6629   44.948   11.340   33.444   13.311   75.390   21.653   36.825   8.8697   54.808   9.9451 -17.98287 13.32578 
1 1 1    9   27   35 o   29.418   7.2557   20.267   9.9403   16.848   11.688   29.201   18.897   26.288   8.9780   32.547   11.401 -6.259205 14.51145 
1 1 1    9   27   36 f   24.752   6.3198   13.775   9.7966   23.047   11.608  -9.1746   18.263   30.135   8.7940   19.369   9.0788 10.76650 12.63954 
1 1 1    9   27   37 o   57.151   5.1855   75.482   11.437   72.037   13.849   82.867   20.278   56.410   5.9526   57.892   8.4926 -1.481834 10.37101 
1 1 1    9   27   38 o   20.678   7.0563  -2.3016   10.962  -0.6542   11.404 -22.2875   39.723   17.289   7.7463   24.068   11.797 -6.778830 14.11265 
1 1 1    9   28    0 o  115.199   2.3631  274.810   15.848  274.810   15.848  274.810   15.848  115.199   3.3419  115.199   3.3419 0.000000 0.000000 
1 1 1    9   28    1 o  139.549   2.1175  402.658   12.187  402.511   17.142  402.809   17.329  139.525   2.9789  139.573   3.0103 -0.4792786E-01 4.235067 
1 1 1    9   28    2 o   94.596   2.3294  184.385   9.0635  175.528   12.279  194.988   13.435   92.116   3.2318   97.077   3.3554 -4.960373 4.658730 
1 1 1    9   28    3 o   83.538   2.4295  144.385   8.3382  144.029   11.297  144.810   12.358   83.438   3.2828   83.638   3.5824 -0.2003632 4.859065 
1 1 1    9   28    4 o  224.288   2.5015  1040.86   22.927  1044.70   34.900  1037.95   30.409  224.596   3.7675  223.981   3.2918 0.6145172 5.003016 
1 1 1    9   28    5 o   49.540   3.5866   49.612   7.1132   45.595   8.8931   56.746   11.852   46.868   4.6005   52.213   5.5035 -5.344608 7.173121 
1 1 1    9   28    6 o  106.288   3.3485  191.182   11.210  171.299   12.125  308.234   29.418   90.988   3.2309  121.587   5.8662 -30.59931 6.697099 
1 1 1    9   28    7 o   14.815   4.4596   0.2192   4.6665  -0.6102   7.6251   0.7158   5.9004   15.382   6.6266   14.248   5.9701 1.134017 8.919283 
1 1 1    9   28    8 o   21.361   5.0666   8.1985   5.0280   12.179   8.8334   6.2904   6.1154   24.282   7.7872   18.439   6.4841 5.843290 10.13329 
1 1 1    9   28    9 o   43.865   4.2523   34.716   6.8574   20.982   8.1875   66.991   12.551   31.060   6.5950   56.670   5.3697 -25.60960 8.504564 
1 1 1    9   28   10 o   52.465   3.8694   54.186   7.8940   48.325   9.4774   67.465   14.265   48.177   4.7696   56.753   6.0942 -8.576130 7.738792 
1 1 1    9   28   11 o   36.370   5.0130   28.322   7.1373   28.099   9.0061   28.698   11.703   36.627   5.9617   36.114   8.0610 0.5129662 10.02604 
1 1 1    9   28   12 o  120.213   3.1738  299.424   15.736  299.424   15.736   0.0000   0.0000  120.213   3.1738  ?   ?       ?      ? 
1 1 1    9   28   13 o   91.312   2.9922  166.842   9.9067  159.973   11.426  187.636   19.880   87.855   3.1534   94.769   5.0861 -6.914169 5.984355 
1 1 1    9   28   14 o   50.863   2.9905   53.338   6.2070   57.449   9.6322   50.420   8.1169   52.496   4.4487   49.230   3.9975 3.265388 5.980923 
1 1 1    9   28   15 o   40.643   4.4144   40.760   6.2353   22.348   10.407   51.071   7.7880   31.731   7.9641   49.554   3.8105 -17.82319 8.828774 
1 1 1    9   28   16 o   98.585   2.9593  202.887   11.847  204.722   15.500  200.308   18.373   99.214   3.7880   97.956   4.5476 1.257957 5.918544 
1 1 1    9   28   17 o   56.426   3.5688   66.132   8.1772   51.457   11.062   83.814   12.142   49.513   5.4166   63.338   4.6481 -13.82441 7.137594 
1 1 1    9   28   18 o   49.408   3.9624   50.977   7.9404   65.185   11.829   39.324   10.713   55.700   5.1491   43.116   6.0240 12.58403 7.924751 
1 1 1    9   28   19 o  101.838   2.9559  210.562   12.015  193.533   14.952  241.601   20.187   96.329   3.7633  107.348   4.5594 -11.01833 5.911859 
1 1 1    9   28   20 o   57.536   3.5057   69.306   8.2781   66.402   11.080   72.977   12.455   56.218   4.7785   58.853   5.1309 -2.634766 7.011399 
1 1 1    9   28   21 o   56.822   7.2132   74.432   10.536   74.763   11.226   71.991   30.506   59.684   4.5605   53.960   13.687 5.724354 14.42647 
1 1 1    9   28   22 o   24.495   5.6212   11.706   6.7792   5.9482   9.0933   18.911   10.171   19.959   7.7365   29.030   8.1571 -9.071047 11.24243 
1 1 1    9   28   23 o   27.478   6.6888   16.224   9.3760   7.8825   16.291   20.356   11.465   24.957   10.132   29.999   8.7356 -5.041784 13.37769 
1 1 1    9   28   24 o   44.385   4.7440   43.682   8.2764   47.251   10.957   38.941   12.629   47.099   5.6405   41.671   7.6294 5.427589 9.488004 
1 1 1    9   28   25 f  128.357   2.9659  347.956   15.454  357.735   20.320  334.536   23.803  130.734   3.7685  125.981   4.5810 4.752983 5.931849 
1 1 1    9   28   26 o   61.810   4.0200   79.970   10.135   67.878   13.267   96.915   15.706   56.311   5.7126   67.309   5.6576 -10.99825 8.040046 
1 1 1    9   28   27 o   76.011   3.7864  121.090   11.472  114.947   14.327  132.066   19.150   73.663   4.7158   78.360   5.9254 -4.696800 7.572867 
1 1 1    9   28   28 o   62.885   4.3368   87.972   10.895   98.371   14.377   73.943   16.698   67.829   5.1390   57.941   6.9874 9.888184 8.673693 
1 1 1    9   28   29 o   33.839   6.1567   24.945   8.2981   19.601   10.091   36.108   14.584   28.936   8.1226   38.742   9.2543 -9.806192 12.31334 
1 1 1    9   28   30 o   43.839   5.3660   42.069   9.0869   37.859   11.164   50.333   15.642   41.433   6.5330   46.246   8.5144 -4.812988 10.73199 
1 1 1    9   28   31 o   40.368   7.4400   47.653   11.096   51.130   11.901   24.537   30.686   48.200   5.9864   32.536   13.623 15.66372 14.87995 
1 1 1    9   28   32 o   25.836   6.5475   15.468   8.9261   18.518   10.716   8.5566   16.131   27.757   8.5330   23.916   9.9332 3.841106 13.09504 
1 1 1    9   28   33 o   25.365   7.5174   10.679   13.242   2.2310   22.849   14.951   16.249   24.416   10.950   26.313   10.302 -1.896902 15.03485 
1 1 1    9   28   34 o   33.246   6.8438   23.071   9.5806   13.674   11.264   47.651   18.217   24.295   8.7717   42.197   10.508 -17.90151 13.68763 
1 1 1    9   28   35 o   23.985   6.7325   11.279   9.2628   9.3885   11.063   15.713   16.941   21.749   8.5046   26.221   10.439 -4.472408 13.46504 
1 1 1    9   28   36 o   25.923   6.8333   17.404   11.270   24.999   12.180 -27.8513   29.729   30.842   9.0101   21.004   10.276 9.838381 13.66657 
1 1 1    9   28   37 f   29.234   7.6545   25.581   12.062   29.048   12.586 -13.4929   42.254   33.064   8.9917   25.404   12.390 7.659676 15.30896 
1 1 1    9   29    0 o   97.844   2.4049  198.606   13.687  198.606   13.687  198.606   13.687   97.844   3.4010   97.844   3.4010 0.000000 0.000000 
1 1 1    9   29    1 o  232.757   2.4913  1121.97   23.700  1115.91   31.435  1129.96   36.076  232.106   3.2836  233.407   3.7475 -1.301041 4.982567 
1 1 1    9   29    2 o  151.408   2.2497  474.229   13.940  470.734   18.563  478.749   21.110  150.807   2.9845  152.009   3.3672 -1.202240 4.499440 
1 1 1    9   29    3 o   41.800   3.7312   34.705   6.2418   43.987   10.501   29.634   7.7618   45.889   5.5484   37.711   4.9903 8.177483 7.462414 
1 1 1    9   29    4 o   42.169   3.2286   37.150   5.5878   35.010   8.1656   39.035   7.6630   41.000   4.8288   43.338   4.2871 -2.338055 6.457264 
1 1 1    9   29    5 o   86.820   2.6857  153.937   9.2460  147.785   11.478  165.306   15.604   84.456   3.2952   89.185   4.2420 -4.729012 5.371474 
1 1 1    9   29    6 o  130.770   2.4015  353.636   12.506  351.298   15.731  357.650   20.614  130.270   2.9279  131.271   3.8073 -1.000534 4.802947 
1 1 1    9   29    7 o   61.365   2.6206   78.094   6.6292   74.665   9.2539   81.708   9.5011   59.979   3.7407   62.751   3.6710 -2.772217 5.241116 
1 1 1    9   29    8 o  110.027   3.7319  260.662   15.624  232.124   27.254  274.633   19.069  105.099   6.2874  114.954   4.0220 -9.854767 7.463743 
1 1 1    9   29    9 o   61.753   3.7544   81.032   9.3898   95.438   13.026   65.446   13.548   67.657   4.6679   55.849   5.8817 11.80895 7.508875 
1 1 1    9   29   10 o   22.611   5.8959   8.3887   7.4037   4.4801   10.348   12.487   10.597   20.223   8.1221   24.999   8.5486 -4.776228 11.79183 
1 1 1    9   29   11 o   86.498   3.1464  153.470   11.129  135.921   14.635  177.534   17.138   80.743   4.3947   92.254   4.5041 -11.51067 6.292869 
1 1 1    9   29   12 f   41.037   4.9907   36.423   8.2226   39.565   11.491   33.126   11.771   43.275   6.4381   38.800   7.6276 4.474998 9.981460 
1 1 1    9   29   13 o  113.679   2.8778  270.393   13.383  280.620   18.028  257.841   19.973  116.165   3.7628  111.193   4.3552 4.971848 5.755532 
1 1 1    9   29   14 o   95.654   4.7029  200.600   14.712  205.507   16.535  181.958   32.226   99.343   4.0356   91.965   8.4960 7.377922 9.405765 
1 1 1    9   29   15 o   65.474   5.4305   75.754   11.569   67.113   12.624  121.061   28.906   56.497   5.4174   74.451   9.4134 -17.95350 10.86095 
1 1 1    9   29   16 o   35.746   4.1141   28.277   5.3983   25.321   9.5402   29.670   6.5472   33.818   7.0675   37.674   4.2135 -3.856754 8.228238 
1 1 1    9   29   17 f   63.761   3.4253   93.360   8.1088   63.166   13.405  110.784   10.183   54.566   5.9563   72.957   3.3841 -18.39072 6.850583 
1 1 1    9   29   18 o   39.934   4.0498   35.834   6.0901   28.453   9.8083   40.466   7.7692   35.905   6.8736   43.963   4.2847 -8.057842 8.099683 
1 1 1    9   29   19 o   76.005   3.1767  120.591   9.9308  109.511   13.551  133.447   14.596   72.236   4.5482   79.774   4.4362 -7.538429 6.353418 
1 1 1    9   29   20 o   96.240   3.0893  193.596   12.244  208.227   17.810  180.483   16.861   99.692   4.3315   92.788   4.4059 6.903908 6.178507 
1 1 1    9   29   21 o   96.120   3.8112  199.452   14.789  166.998   21.992  226.248   19.983   88.529   6.0229  103.711   4.6716 -15.18159 7.622302 
1 1 1    9   29   22 o   72.385   3.3508  106.162   9.7568   91.754   12.252  131.141   16.132   66.019   4.4995   78.751   4.9666 -12.73270 6.701691 
1 1 1    9   29   23 o   51.874   9.0060   65.292   11.067   65.366   11.439   64.220   43.792   55.582   4.9897   48.165   17.307 7.416908 18.01202 
1 1 1    9   29   24 o   46.879   5.8000   51.595   10.350   41.445   16.670   57.962   13.202   41.858   9.8244   51.899   6.1677 -10.04116 11.59996 
1 1 1    9   29   25 o   26.358   5.9175   15.710   7.2657   17.697   9.4038   12.766   11.445   27.846   7.8499   24.870   8.8571 2.976669 11.83506 
1 1 1    9   29   26 o   26.183   6.1663   15.082   7.6141   14.706   9.5673   15.731   12.575   25.573   8.0940   26.793   9.3049 -1.219589 12.33268 
1 1 1    9   29   27 o   58.928   4.0165   73.874   9.4664   70.473   11.899   79.739   15.625   57.399   5.0261   60.457   6.2664 -3.058182 8.033040 
1 1 1    9   29   28 o   13.051   4.4691 -14.2824   7.1592 -11.4838   8.9074 -19.3894   12.032   12.501   5.9960   13.601   6.6288 -1.100003 8.938231 
1 1 1    9   29   29 o   46.525   5.5287   49.139   10.139   46.380   12.938   53.528   16.319   45.586   6.8815   47.464   8.6551 -1.878780 11.05737 
1 1 1    9   29   30 o   47.755   5.5604   51.259   9.7404   48.556   11.552   57.906   18.116   46.951   5.9656   48.559   9.3852 -1.608006 11.12070 
1 1 1    9   29   31 o   26.855   6.7243   16.442   8.8799   15.530   10.752   18.399   15.750   25.733   8.6117   27.978   10.330 -2.245123 13.44868 
1 1 1    9   29   32 o   27.409   8.1376   15.033   10.696   16.348   10.996  -8.0267   46.045   26.064   8.7092   28.753   13.749 -2.689713 16.27516 
1 1 1    9   29   33 f   17.981   5.7883  -4.3922   8.8935  -8.0604   10.939   2.7590   15.274   14.960   7.0166   21.002   9.2079 -6.042404 11.57660 
1 1 1    9   29   34 o   27.857   8.8220   12.541   21.622   24.085   24.662 -25.8112   44.954   29.982   12.352   25.732   12.599 4.250662 17.64397 
1 1 1    9   29   35 o   30.501   8.1489   27.753   13.074   30.520   13.567  -8.2616   48.946   33.720   9.4019   27.282   13.313 6.437708 16.29787 
1 1 1    9   29   36 o   25.962   8.8837  -5.1492   28.000  -7.9328   34.918  -0.1356   46.862   24.537   11.796   27.388   13.287 -2.851139 17.76746 
1 1 1    9   30    0 o   36.453   3.6975   29.219   7.3926   29.219   7.3926   29.219   7.3926   36.453   5.2291   36.453   5.2291 0.000000 0.000000 
1 1 1    9   30    1 o   33.592   3.7911   23.950   5.1221   21.539   7.1630   26.473   7.3272   31.587   5.7082   35.598   4.9906 -4.010254 7.582190 
1 1 1    9   30    2 o  163.724   2.3120  554.207   15.415  566.499   23.882  545.428   20.183  165.206   3.5049  162.241   3.0162 2.965775 4.624029 
1 1 1    9   30    3 o   41.514   3.2064   36.074   5.4451   41.680   7.7478   30.603   7.6541   44.746   4.1981   38.282   4.8477 6.464348 6.412817 
1 1 1    9   30    4 o   79.340   2.7261  131.491   8.5136  133.001   10.601  128.749   14.287   80.083   3.2096   78.598   4.4073 1.485306 5.452168 
1 1 1    9   30    5 o  113.377   2.4528  266.086   10.957  264.221   13.595  269.543   18.510  112.922   2.9191  113.831   3.9425 -0.9087601 4.905573 
1 1 1    9   30    6 o   49.636   3.1303   53.353   6.0864   59.207   7.7734   44.078   9.7843   53.391   3.5300   45.881   5.1705 7.510174 6.260627 
1 1 1    9   30    7 o  106.000   3.4645  225.830   12.063  250.477   27.737  220.081   13.396  108.996   6.1699  103.005   3.1532 5.990967 6.928980 
1 1 1    9   30    8 o  100.327   2.9219  208.263   12.038  195.149   16.131  224.745   18.085   96.809   4.0401  103.845   4.2224 -7.035667 5.843878 
1 1 1    9   30    9 o   97.461   2.9393  197.569   11.767  194.465   15.882  201.346   17.520   96.654   3.9840   98.268   4.3226 -1.614128 5.878523 
1 1 1    9   30   10 o   72.260   3.3339  110.190   9.8334  122.567   13.544   96.392   14.300   76.676   4.2827   67.843   5.1106 8.833893 6.667787 
1 1 1    9   30   11 o   97.108   2.9744  197.652   11.825  206.817   16.020  186.682   17.527   99.670   3.8970   94.547   4.4945 5.123276 5.948740 
1 1 1    9   30   12 o   50.440   4.1676   53.178   8.5804   43.474   11.560   65.085   12.805   45.308   6.1859   55.572   5.5866 -10.26331 8.335208 
1 1 1    9   30   13 o   37.411   5.4596   31.259   8.1086   32.013   10.932   30.337   12.090   38.070   7.2264   36.752   8.1859 1.318848 10.91929 
1 1 1    9   30   14 o   48.842   4.3178   50.492   8.6805   47.715   11.826   53.736   12.782   47.405   6.0484   50.279   6.1637 -2.874275 8.635654 
1 1 1    9   30   15 o   69.631   5.3681  101.654   12.059   99.791   13.362  109.834   27.999   68.937   4.6993   70.325   9.6531 -1.387634 10.73623 
1 1 1    9   30   16 o   49.824   4.2545   53.430   8.6218   59.213   11.737   46.652   12.707   52.939   5.3753   46.708   6.5962 6.231190 8.509033 
1 1 1    9   30   17 o   35.220   5.7981   28.002   8.2628   29.158   11.897   26.925   11.484   35.927   8.2085   34.512   8.1910 1.415096 11.59614 
1 1 1    9   30   18 o   26.242   5.0711   14.105   4.7880   17.017   10.850   13.400   5.3356   27.755   8.5949   24.728   5.3842 3.027042 10.14211 
1 1 1    9   30   19 o   49.930   3.4102   52.579   7.0186   50.968   9.9757   54.158   9.8767   49.150   4.9210   50.710   4.7223 -1.560066 6.820331 
1 1 1    9   30   20 o   23.451   5.1304   11.216   5.4455   16.233   8.7543   8.0499   6.9548   26.864   7.5742   20.038   6.9222 6.826578 10.26089 
1 1 1    9   30   21 o   20.151   5.2148   7.4862   5.6756   5.8035   8.6652   8.7504   7.5109   19.481   7.5519   20.821   7.1936 -1.340206 10.42970 
1 1 1    9   30   22 o   81.301   4.2811  150.545   13.422  103.677   20.538  185.486   17.734   68.881   7.2294   93.721   4.5877 -24.83994 8.562172 
1 1 1    9   30   23 o   20.507   5.2763   6.0165   6.3440  -1.3220   8.7678   14.080   9.1909   15.851   6.9622   25.163   7.9299 -9.312283 10.55251 
1 1 1    9   30   24 o   48.333   7.8523   54.475   10.153   53.939   10.704   59.286   32.064   50.287   5.1608   46.378   14.832 3.909515 15.70456 
1 1 1    9   30   25 o   31.453   6.5432   25.997   9.7649   6.5990   19.361   32.615   11.309   25.199   10.699   37.707   7.5349 -12.50846 13.08637 
1 1 1    9   30   26 o   38.562   5.3545   35.125   8.0630   39.384   10.368   28.606   12.826   42.575   5.9043   34.549   8.9344 8.026066 10.70909 
1 1 1    9   30   27 o   16.914   5.1779  -0.8878   7.0029   4.6859   9.1197  -8.8970   10.932   18.813   7.6004   15.016   7.0340 3.796096 10.35582 
1 1 1    9   30   28 o   30.074   6.0147   22.582   7.9295   26.179   10.075   16.727   12.854   33.360   7.5040   26.788   9.4018 6.572628 12.02933 
1 1 1    9   30   29 o   58.761   4.1267   75.562   9.6996   74.690   12.299   76.996   15.776   58.752   5.0755   58.770   6.5083 -0.1810455E-01 8.253425 
1 1 1    9   30   30 o   27.103   6.6104   17.782   9.3002   22.318   11.976   10.892   14.761   30.019   8.9776   24.187   9.7053 5.831764 13.22082 
1 1 1    9   30   31 o   37.179   7.2349   40.763   10.664   43.727   11.443   21.186   29.406   44.078   6.2943   30.281   13.029 13.79754 14.46976 
1 1 1    9   30   32 o   18.534   6.3641  -8.1527   9.9848  -5.9438   10.596 -25.6676   29.836   15.276   7.0776   21.792   10.579 -6.515610 12.72817 
1 1 1    9   30   33 o   28.056   9.0281   13.388   22.811   20.918   26.733  -6.7729   43.742   28.984   12.446   27.128   13.082 1.856133 18.05629 
1 1 1    9   30   34 o   33.046   8.7713   29.239   20.657   65.462   27.542 -17.3414   31.232   43.531   13.728   22.560   10.922 20.97108 17.54262 
1 1 1    9   31    0 o  179.020   3.2925  666.466   34.327  666.466   34.327  666.466   34.327  179.020   4.6563  179.020   4.6563 0.000000 0.000000 
1 1 1    9   31    1 o   59.635   2.6225   74.131   6.4314   77.406   8.8948   70.543   9.3102   61.041   3.5330   58.229   3.8767 2.812302 5.245086 
1 1 1    9   31    2 o   47.358   3.2486   46.703   6.1557   47.354   10.028   46.310   7.7976   47.552   5.1132   47.164   4.0085 0.3880653 6.497151 
1 1 1    9   31    3 o  138.172   2.2002  397.945   12.423  412.236   16.660  380.047   18.644  141.041   2.8640  135.303   3.3409 5.737350 4.400492 
1 1 1    9   31    4 o   41.872   3.6574   35.324   6.0131   32.409   7.3218   41.363   10.539   39.401   4.5055   44.342   5.7626 -4.940620 7.314878 
1 1 1    9   31    5 o   54.390   3.7701   67.765   7.3939   49.315   13.212   76.179   8.9219   48.243   6.6399   60.538   3.5733 -12.29514 7.540281 
1 1 1    9   31    6 o   41.966   4.2760   35.795   7.0780   41.936   12.276   32.737   8.6629   44.451   6.6960   39.481   5.3199 4.970043 8.552090 
1 1 1    9   31    7 o   79.877   4.1979  137.160   12.560  128.968   22.830  140.716   15.041   77.714   7.1225   82.039   4.4451 -4.325577 8.395802 
1 1 1    9   31    8 o   50.060   4.1616   53.506   8.3610   38.989   11.621   69.085   12.038   42.793   6.5843   57.327   5.0914 -14.53316 8.323226 
1 1 1    9   31    9 o   44.088   4.8115   41.206   8.4083   32.161   11.123   53.265   12.844   38.113   7.3422   50.063   6.2205 -11.94987 9.623034 
1 1 1    9   31   10 o   41.249   4.8550   36.915   8.0755   34.682   11.385   39.177   11.456   39.633   7.2312   42.865   6.4801 -3.231373 9.709925 
1 1 1    9   31   11 o   49.004   4.1547   51.028   8.3745   52.812   11.565   49.061   12.142   49.966   5.6121   48.043   6.1279 1.922977 8.309422 
1 1 1    9   31   12 o   38.901   5.1241   33.297   7.9714   25.886   11.131   41.099   11.421   33.882   8.0791   43.919   6.3050 -10.03749 10.24814 
1 1 1    9   31   13 o   52.027   4.2289   56.875   8.9663   53.561   11.677   61.638   13.997   50.288   5.6297   53.766   6.3119 -3.477314 8.457757 
1 1 1    9   31   14 o   39.111   5.1741   33.587   8.1205   34.296   10.951   32.720   12.104   40.035   6.6318   38.188   7.9437 1.846848 10.34811 
1 1 1    9   31   15 o   43.143   7.4422   30.966   10.437   24.023   11.343   69.287   26.648   32.559   8.3933   53.727   12.292 -21.16714 14.88438 
1 1 1    9   31   16 o   65.253   3.6049   88.817   9.6403   80.171   12.792  100.184   14.667   61.641   5.0314   68.865   5.1638 -7.223801 7.209729 
1 1 1    9   31   17 o   18.490   5.5066   1.8574   7.1553   1.8302   9.9417   1.8866   10.306   18.336   7.7196   18.644   7.8550 -0.3074207 11.01326 
1 1 1    9   31   18 o   56.633   5.3343   68.089   12.460   68.089   12.460   0.0000   0.0000   56.633   5.3343  ?   ?       ?      ? 
1 1 1    9   31   19 o   54.504   4.0513   62.907   9.0705   56.703   12.229   70.495   13.524   51.532   5.7536   57.475   5.7051 -5.942772 8.102563 
1 1 1    9   31   20 o   75.660   3.4538  122.800   10.524   92.588   14.803  153.681   14.966   65.882   5.4478   85.438   4.2470 -19.55595 6.907668 
1 1 1    9   31   21 o   20.815   4.9020   9.2306   5.0613   5.1942   8.2836   11.635   6.3935   18.775   7.3545   22.855   6.4830 -4.079702 9.803979 
1 1 1    9   31   22 o   25.855   5.2277   15.220   5.8194   14.469   9.0484   15.750   7.5996   25.358   7.8483   26.352   6.9079 -0.9938869 10.45537 
1 1 1    9   31   23 o   38.109   4.7928   31.876   7.3332   37.294   11.154   27.751   9.7319   41.267   6.5536   34.951   6.9952 6.315624 9.585555 
1 1 1    9   31   24 o   48.503   3.9723   50.352   7.8923   43.023   10.642   59.310   11.765   44.549   5.7920   52.457   5.4376 -7.908657 7.944518 
1 1 1    9   31   25 o   82.197   3.4143  144.793   11.540  157.982   16.364  131.748   16.275   86.058   4.6104   78.337   5.0372 7.721443 6.828515 
1 1 1    9   31   26 o   25.958   7.6914   10.902   13.436   16.411   15.082 -10.2791   29.575   27.074   10.086   24.841   11.615 2.233702 15.38285 
1 1 1    9   31   27 o   54.035   4.0170   62.869   8.8437   57.502   11.478   70.712   13.874   51.387   5.4154   56.684   5.9346 -5.296795 8.034046 
1 1 1    9   31   28 o   25.057   5.9657   15.184   9.4042   24.102   9.8985 -67.4773   30.136   31.844   7.6354   18.270   9.1683 13.57407 11.93136 
1 1 1    9   31   29 o   41.565   8.6197   42.346   11.265   40.698   11.784   59.815   38.357   42.361   6.7448   40.768   15.865 1.593071 17.23935 
1 1 1    9   31   30 o   26.686   8.4105  -1.8706   20.563   31.934   29.356 -34.4341   28.812   32.958   13.515   20.414   10.014 12.54346 16.82100 
1 1 1    9   31   31 o   24.993   7.8939  -2.6770   18.749   24.637   24.918 -38.3172   28.464   30.277   12.438   19.709   9.7237 10.56745 15.78786 
1 1 1    9   31   32 o   33.719   10.369   30.417   25.392   81.501   45.278   6.9803   30.669   41.145   16.819   26.294   12.133 14.85077 20.73809 
1 1 1    9   31   33 o   22.962   7.6195  -8.6792   19.457   12.647   25.638 -37.6428   29.878   26.119   11.665   19.805   9.8061 6.313892 15.23904 
1 1 1    9   32    0 o   52.344   2.7140   57.737   8.1840   57.737   8.1840   57.737   8.1840   52.344   3.8382   52.344   3.8382 0.000000 0.000000 
1 1 1    9   32    1 o   23.848   4.9890   12.295   5.1529   12.884   8.3289   11.930   6.5588   24.383   7.5271   23.314   6.5500 1.068811 9.977989 
1 1 1    9   32    2 o   58.900   2.5323   72.125   6.1099   61.211   8.4195   84.266   8.8804   54.171   3.7684   63.629   3.3838 -9.458332 5.064666 
1 1 1    9   32    3 o  103.462   2.6187  224.704   10.221  226.998   12.238  219.413   18.583  104.576   2.8374  102.348   4.4022 2.227837 5.237363 
1 1 1    9   32    4 o   58.381   3.2218   70.607   7.2010   73.829   12.965   69.170   8.6594   59.158   5.3138   57.604   3.6447 1.553299 6.443616 
1 1 1    9   32    5 o  138.179   2.8398  400.153   16.105  384.967   23.709  413.164   21.946  135.635   4.2381  140.723   3.7811 -5.087982 5.679681 
1 1 1    9   32    6 o  114.980   3.7403  289.747   16.859  323.863   21.636  237.011   26.900  124.407   4.2166  105.552   6.1790 18.85443 7.480641 
1 1 1    9   32    7 o   50.373   5.3627   44.423   9.7687   87.168   19.948   30.939   11.204   63.491   7.6178   37.256   7.5501 26.23532 10.72545 
1 1 1    9   32    8 o   81.010   3.1170  137.037   10.389  130.359   14.098  144.972   15.368   78.881   4.3333   83.139   4.4817 -4.258354 6.234015 
1 1 1    9   32    9 o   62.441   4.2834   84.372   10.821   69.707   15.847   97.183   14.812   57.043   6.7355   67.840   5.2937 -10.79675 8.566817 
1 1 1    9   32   10 f  114.067   3.1485  274.018   14.680  263.334   22.034  282.546   19.685  111.917   4.7734  116.216   4.1069 -4.299568 6.296971 
1 1 1    9   32   11 o   33.654   5.6189   28.351   8.9515   3.6092   14.787   42.663   11.246   22.526   9.4454   44.783   6.0888 -22.25660 11.23783 
1 1 1    9   32   12 o   31.962   6.2496   24.425   8.9132   13.401   14.624   30.941   11.243   26.716   9.9359   37.209   7.5832 -10.49297 12.49911 
1 1 1    9   32   13 o   70.891   4.0399  106.004   11.758  115.970   17.690   98.117   15.738   73.815   5.8107   67.966   5.6141 5.848877 8.079712 
1 1 1    9   32   14 o   34.889   6.4549   28.856   9.3020   24.245   15.370   31.521   11.685   32.445   10.258   37.334   7.8381 -4.889515 12.90977 
1 1 1    9   32   15 o   33.514   8.3718   24.727   13.359   24.957   15.474   24.052   26.471   32.827   10.281   34.201   13.216 -1.374218 16.74368 
1 1 1    9   32   16 f   95.369   4.3660  189.380   15.148  207.605   29.935  183.107   17.562   97.529   7.4417   93.210   4.5682 4.319405 8.731979 
1 1 1    9   32   17 o   46.352   4.6489   46.626   8.4473   34.176   11.421   61.665   12.552   38.988   7.3723   53.717   5.6654 -14.72903 9.297750 
1 1 1    9   32   18 o   80.862   5.6501  166.639   13.676  181.326   15.367  110.684   29.994   92.886   4.0111   68.838   10.564 24.04811 11.30016 
1 1 1    9   32   19 o   99.200   3.0383  207.806   12.296  209.512   16.285  205.542   18.754   99.842   3.9547   98.557   4.6137 1.284752 6.076641 
1 1 1    9   32   20 o   66.812   3.7036   92.456   10.042   77.974   12.902  114.707   15.993   60.411   5.1782   73.213   5.2964 -12.80182 7.407099 
1 1 1    9   32   21 o   66.903   8.6131  126.330   13.168  129.989   13.894   94.054   41.262   78.342   4.3000   55.464   16.681 22.87860 17.22627 
1 1 1    9   32   22 o   21.726   4.6658   2.2342   3.9629   25.096   10.729  -1.3776   4.2644   32.714   8.0148   10.738   4.7793 21.97531 9.331627 
1 1 1    9   32   23 o   28.528   4.5978   19.483   5.5727   10.297   8.4965   26.418   7.3825   21.997   7.6481   35.058   5.1056 -13.06168 9.195658 
1 1 1    9   32   24 o   15.772   4.7470   1.0839   5.1061   2.6546   8.9513   0.3263   6.2168   17.561   7.3554   13.982   6.0028 3.578588 9.494009 
1 1 1    9   32   25 o   47.069   9.1444   66.306   17.258   69.113   18.943   52.606   41.854   54.297   8.4588   39.842   16.215 14.45477 18.28874 
1 1 1    9   32   26 o   26.519   7.5250   13.662   9.7509   14.135   10.392   10.183   28.191   24.792   8.4657   28.245   12.443 -3.453836 15.04992 
1 1 1    9   32   27 o   28.231   8.5352   7.5659   18.210 -10.8378   23.630   34.477   28.574   21.924   10.293   34.537   13.618 -12.61296 17.07035 
1 1 1    9   32   28 o   45.764   9.0140   60.854   18.712   37.461   24.973   90.805   28.257   35.177   13.003   56.351   12.487 -21.17354 18.02792 
1 1 1    9   32   29 o   27.098   8.7545   7.1956   20.016   4.9022   23.653   12.980   37.565   24.779   11.125   29.417   13.520 -4.637791 17.50896 
1 1 1    9   32   30 o   35.953   9.4017   38.577   20.927   71.722   30.395   8.7033   28.857   45.409   14.433   26.496   12.053 18.91305 18.80348 
1 1 1    9   32   31 o   23.012   7.6821  -5.1664   18.855  -4.8061   24.626  -5.6769   29.313   22.379   10.506   23.646   11.210 -1.267187 15.36422 
1 1 1    9   32   32 o   39.715   10.246   65.413   23.405   69.769   27.079   52.547   46.535   45.336   13.486   34.094   15.429 11.24105 20.49194 
1 1 1    9   33    0 o   18.974   5.6179   10.673   6.2360   10.673   6.2360   10.673   6.2360   18.974   7.9449   18.974   7.9449 0.000000 0.000000 
1 1 1    9   33    1 o   22.394   4.3236   10.773   4.3873   5.3807   6.1823   16.243   6.2271   17.584   6.4754   27.204   5.7309 -9.620222 8.647168 
1 1 1    9   33    2 o   22.291   4.3462   10.808   4.2266   14.091   6.0285   7.6342   5.9275   25.283   5.8906   19.299   6.3921 5.983665 8.692387 
1 1 1    9   33    3 o  128.853   2.9766  347.493   15.817  342.551   22.182  352.606   22.561  127.923   4.2043  129.782   4.2148 -1.858955 5.953168 
1 1 1    9   33    4 o   89.589   2.7180  164.111   9.4687  178.048   16.695  157.501   11.497   92.165   4.3918   87.014   3.2035 5.151733 5.436010 
1 1 1    9   33    5 o   78.351   2.7597  119.796   8.2757  151.252   15.476  107.200   9.7935   84.937   4.4178   71.765   3.3087 13.17235 5.519477 
1 1 1    9   33    6 o   85.666   3.1774  153.641   11.185  157.761   16.634  150.241   15.112   86.658   4.6539   84.673   4.3271 1.985291 6.354734 
1 1 1    9   33    7 o   79.781   3.5468  131.155   11.404  148.290   18.603  120.838   14.435   83.727   5.3870   75.834   4.6152 7.892632 7.093643 
1 1 1    9   33    8 o   30.782   6.0068   22.718   8.2617   12.047   13.658   28.875   10.375   25.586   9.5851   35.978   7.2424 -10.39207 12.01361 
1 1 1    9   33    9 o   69.743   3.4595  103.264   9.8072  106.519   12.951   98.888   15.016   71.190   4.4109   68.297   5.3306 2.893021 6.918943 
1 1 1    9   33   10 o   40.251   4.8447   35.568   7.8454   37.516   10.930   33.497   11.268   41.799   6.3397   38.703   7.3274 3.095993 9.689321 
1 1 1    9   33   11 o   80.817   3.0895  133.737   10.159  114.471   13.143  162.331   16.012   73.795   4.3182   87.838   4.4197 -14.04326 6.179071 
1 1 1    9   33   12 o   47.848   4.2965   46.376   8.2142   34.036   10.415   66.681   13.360   39.801   6.3448   55.895   5.7952 -16.09441 8.593062 
1 1 1    9   33   13 o   26.954   5.5567   14.084   7.1755   4.7155   9.3836   27.276   11.135   19.328   7.7442   34.580   7.9707 -15.25254 11.11332 
1 1 1    9   33   14 o   35.553   5.4037   27.943   7.6090   23.671   9.8624   34.226   11.960   32.253   7.5477   38.854   7.7352 -6.600990 10.80746 
1 1 1    9   33   15 f   40.890   4.9040   37.471   7.8624   39.799   10.269   34.173   12.222   43.083   5.7791   38.697   7.9247 4.386318 9.808067 
1 1 1    9   33   16 o   65.797   3.7166   92.134   10.064   90.180   13.725   94.406   14.800   65.101   5.1116   66.492   5.3967 -1.390755 7.433182 
1 1 1    9   33   17 o   37.214   5.2703   36.828   8.0753   53.429   10.348   10.979   12.913   50.088   5.0093   24.339   9.2742 25.74906 10.54054 
1 1 1    9   33   18 o   35.614   6.2144   31.946   9.8350   15.589   15.793   42.308   12.570   27.416   10.300   43.811   6.9564 -16.39519 12.42889 
1 1 1    9   33   19 o   59.044   4.6325   76.700   11.081   75.338   17.236   77.660   14.468   58.240   7.1753   59.848   5.8613 -1.607170 9.264957 
1 1 1    9   33   20 o   54.656   4.0087   64.826   8.9366   65.666   11.855   63.720   13.601   55.274   5.2000   54.038   6.1024 1.236328 8.017458 
1 1 1    9   33   21 f   27.994   6.0608   18.475   7.6098   18.337   10.073   18.659   11.615   27.897   8.2062   28.091   8.9213 -0.1937466 12.12154 
1 1 1    9   33   22 o   40.532   7.3010   46.230   10.822   49.388   11.792   29.358   27.255   47.367   6.0359   33.697   13.296 13.67067 14.60200 
1 1 1    9   33   23 o   29.206   8.3304   13.755   17.550   34.261   23.261 -13.3425   26.740   35.319   12.622   23.093   10.875 12.22541 16.66078 
1 1 1    9   33   24 o   33.902   10.094   25.906   22.585   46.234   39.994   16.387   27.367   38.198   15.733   29.607   12.649 8.591516 20.18713 
1 1 1    9   33   25 o   32.370   9.7382   22.726   20.138   16.549   23.228   41.418   40.409   28.425   11.872   36.315   15.439 -7.890770 19.47631 
1 1 1    9   33   26 o   75.157   6.7874  142.620   20.623  152.965   27.595  129.533   31.038   79.855   8.3786   70.460   10.681 9.394623 13.57477 
1 1 1    9   33   27 o   21.640   7.2804 -14.9429   17.993  -5.7068   23.464 -28.1257   28.033   22.464   10.451   20.816   10.139 1.648260 14.56073 
1 1 1    9   33   28 o   19.958   6.9260 -33.8194   18.147 -50.3825   23.204  -7.7384   29.118   16.144   8.0939   23.771   11.241 -7.626932 13.85206 
1 1 1    9   33   29 o   33.354   9.0195   30.370   19.794   0.3189   27.215   64.121   28.841   24.181   11.251   42.528   14.101 -18.34693 18.03909 
1 1 1    9   33   30 o   19.651   6.7900 -24.4689   18.036 -17.5681   22.954 -35.6039   29.158   19.560   9.4433   19.743   9.7591 -0.1831627 13.57999 
1 1 1    9   34    0 o   14.455   5.7781   5.9939   7.4813   5.9939   7.4813   5.9939   7.4813   14.455   8.1715   14.455   8.1715 0.000000 0.000000 
1 1 1    9   34    1 o   35.365   3.3712   26.723   4.8335   31.887   6.7845   21.401   6.8878   38.966   4.2215   31.765   5.2574 7.201296 6.742476 
1 1 1    9   34    2 o   29.330   5.6903   19.551   7.0906   19.607   9.9578   19.493   10.099   29.374   8.0020   29.285   8.0922 0.8926201E-01 11.38051 
1 1 1    9   34    3 o   59.338   3.1135   68.854   7.2248   91.084   12.975   58.865   8.6979   65.683   4.7896   52.994   3.9795 12.68902 6.227054 
1 1 1    9   34    4 o   83.125   2.8932  148.845   9.1843  134.143   15.963  156.121   11.229   79.684   4.8571   86.566   3.1451 -6.882263 5.786436 
1 1 1    9   34    5 o   25.672   5.0451   14.831   4.9479   12.931   10.703   15.348   5.5800   24.883   8.5876   26.461   5.2976 -1.578508 10.09015 
1 1 1    9   34    6 o   26.431   5.9646   15.095   7.2369   17.598   11.378   13.395   9.3782   28.035   8.8216   24.827   8.0302 3.207661 11.92913 
1 1 1    9   34    7 o   23.016   6.9806   2.7865   11.210   3.1362   13.557   2.0303   19.937   21.395   9.0113   24.636   10.664 -3.240173 13.96122 
1 1 1    9   34    8 o   24.080   5.5054   11.510   6.8053   3.5870   9.6132   19.469   9.6352   18.904   7.7410   29.257   7.8303 -10.35352 11.01075 
1 1 1    9   34    9 f   47.473   4.2716   49.254   8.1470   53.452   10.708   43.486   12.554   50.167   5.1753   44.780   6.7972 5.386749 8.543134 
1 1 1    9   34   10 o   56.473   3.4980   68.859   7.9358   74.413   10.403   61.128   12.273   59.453   4.2424   53.494   5.5629 5.959202 6.995974 
1 1 1    9   34   11 o   51.199   5.3128   54.154   10.127   66.319   19.709   49.791   11.804   54.263   8.8064   48.136   5.9456 6.127121 10.62561 
1 1 1    9   34   12 f   58.629   5.2782   74.226   11.639   79.210   21.595   72.186   13.817   59.250   8.8368   58.009   5.7750 1.240208 10.55650 
1 1 1    9   34   13 o   29.661   6.8876   14.139   9.1146   35.722   18.275   6.9932   10.516   38.169   11.004   21.153   8.2861 17.01591 13.77513 
1 1 1    9   34   14 o   23.828   6.6948  -2.4454   8.6775   27.661   19.876  -9.5353   9.6452   33.861   11.702   13.796   6.5074 20.06455 13.38951 
1 1 1    9   34   15 o   73.391   5.2038  124.958   13.690  107.326   25.682  131.956   16.180   68.181   9.1328   78.601   4.9910 -10.42036 10.40759 
1 1 1    9   34   16 o   54.222   6.5540   66.219   11.765   74.482   25.346   63.949   13.283   54.166   11.688   54.278   5.9332 -0.1122856 13.10802 
1 1 1    9   34   17 o   67.810   5.5240   95.406   13.756  123.609   27.613   86.097   15.864   72.802   9.1960   62.817   6.1233 9.985630 11.04809 
1 1 1    9   34   18 o   26.368   5.5905   16.660   6.6387   19.323   8.1994   11.592   11.311   28.970   6.9511   23.765   8.7578 5.205462 11.18104 
1 1 1    9   34   19 o   36.195   4.9090   25.932   7.1691   11.066   8.8438   54.423   12.243   22.550   7.8049   49.840   5.9561 -27.28964 9.817946 
1 1 1    9   34   20 o   28.908   7.6960   18.286   10.599   20.775   25.059   17.744   11.697   30.552   12.503   27.265   8.9767 3.287924 15.39197 
1 1 1    9   34   21 o   40.011   7.4833   41.571   11.209   38.071   25.711   42.393   12.455   36.644   13.249   43.378   6.9619 -6.734192 14.96668 
1 1 1    9   34   22 o   28.811   8.7303   14.578   18.529   13.289   25.869   15.937   26.554   28.374   12.215   29.248   12.477 -0.8738136 17.46062 
1 1 1    9   34   23 o   36.306   8.6634   37.583   17.628   56.283   23.183   11.951   27.142   44.626   12.232   27.987   12.272 16.63954 17.32689 
1 1 1    9   34   24 o   38.712   9.2323   46.999   18.202   55.411   23.817   35.187   28.223   43.292   12.586   34.133   13.510 9.159409 18.46454 
1 1 1    9   34   25 o   29.167   8.6029   20.462   17.229   24.010   21.614   14.281   28.532   30.111   11.853   28.224   12.472 1.886354 17.20588 
1 1 1    9   34   26 o   28.507   8.6021   17.531   17.453   10.487   22.281   28.716   28.078   25.570   11.168   31.444   13.086 -5.874458 17.20419 
1 1 1    9   34   27 o   27.272   7.9272   9.1376   17.961   39.363   23.085 -37.2285   28.592   34.988   12.566   19.557   9.6666 15.43100 15.85431 
1 1 1    9   34   28 o   30.517   9.2071   29.330   20.486   33.251   24.084   19.072   38.958   32.036   12.543   28.998   13.482 3.037260 18.41415 
1 1 1    9   35    0 o  106.496   2.0687  235.579   12.828  235.579   12.828  235.579   12.828  106.496   2.9255  106.496   2.9255 0.000000 0.000000 
1 1 1    9   35    1 o   53.184   3.0057   61.085   6.1372   64.118   7.5412   55.137   10.561   55.408   3.2999   50.960   5.0248 4.448074 6.011484 
1 1 1    9   35    2 f   78.413   2.8209  126.782   8.4450  135.540   15.357  122.986   10.111   80.059   4.6509   76.767   3.1934 3.292885 5.641737 
1 1 1    9   35    3 o   28.473   4.8060   16.411   5.0961   23.291   9.8880   13.922   5.9467   31.941   7.6136   25.005   5.8672 6.935970 9.612025 
1 1 1    9   35    4 o   98.914   2.9709  205.787   12.061  208.203   18.010  203.822   16.240   99.344   4.3954   98.484   3.9981 0.8597641 5.941770 
1 1 1    9   35    5 o   87.184   3.6269  163.464   12.271  156.071   20.999  167.298   15.122   85.195   5.9760   89.172   4.1117 -3.977730 7.253897 
1 1 1    9   35    6 o   49.004   3.8546   51.221   7.7832   49.691   10.724   52.923   11.314   48.251   5.3887   49.757   5.5131 -1.505302 7.709231 
1 1 1    9   35    7 o   52.706   5.6800   58.937   11.611   53.745   13.967   70.556   20.892   49.661   6.8188   55.752   9.0858 -6.090401 11.35991 
1 1 1    9   35    8 o   46.194   3.8463   45.088   7.2679   41.586   9.5623   49.880   11.184   44.151   5.2511   48.237   5.6215 -4.085831 7.692570 
1 1 1    9   35    9 o   48.210   5.7729   52.650   10.638   52.929   17.949   52.498   13.208   47.310   9.5279   49.109   6.5211 -1.798973 11.54581 
1 1 1    9   35   10 o   92.838   4.9393  191.457   18.683  216.855   25.926  164.016   26.948   99.856   6.2949   85.821   7.6132 14.03525 9.878635 
1 1 1    9   35   11 o   51.125   5.3855   54.010   10.460   70.386   19.861   47.724   12.305   55.493   8.6777   46.757   6.3805 8.736744 10.77099 
1 1 1    9   35   12 o   70.285   4.9347  108.816   13.057  110.116   23.842  108.259   15.605   69.597   8.3059   70.973   5.3309 -1.376198 9.869428 
1 1 1    9   35   13 o   59.479   6.2909   91.485   12.376   62.575   23.038  103.212   14.673   49.591   11.489   69.368   5.1286 -19.77711 12.58172 
1 1 1    9   35   14 o   23.297   7.4353  -3.2897   14.599  -6.6246   18.361   2.4432   24.074   20.807   9.5221   25.787   11.422 -4.979832 14.87055 
1 1 1    9   35   15 o   34.692   8.1141   28.407   11.403   0.0000   0.0000   28.407   11.403  ?   ?    34.692   8.1141      ?      ? 
1 1 1    9   35   16 f   21.538   6.4009   5.1197   9.6222 -18.8812   21.879   10.875   10.714   20.056   9.5588   23.020   8.5158 -2.964056 12.80189 
1 1 1    9   35   17 o   34.318   6.8842   33.456   11.120   10.402   22.206   41.172   12.847   26.717   11.404   41.920   7.7148 -15.20292 13.76839 
1 1 1    9   35   18 o   45.362   7.3462   43.647   11.237   71.399   25.812   37.157   12.482   51.088   12.380   39.635   7.9127 11.45311 14.69237 
1 1 1    9   35   19 o   20.547   6.3378   2.5700   9.6472 -18.6169   22.015   7.6056   10.733   20.001   9.5478   21.094   8.3371 -1.093281 12.67554 
1 1 1    9   35   20 o   26.088   6.8468   15.798   10.635 -12.8219   24.631   22.356   11.791   22.103   10.418   30.073   8.8877 -7.970387 13.69368 
1 1 1    9   35   21 o   21.047   6.8078  -0.2452   9.9834   0.6500   25.115  -0.4132   10.880   24.655   11.226   17.440   7.7041 7.214710 13.61560 
1 1 1    9   35   22 o   24.533   7.8640  -7.7412   17.976 -31.4344   23.896   23.144   27.283   18.669   9.1504   30.397   12.792 -11.72779 15.72793 
1 1 1    9   35   23 o   48.216   7.0480   53.734   14.016   0.0000   0.0000   53.734   14.016  ?   ?    48.216   7.0480      ?      ? 
1 1 1    9   35   24 o   26.173   8.6261   1.9357   18.588  -3.6631   20.985   22.332   40.053   21.639   10.003   30.707   14.057 -9.067812 17.25226 
1 1 1    9   35   25 o   25.308   7.9737   9.6909   16.785   13.284   21.258   3.7408   27.354   25.720   11.072   24.897   11.477 0.8230896 15.94749 
1 1 1    9   35   26 o   23.364   7.5858   2.0929   16.794   8.5138   21.191  -8.7505   27.538   24.152   10.706   22.575   10.750 1.577015 15.17160 
1 1 1    9   36    0 o  116.093   2.0118  280.015   13.605  280.015   13.605  280.015   13.605  116.093   2.8451  116.093   2.8451 0.000000 0.000000 
1 1 1    9   36    1 o   21.202   6.0352   6.3526   7.4488   6.3478   8.7379   6.3655   14.248   19.653   7.5934   22.750   9.3827 -3.096903 12.07036 
1 1 1    9   36    2 f   57.771   3.1425   69.038   6.9023   75.251   12.690   66.428   8.2255   59.285   5.1897   56.256   3.5451 3.028866 6.284966 
1 1 1    9   36    3 o   25.736   4.9311   15.433   5.0848   13.049   9.6631   16.346   5.9796   24.350   8.1640   27.122   5.5329 -2.771343 9.862299 
1 1 1    9   36    4 f   32.737   5.0123   27.879   5.7312   16.620   12.123   31.120   6.5039   27.095   9.1440   38.380   4.1087 -11.28570 10.02463 
1 1 1    9   36    5 o   34.145   4.9567   26.873   6.8642   35.584   9.6204   17.840   9.7970   40.567   5.7498   27.723   8.0757 12.84463 9.913494 
1 1 1    9   36    6 o   63.868   3.8159   90.450   9.6836   66.760   14.159  111.267   13.273   55.337   6.2038   72.399   4.4450 -17.06207 7.631869 
1 1 1    9   36    7 o   33.071   11.720   26.716   20.016   0.0000   0.0000   26.716   20.016  ?   ?    33.071   11.720      ?      ? 
1 1 1    9   36    8 o   76.632   4.0566  119.822   11.939  148.143   22.059  108.091   14.198   82.131   6.5121   71.133   4.8393 10.99738 8.113297 
1 1 1    9   36    9 o   22.225   6.2980   7.8343   8.2402   5.5219   15.606   8.7282   9.7031   22.954   9.6681   21.497   8.0739 1.456371 12.59606 
1 1 1    9   36   10 o   52.047   5.3200   56.717   10.422   71.810   20.006   51.096   12.209   55.741   8.7022   48.353   6.1221 7.388168 10.63995 
1 1 1    9   36   11 o   48.381   6.2778   62.495   10.701   38.629   19.277   73.125   12.865   38.585   11.353   58.178   5.3615 -19.59307 12.55560 
1 1 1    9   36   12 o   54.763   5.4693   65.763   11.590   76.097   20.771   61.091   13.966   56.974   8.8394   52.551   6.4436 4.422539 10.93868 
1 1 1    9   36   13 o   27.728   7.0939   15.692   9.1114   24.387   19.097   13.129   10.367   31.241   11.399   24.215   8.4467 7.026430 14.18779 
1 1 1    9   36   14 o   24.331   7.5720   3.3997   14.952   9.6682   19.517  -5.5058   23.263   25.567   10.793   23.094   10.624 2.472881 15.14406 
1 1 1    9   36   15 o   30.578   8.6496   22.775   11.397   0.0000   0.0000   22.775   11.397  ?   ?    30.578   8.6496      ?      ? 
1 1 1    9   36   16 o   32.975   7.6744   25.722   10.627   33.784   22.729   23.467   12.022   35.068   12.482   30.882   8.9317 4.185160 15.34879 
1 1 1    9   36   17 o   40.888   7.7495   41.112   12.099   53.017   23.942   37.028   14.022   43.058   12.648   38.717   8.9585 4.341541 15.49908 
1 1 1    9   36   18 o   35.935   7.6557   34.081   11.131   34.518   24.404   33.966   12.508   34.577   12.840   37.292   8.3412 -2.715157 15.31149 
1 1 1    9   36   19 o   22.221   6.5996   7.2352   10.199 -16.7376   23.651   12.712   11.305   20.675   9.8772   23.766   8.7557 -3.091049 13.19926 
1 1 1    9   36   20 o   96.252   5.1902  221.566   18.102  199.236   33.552  230.734   21.500   89.855   9.0535  102.649   5.0782 -12.79404 10.38042 
1 1 1    9   36   21 o   30.404   7.2285   26.632   11.410   5.0697   26.010   31.771   12.697   25.401   11.511   35.407   8.7462 -10.00509 14.45699 
1 1 1    9   36   22 o   55.665   7.4099   96.292   13.974   57.202   27.260  110.226   16.275   41.156   13.712   70.175   5.6231 -29.01922 14.81984 
1 1 1    9   36   23 o   51.622   6.8981   62.496   14.687   0.0000   0.0000   62.496   14.687  ?   ?    51.622   6.8981      ?      ? 
1 1 1    9   36   24 o   21.937   6.9304   5.3557   11.346  -5.5660   26.392   7.8322   12.567   22.708   10.727   21.165   8.7773 1.543255 13.86072 
1 1 1    9   37    0 o   17.745   8.3515  -1.9762   23.274  -1.9762   23.274  -1.9762   23.274   17.745   11.811   17.745   11.811 0.000000 0.000000 
1 1 1    9   37    1 o   16.879   4.5078   5.0187   4.2454   1.2909   7.8398   6.5654   5.0499   16.071   6.8152   17.687   5.9020 -1.616089 9.015518 
1 1 1    9   37    2 o   51.723   5.1167   65.322   9.5569   78.752   12.196   43.954   15.384   60.624   4.8775   42.821   8.9963 17.80301 10.23346 
1 1 1    9   37    3 o   34.723   4.9150   28.545   5.6387   24.930   12.243   29.518   6.3525   32.136   8.9212   37.310   4.1282 -5.174114 9.830064 
1 1 1    9   37    4 o   47.768   4.1225   49.892   8.0941   46.753   11.653   52.818   11.251   46.180   6.1183   49.355   5.5269 -3.174484 8.245059 
1 1 1    9   37    5 o   26.094   5.3822   15.620   6.2118   12.325   8.4711   19.452   9.1361   23.395   7.6364   28.793   7.5868 -5.397923 10.76449 
1 1 1    9   37    6 o   21.081   5.7122   2.5787   7.0932   18.588   12.824  -4.4779   8.5142   27.988   9.4049   14.174   6.4856 13.81373 11.42437 
1 1 1    9   37    7 o   29.879   11.429   20.926   19.660   0.0000   0.0000   20.926   19.660  ?   ?    29.879   11.429      ?      ? 
1 1 1    9   37    8 o   20.603   5.0716   4.2941   7.5608 -27.9254   13.752   18.252   9.0516   13.438   6.6535   27.769   7.6561 -14.33033 10.14319 
1 1 1    9   37    9 f   34.865   6.5846   29.319   9.0302   32.403   16.843   28.075   10.698   35.299   10.667   34.431   7.7233 0.8680992 13.16927 
1 1 1    9   37   10 o   20.609   6.2078  -0.3695   8.1283   14.653   16.697  -5.0354   9.3054   26.550   10.429   14.668   6.7370 11.88210 12.41562 
1 1 1    9   37   11 o   34.049   6.8592   29.680   9.8152   26.252   17.799   31.179   11.766   31.986   11.073   36.113   8.0990 -4.127850 13.71839 
1 1 1    9   37   12 o   27.567   7.0138   15.180   9.5992   27.382   17.521   9.9468   11.474   32.499   10.993   22.636   8.7138 9.863789 14.02759 
1 1 1    9   37   13 o   27.318   6.8956   8.8358   9.5372   37.160   19.124  -0.5410   11.003   37.047   11.401   17.590   7.7602 19.45609 13.79112 
1 1 1    9   37   14 o   55.304   8.0386   81.698   17.642   83.233   23.799   79.826   26.286   56.804   10.547   53.803   12.134 3.000595 16.07714 
1 1 1    9   37   15 o   28.468   8.8799   20.188   11.558   0.0000   0.0000   20.188   11.558  ?   ?    28.468   8.8799      ?      ? 
1 1 1    9   37   16 o   32.161   7.1572   28.928   10.649   17.956   21.999   32.286   12.171   28.159   11.640   36.163   8.3313 -8.004396 14.31433 
1 1 1    9   37   17 o   24.691   6.8427   13.327   10.423  -2.4886   21.434   18.225   11.928   22.341   10.248   27.041   9.0704 -4.699427 13.68535 
1 1 1    9   37   18 o   23.034   7.0324   1.5073   9.5461   24.167   22.634  -3.3954   10.528   30.067   12.035   16.001   7.2792 14.06667 14.06478 
1 1 1    9   37   19 f   34.441   7.1553   36.119   11.372   17.472   24.671   41.150   12.814   27.858   11.959   41.024   7.8596 -13.16536 14.31053 
1 1 1    9   37   20 o   29.263   7.5067   23.403   11.025   21.362   22.917   24.018   12.575   28.453   11.831   30.074   9.2432 -1.621408 15.01333 
1 1 1    9   37   21 o   37.102   7.8597   40.237   12.181   41.829   24.851   39.734   13.975   35.133   12.975   39.070   8.8743 -3.937149 15.71946 
1 1 1    9   37   22 o   23.837   6.5808   12.128   11.180 -27.4849   24.986   22.044   12.501   19.049   9.3406   28.626   9.2726 -9.577160 13.16156 
1 1 1    9   38    1 o   34.846   7.6785   27.543   9.6797   25.694   10.463   38.526   25.498   32.854   7.8321   36.838   13.210 -3.984379 15.35694 
1 1 1    9   38    2 o   27.057   6.5057   18.722   9.8528   25.488   10.665 -20.7165   25.747   32.641   7.9869   21.474   10.272 11.16697 13.01140 
1 1 1    9   38    3 o   33.374   7.1709   31.812   11.138   36.970   12.214   6.3353   27.147   39.623   7.7514   27.126   12.067 12.49738 14.34179 
1 1 1    9   38    4 o   36.114   8.5956   31.699   12.618   31.699   12.618   0.0000   0.0000   36.114   8.5956  ?   ?       ?      ? 
1 1 1    9   38    5 o   30.545   5.7028   20.029   7.6029   35.722   12.407   10.594   9.6208   38.740   8.0289   22.350   8.1009 16.39013 11.40556 
1 1 1    9   38    6 o   34.814   5.4634   23.122   8.2350   52.958   14.448   8.7659   10.022   48.243   7.2614   21.385   8.1651 26.85776 10.92687 
1 1 1    9   38    7 o   15.357   6.9016  -2.5656   9.1269   0.0000   0.0000  -2.5656   9.1269  ?   ?    15.357   6.9016      ?      ? 
1 1 1    9   38    8 o   33.567   6.3715   28.085   8.6546   27.265   15.442   28.460   10.450   32.472   10.284   34.663   7.5253 -2.191200 12.74305 
1 1 1    9   38    9 o   21.411   6.2190   6.4718   8.1891   9.5140   14.969   5.1723   9.7830   23.607   9.6625   19.215   7.8319 4.392653 12.43792 
1 1 1    9   38   10 o   31.942   6.8689   27.181   9.9539   20.349   17.516   30.440   12.097   28.715   10.835   35.169   8.4460 -6.453489 13.73787 
1 1 1    9   38   11 o   20.945   6.3401   3.5445   8.5497   10.580   17.144   1.2154   9.8638   24.559   10.224   17.330   7.5011 7.228481 12.68029 
1 1 1    9   38   12 o   29.980   6.9292   23.739   9.7260   19.101   18.062   25.633   11.542   27.977   10.887   31.982   8.5747 -4.005375 13.85835 
1 1 1    9   38   13 o   23.916   6.5411   12.474   9.3409   0.0780   18.749   16.567   10.773   21.826   9.8427   26.006   8.6176 -4.180332 13.08212 
1 1 1    9   38   14 o   34.842   7.4315   33.001   15.356   59.110   19.784  -6.5682   24.355   47.080   10.460   22.603   10.559 24.47659 14.86306 
1 1 1    9   38   15 o   26.912   8.9363   18.248   11.582   0.0000   0.0000   18.248   11.582  ?   ?    26.912   8.9363      ?      ? 
1 1 1    9   38   16 o   18.056   6.0087  -5.4734   9.3047  -5.8112   20.518  -5.3859   10.440   20.902   9.7399   15.210   7.0394 5.691818 12.01740 
1 1 1    9   38   17 f   52.179   6.7371   65.005   12.174   84.143   25.265   59.218   13.893   53.866   11.707   50.492   6.6714 3.373764 13.47418 
1 1 1    9   38   18 o   27.091   6.6833   20.461   10.857  -8.2279   23.047   28.643   12.308   21.179   10.011   33.004   8.8570 -11.82512 13.36652 
1 1 1    9   38   19 o   34.321   7.9118   34.868   12.212   36.294   24.287   34.385   14.128   33.022   12.686   35.621   9.4577 -2.598804 15.82366 
1 1 1    9   39    9 o   38.683   9.2682   41.386   15.727   34.547   18.065   62.795   31.963   35.060   11.125   42.305   14.827 -7.245029 18.53632 
1 1 1    9   39   10 o   48.869   9.4046   69.439   17.448   64.366   19.842   86.742   36.648   49.482   10.065   48.256   15.890 1.225639 18.80923 
1 1 1    9   39   11 o   31.552   8.8133   28.960   16.093   30.671   17.984   22.082   36.056   32.787   11.137   30.317   13.663 2.469742 17.62663 
1 1 1    9   39   12 o   30.928   8.4010   28.923   17.082   38.908   19.313  -6.9564   36.611   36.252   11.503   25.604   12.247 10.64855 16.80209 
1 1 1    9   39   13 o   28.677   8.9053   16.227   16.909   10.063   19.026   39.392   36.882   24.224   10.451   33.129   14.422 -8.904276 17.81062 
1 1 1    9   39   14 o   35.023   9.5169   42.999   19.018   43.679   21.887   40.904   38.420   37.016   12.284   33.029   14.539 3.987640 19.03384 
1 1 1    9   39   15 o   19.971   10.033 -62.0320   36.584   0.0000   0.0000 -62.0320   36.584  ?   ?    19.971   10.033      ?      ? 
1 1 1    9   39   16 o   29.944   9.2589   22.826   19.393   14.152   22.627   46.836   37.646   25.911   11.288   33.976   14.680 -8.064667 18.51788 
1 1 1   10    0    0 o  596.250   5.9768  7342.40  207.769  7342.40  207.769  7342.40  207.769  596.250   8.4525  596.250   8.4525 0.000000 0.000000 
1 1 1   10    0    1 o  251.307   2.3003  1303.39   33.706  1303.39   33.706  1303.39   33.706  251.307   3.2531  251.307   3.2531 0.000000 0.000000 
1 1 1   10    0    2 o   54.307   2.2977   61.485   7.2186   61.485   7.2186   61.485   7.2186   54.307   3.2495   54.307   3.2495 0.000000 0.000000 
1 1 1   10    0    3 o   26.223   4.6073   16.561   6.0984   16.561   6.0984   16.561   6.0984   26.223   6.5158   26.223   6.5158 0.000000 0.000000 
1 1 1   10    0    4 o  135.838   2.2428  381.227   17.748  381.227   17.748  381.227   17.748  135.838   3.1717  135.838   3.1717 0.000000 0.000000 
1 1 1   10    0    5 f  182.530   2.0578  687.712   21.896  687.712   21.896  687.712   21.896  182.530   2.9102  182.530   2.9102 0.000000 0.000000 
1 1 1   10    0    6 o  272.744   2.4298  1535.12   38.641  1535.12   38.641  1535.12   38.641  272.744   3.4363  272.744   3.4363 0.000000 0.000000 
1 1 1   10    0    7 o   87.808   2.1100  159.575   10.778  159.575   10.778  159.575   10.778   87.808   2.9840   87.808   2.9840 0.000000 0.000000 
1 1 1   10    0    8 o  241.268   2.2968  1201.24   32.309  1201.24   32.309  1201.24   32.309  241.268   3.2482  241.268   3.2482 0.000000 0.000000 
1 1 1   10    0    9 o  129.625   3.0633  347.753   23.102  347.753   23.102  347.753   23.102  129.625   4.3321  129.625   4.3321 0.000000 0.000000 
1 1 1   10    0   10 o  233.917   3.3053  1130.10   45.057  1130.10   45.057  1130.10   45.057  233.917   4.6744  233.917   4.6744 0.000000 0.000000 
1 1 1   10    0   11 o  367.639   3.4500  2789.66   73.951  2789.66   73.951  2789.66   73.951  367.639   4.8790  367.639   4.8790 0.000000 0.000000 
1 1 1   10    0   12 o  478.394   5.0770  4726.12  141.596  4726.12  141.596  4726.12  141.596  478.394   7.1799  478.394   7.1799 0.000000 0.000000 
1 1 1   10    0   13 o  148.368   2.7089  454.970   23.408  454.970   23.408  454.970   23.408  148.368   3.8310  148.368   3.8310 0.000000 0.000000 
1 1 1   10    0   14 o  499.439   4.2836  5149.23  124.746  5149.23  124.746  5149.23  124.746  499.439   6.0579  499.439   6.0579 0.000000 0.000000 
1 1 1   10    0   15 o  398.116   3.1323  3270.84   72.717  3270.84   72.717  3270.84   72.717  398.116   4.4297  398.116   4.4297 0.000000 0.000000 
1 1 1   10    0   16 o  524.891   5.4492  5691.86  166.753  5691.86  166.753  5691.86  166.753  524.891   7.7064  524.891   7.7064 0.000000 0.000000 
1 1 1   10    0   18 o  180.894   2.8387  676.087   29.919  676.087   29.919  676.087   29.919  180.894   4.0146  180.894   4.0146 0.000000 0.000000 
1 1 1   10    0   19 o   69.555   4.1580  101.990   16.592  101.990   16.592  101.990   16.592   69.555   5.8803   69.555   5.8803 0.000000 0.000000 
1 1 1   10    0   20 o   72.228   4.3122  109.990   17.869  109.990   17.869  109.990   17.869   72.228   6.0983   72.228   6.0983 0.000000 0.000000 
1 1 1   10    0   21 o   16.535   7.4955   0.6115   16.356   0.6115   16.356   0.6115   16.356   16.535   10.600   16.535   10.600 0.000000 0.000000 
1 1 1   10    0   22 o   23.942   9.0220   17.077   17.105   17.077   17.105   17.077   17.105   23.942   12.759   23.942   12.759 0.000000 0.000000 
1 1 1   10    0   23 o   13.046   6.3782 -13.2805   16.492 -13.2805   16.492 -13.2805   16.492   13.046   9.0202   13.046   9.0202 0.000000 0.000000 
1 1 1   10    0   24 o   21.511   9.2193   9.0508   21.408   9.0508   21.408   9.0508   21.408   21.511   13.038   21.511   13.038 0.000000 0.000000 
1 1 1   10    0   25 o  109.541   3.3971  249.199   21.610  249.199   21.610  249.199   21.610  109.541   4.8043  109.541   4.8043 0.000000 0.000000 
1 1 1   10    0   26 o  115.085   3.3337  274.904   22.293  274.904   22.293  274.904   22.293  115.085   4.7146  115.085   4.7146 0.000000 0.000000 
1 1 1   10    0   27 o  210.443   3.6542  916.625   44.793  916.625   44.793  916.625   44.793  210.443   5.1678  210.443   5.1678 0.000000 0.000000 
1 1 1   10    0   28 o   11.578   5.8756 -31.2418   18.900 -31.2418   18.900 -31.2418   18.900   11.578   8.3094   11.578   8.3094 0.000000 0.000000 
1 1 1   10    0   29 f  237.639   2.8506  1167.10   39.487  1167.10   39.487  1167.10   39.487  237.639   4.0313  237.639   4.0313 0.000000 0.000000 
1 1 1   10    0   30 o  246.743   3.2361  1259.01   46.538  1259.01   46.538  1259.01   46.538  246.743   4.5765  246.743   4.5765 0.000000 0.000000 
1 1 1   10    0   31 o   56.876   7.4819   73.790   22.299   73.790   22.299   73.790   22.299   56.876   10.581   56.876   10.581 0.000000 0.000000 
1 1 1   10    0   32 o   22.845   9.5190   12.693   21.629   12.693   21.629   12.693   21.629   22.845   13.462   22.845   13.462 0.000000 0.000000 
1 1 1   10    0   33 o   21.952   9.8814   3.5197   27.816   3.5197   27.816   3.5197   27.816   21.952   13.974   21.952   13.974 0.000000 0.000000 
1 1 1   10    0   34 o   40.177   10.942   46.397   24.297   46.397   24.297   46.397   24.297   40.177   15.475   40.177   15.475 0.000000 0.000000 
1 1 1   10    0   35 o  175.026   4.3423  638.246   44.206  638.246   44.206  638.246   44.206  175.026   6.1409  175.026   6.1409 0.000000 0.000000 
1 1 1   10    0   36 o  139.411   6.2375  412.409   50.255  412.409   50.255  412.409   50.255  139.411   8.8211  139.411   8.8211 0.000000 0.000000 
1 1 1   10    0   37 o   49.830   10.070   64.417   25.368   64.417   25.368   64.417   25.368   49.830   14.241   49.830   14.241 0.000000 0.000000 
1 1 1   10    0   38 o  125.252   4.0384  328.630   29.364  328.630   29.364  328.630   29.364  125.252   5.7112  125.252   5.7112 0.000000 0.000000 
1 1 1   10    0   39 o   67.997   7.2495  105.045   26.821  105.045   26.821  105.045   26.821   67.997   10.252   67.997   10.252 0.000000 0.000000 
1 1 1   10    0   40 o   56.629   8.6742   77.951   25.122   77.951   25.122   77.951   25.122   56.629   12.267   56.629   12.267 0.000000 0.000000 
1 1 1   10    0   41 o   31.012   11.529   32.687   27.638   32.687   27.638   32.687   27.638   31.012   16.305   31.012   16.305 0.000000 0.000000 
1 1 1   10    0   42 o   34.794   10.966   39.522   23.607   39.522   23.607   39.522   23.607   34.794   15.509   34.794   15.509 0.000000 0.000000 
1 1 1   10    0   43 o   27.800   11.038   26.404   27.054   26.404   27.054   26.404   27.054   27.800   15.610   27.800   15.610 0.000000 0.000000 
1 1 1   10    0   44 o   30.756   10.840   33.168   23.635   33.168   23.635   33.168   23.635   30.756   15.331   30.756   15.331 0.000000 0.000000 
1 1 1   10    0   45 o   28.535   10.476   29.187   22.604   29.187   22.604   29.187   22.604   28.535   14.815   28.535   14.815 0.000000 0.000000 
1 1 1   10    0   46 o   21.156   9.2069   12.363   22.091   12.363   22.091   12.363   22.091   21.156   13.021   21.156   13.021 0.000000 0.000000 
1 1 1   10    0   47 o   14.897   7.4757 -28.1475   27.456 -28.1475   27.456 -28.1475   27.456   14.897   10.572   14.897   10.572 0.000000 0.000000 
1 1 1   10    0   48 o   15.340   7.6754 -24.9233   28.210 -24.9233   28.210 -24.9233   28.210   15.340   10.855   15.340   10.855 0.000000 0.000000 
1 1 1   10    0   49 o   16.010   8.1342 -42.2258   36.674 -42.2258   36.674 -42.2258   36.674   16.010   11.503   16.010   11.503 0.000000 0.000000 
1 1 1   10    1    0 o  758.991   5.2388 11899.18  231.875 11899.18  231.875 11899.18  231.875  758.991   7.4087  758.991   7.4087 0.000000 0.000000 
1 1 1   10    1    1 o   23.226   4.1015   11.642   3.9764   8.7166   5.6891   14.436   5.5602   20.490   6.2011   25.962   5.3698 -5.472639 8.202933 
1 1 1   10    1    2 o  232.066   2.2165  1110.89   21.212  1097.91   29.689  1124.42   30.317  230.682   3.1204  233.451   3.1487 -2.768265 4.432973 
1 1 1   10    1    3 o   65.257   2.1616   87.859   5.8176   87.129   8.2291   88.587   8.2257   64.986   3.0702   65.528   3.0436 -0.5417328 4.323100 
1 1 1   10    1    4 o  257.222   2.3353  1365.06   24.775  1367.12   35.067  1363.02   35.007  257.415   3.3029  257.029   3.3023 0.3862000 4.670560 
1 1 1   10    1    5 o  358.781   2.8459  2655.90   42.108  2635.77   58.991  2676.80   60.124  357.397   4.0019  360.165   4.0474 -2.768219 5.691845 
1 1 1   10    1    6 o  334.318   2.7213  2305.94   37.521  2292.69   52.704  2319.55   53.427  333.345   3.8334  335.291   3.8635 -1.946106 5.442564 
1 1 1   10    1    7 o  349.417   2.8061  2517.68   40.421  2480.83   56.136  2557.35   58.249  346.765   3.9250  352.069   4.0114 -5.303986 5.612260 
1 1 1   10    1    8 o  406.685   3.1196  3412.20   52.322  3394.46   73.479  3430.44   74.522  405.613   4.3922  407.756   4.4312 -2.142639 6.239153 
1 1 1   10    1    9 o  614.138   4.3441  7785.61  110.036  7781.53  155.477  7789.70  155.752  613.978   6.1397  614.299   6.1474 -0.3212891 8.688286 
1 1 1   10    1   10 o  528.277   3.9963  5729.67   83.351  5866.40  140.615  5655.60  103.493  533.042   6.3959  523.513   4.7931 9.528870 7.992601 
1 1 1   10    1   11 o  364.050   5.8949  2735.72   88.513  2735.72   88.513   0.0000   0.0000  364.050   5.8949  ?   ?       ?      ? 
1 1 1   10    1   12 o   52.014   4.6816   56.434   9.2669   54.361   16.556   57.379   11.183   51.299   7.8248   52.729   5.1420 -1.430103 9.363135 
1 1 1   10    1   13 o  707.372   5.7361 10236.39  165.107 10950.59  258.854  9746.54  214.377  727.872   8.6225  686.871   7.5672 41.00098 11.47217 
1 1 1   10    1   14 o  289.566   2.6348  1729.09   31.458  1762.23   45.161  1697.86   43.846  292.259   3.7466  286.873   3.7057 5.385773 5.269629 
1 1 1   10    1   15 o  238.349   2.8476  1172.19   27.994  1173.09   39.562  1171.30   39.616  238.440   4.0228  238.258   4.0314 0.1819305 5.695206 
1 1 1   10    1   16 o   80.420   2.8757  133.915   9.4960  139.369   12.999  127.675   13.905   82.184   3.8350   78.655   4.2863 3.529137 5.751469 
1 1 1   10    1   17 o   29.755   11.857   9.2760   21.870   0.0000   0.0000   9.2760   21.870  ?   ?    29.755   11.857      ?      ? 
1 1 1   10    1   18 o   92.545   3.3024  176.785   12.562  176.399   17.067  177.241   18.558   92.439   4.4766   92.651   4.8563 -0.2118301 6.604828 
1 1 1   10    1   19 o  456.286   3.5130  4299.78   66.112  4296.62   93.298  4302.96   93.698  456.119   4.9594  456.453   4.9770 -0.3341675 7.026097 
1 1 1   10    1   20 o   27.870   7.3097   10.517   11.716   1.1390   16.370   20.366   16.776   23.498   9.8999   32.241   10.757 -8.743481 14.61934 
1 1 1   10    1   21 o  352.332   3.0345  2562.33   44.081  2606.01   63.392  2521.45   61.338  355.234   4.3267  349.431   4.2560 5.802826 6.069051 
1 1 1   10    1   22 o  277.800   2.7784  1593.20   31.829  1614.79   45.504  1572.52   44.538  279.641   3.9453  275.960   3.9130 3.680878 5.556750 
1 1 1   10    1   23 o   37.918   7.6182   30.952   12.597   25.209   18.563   35.855   17.151   35.151   11.290   40.684   10.231 -5.532936 15.23635 
1 1 1   10    1   24 o   47.380   7.4733   49.599   14.221   40.385   21.328   56.976   19.083   43.212   11.686   51.547   9.3189 -8.334511 14.94655 
1 1 1   10    1   25 o  168.997   2.8181  589.884   19.640  600.349   28.061  579.835   27.497  170.466   3.9912  167.529   3.9795 2.936844 5.636139 
1 1 1   10    1   26 o  104.429   3.5417  226.272   15.199  204.944   21.565  247.324   21.425   99.508   5.2543  109.350   4.7504 -9.841751 7.083408 
1 1 1   10    1   27 o  178.867   3.4047  662.390   25.034  655.851   36.835  668.004   34.128  178.021   5.0167  179.713   4.6043 -1.691528 6.809322 
1 1 1   10    1   28 o   48.509   8.1094   50.752   15.376   49.540   18.966   53.075   26.264   47.798   9.9442   49.220   12.813 -1.421932 16.21884 
1 1 1   10    1   29 o   96.646   4.0197  193.552   16.017  186.052   22.441  201.339   22.867   94.733   5.7435   98.559   5.6254 -3.825645 8.039463 
1 1 1   10    1   30 o   52.950   6.8128   59.647   14.562   55.549   20.375   63.926   20.819   50.608   10.115   55.292   9.1293 -4.684185 13.62568 
1 1 1   10    1   31 o  129.050   3.5777  345.709   18.971  382.082   26.936  309.906   26.724  135.828   4.8081  122.273   5.2991 13.55540 7.155335 
1 1 1   10    1   32 o  149.650   3.8826  461.307   23.176  451.646   29.126  477.982   38.264  147.641   4.7831  151.659   6.1172 -4.017181 7.765240 
1 1 1   10    1   33 o   87.870   6.1731  161.737   22.286  182.648   32.400  142.960   30.703   93.302   8.4196   82.439   9.0299 10.86271 12.34616 
1 1 1   10    1   34 o   80.658   5.4193  136.775   17.981  130.318   25.969  142.720   24.921   78.766   7.9938   82.551   7.3194 -3.784462 10.83859 
1 1 1   10    1   35 o   96.210   5.0186  195.667   19.758  179.361   28.997  209.797   26.993   92.314   7.6159  100.106   6.5378 -7.791847 10.03715 
1 1 1   10    1   36 o  109.175   5.9898  256.410   25.330  245.187   43.519  262.161   31.150  106.735   9.8856  111.615   6.7666 -4.879868 11.97963 
1 1 1   10    1   37 o   52.189   8.2550   63.650   17.304   72.326   23.130   52.623   26.077   56.861   10.239   47.517   12.951 9.344448 16.51000 
1 1 1   10    1   38 o   21.939   7.0736 -24.2572   15.771 -55.5151   22.705   4.8863   21.924   16.625   8.2843   27.252   11.468 -10.62700 14.14717 
1 1 1   10    1   39 o   45.939   9.2341   54.423   19.372   28.195   33.462   67.644   23.758   37.914   14.801   53.964   11.046 -16.04966 18.46829 
1 1 1   10    1   40 o   34.608   8.9914   24.703   17.265   33.128   23.665   15.117   25.244   37.844   12.776   31.373   12.656 6.471788 17.98281 
1 1 1   10    1   41 o   83.346   6.2533  154.053   21.320  167.454   29.358  139.100   31.011   87.624   8.1235   79.068   9.5092 8.555511 12.50664 
1 1 1   10    1   42 o   41.122   9.1092   42.069   17.282   46.129   23.228   37.035   25.865   43.211   12.391   39.034   13.356 4.177288 18.21837 
1 1 1   10    1   43 o   53.030   9.2689   75.295   20.616   53.553   32.376   90.123   26.737   44.712   14.944   61.348   10.970 -16.63554 18.53781 
1 1 1   10    1   44 f   38.304   9.8748   36.688   19.998   31.289   25.996   44.515   31.298   35.838   13.263   40.770   14.633 -4.932529 19.74970 
1 1 1   10    1   45 o   50.354   8.0446   64.663   16.457   51.023   23.128   78.655   23.424   43.999   12.278   56.709   10.398 -12.70994 16.08924 
1 1 1   10    1   46 o   51.538   7.9204   68.578   16.357   74.892   23.679   62.816   22.622   54.077   10.991   48.999   11.407 5.077362 15.84089 
1 1 1   10    1   47 o   41.027   9.0884   48.013   17.658   60.556   24.951   35.427   24.992   46.463   12.671   35.592   13.033 10.87103 18.17681 
1 1 1   10    1   48 o   30.377   9.1624   20.286   20.708   32.794   29.279   7.7674   29.292   33.511   13.590   27.242   12.292 6.268362 18.32475 
1 1 1   10    1   49 o   25.338   8.7154 -21.9312   28.951 -28.4246   43.997 -16.9725   38.448   25.401   12.443   25.274   12.207 0.1262417 17.43076 
1 1 1   10    2    0 o  165.750   1.9886  567.151   19.213  567.151   19.213  567.151   19.213  165.750   2.8123  165.750   2.8123 0.000000 0.000000 
1 1 1   10    2    1 f  139.963   1.9272  403.747   11.120  418.646   16.008  389.854   15.458  142.456   2.7246  137.470   2.7264 4.985977 3.854435 
1 1 1   10    2    2 o  311.977   2.5936  2008.36   33.372  2013.85   47.330  2002.93   47.061  312.401   3.6734  311.553   3.6624 0.8474731 5.187168 
1 1 1   10    2    3 o  481.746   3.5384  4790.94   70.302  4814.51  100.104  4768.00   98.754  482.913   5.0259  480.579   4.9822 2.333679 7.076881 
1 1 1   10    2    4 o  366.907   2.8889  2778.01   43.716  2770.62   61.586  2785.52   62.066  366.416   4.0751  367.398   4.0959 -0.9823914 5.777809 
1 1 1   10    2    5 o  298.979   2.5399  1844.27   31.320  1843.05   44.270  1845.50   44.315  298.880   3.5913  299.078   3.5925 -0.1979675 5.079718 
1 1 1   10    2    6 o  355.703   2.8355  2610.41   41.596  2597.52   58.452  2623.64   59.207  354.814   3.9942  356.591   4.0256 -1.777924 5.670928 
1 1 1   10    2    7 o  473.703   3.4995  4630.38   68.368  4612.20   96.166  4648.97   97.217  472.764   4.9319  474.642   4.9660 -1.878723 6.998928 
1 1 1   10    2    8 o  467.871   3.4697  4516.88   66.953  4529.06   95.073  4504.90   94.303  468.496   4.9202  467.246   4.8934 1.249786 6.939326 
1 1 1   10    2    9 o   60.569   2.5825   75.637   6.4488   72.664   9.0096   78.761   9.2345   59.349   3.6807   61.789   3.6236 -2.439835 5.165023 
1 1 1   10    2   10 o   75.022   2.5218  114.538   7.5511  122.225   12.532  110.156   9.4616   76.969   3.9476   73.076   3.1392 3.892731 5.043628 
1 1 1   10    2   11 o  460.413   4.2487  4385.95   76.306  4407.34   93.877  4344.30  130.999  462.145   4.9251  458.681   6.9246 3.463928 8.497413 
1 1 1   10    2   12 o  279.652   2.7779  1612.81   31.623  1617.56   48.856  1609.38   41.485  279.997   4.2306  279.308   3.6012 0.6892090 5.555710 
1 1 1   10    2   13 o  519.493   4.8269  5580.67  103.243  5215.28  146.264  5943.51  145.754  502.498   7.0573  536.489   6.5871 -33.99060 9.653751 
1 1 1   10    2   14 o  178.158   2.4779  647.315   17.795  621.233   22.661  689.279   28.743  173.536   3.1660  182.781   3.8128 -9.244080 4.955890 
1 1 1   10    2   15 o  232.630   2.8260  1116.29   27.109  1132.05   38.828  1101.31   37.866  234.231   4.0192  231.030   3.9739 3.201218 5.652063 
1 1 1   10    2   16 f  284.356   3.6921  1635.86   42.411  1830.52   68.622  1515.55   53.948  297.747   5.5880  270.965   4.8272 26.78128 7.384264 
1 1 1   10    2   17 f  173.002   3.0651  609.231   21.460  660.586   34.357  576.377   27.480  178.885   4.6567  167.118   3.9868 11.76747 6.130177 
1 1 1   10    2   18 o  191.655   2.9600  736.423   20.233  715.926   23.194  801.670   41.383  186.279   3.0189  197.032   5.0923 -10.75322 5.919933 
1 1 1   10    2   19 o  275.646   2.7466  1566.63   30.132  1561.91   37.899  1574.73   49.678  275.115   3.3400  276.176   4.3612 -1.061371 5.493264 
1 1 1   10    2   20 o  159.130   2.6943  522.208   17.674  537.568   25.513  508.036   24.507  161.377   3.8332  156.883   3.7874 4.493500 5.388678 
1 1 1   10    2   21 o  139.040   2.9006  399.122   16.630  401.951   23.813  396.428   23.234  139.519   4.1382  138.561   4.0655 0.9586487 5.801160 
1 1 1   10    2   22 o  113.947   3.4389  264.935   16.060  235.475   21.354  303.289   24.365  106.748   4.8503  121.146   4.8764 -14.39837 6.877806 
1 1 1   10    2   23 o  160.508   3.2078  532.884   21.219  548.528   29.740  516.662   30.285  162.919   4.4259  158.098   4.6445 4.820038 6.415570 
1 1 1   10    2   24 o  161.300   2.9953  539.474   19.847  564.883   27.295  510.970   28.909  165.361   4.0020  157.239   4.4577 8.121994 5.990623 
1 1 1   10    2   25 o  134.970   3.0871  376.346   17.179  362.744   24.047  390.524   24.552  132.478   4.4010  137.462   4.3304 -4.984085 6.174287 
1 1 1   10    2   26 o   99.829   3.6687  206.135   15.101  212.108   21.647  200.472   21.077  101.237   5.1844   98.421   5.1923 2.816536 7.337426 
1 1 1   10    2   27 o   66.570   5.9961   90.875   16.268  101.578   25.483   83.512   21.136   69.796   8.8523   63.343   8.0900 6.453030 11.99215 
1 1 1   10    2   28 o  192.515   3.3913  768.216   26.880  796.312   37.387  738.153   38.673  196.188   4.6205  188.841   4.9653 7.347336 6.782592 
1 1 1   10    2   29 o  193.313   3.8947  774.999   27.860  773.097   52.655  775.738   32.831  192.939   6.6169  193.686   4.1098 -0.7470551 7.789389 
1 1 1   10    2   30 o  103.526   4.2725  222.131   18.147  224.796   27.164  219.983   24.387  104.055   6.3294  102.996   5.7408 1.058716 8.545094 
1 1 1   10    2   31 o   33.436   8.3935   20.221   14.772   26.789   20.610   13.281   21.185   36.251   11.915   30.620   11.825 5.630939 16.78705 
1 1 1   10    2   32 o  114.004   4.3404  268.487   20.056  278.929   31.688  261.509   25.905  115.767   6.6366  112.242   5.5959 3.524834 8.680888 
1 1 1   10    2   33 o  173.976   3.4553  628.913   24.714  642.045   33.832  613.890   36.187  175.972   4.6615  171.979   5.1016 3.992996 6.910561 
1 1 1   10    2   34 o   59.220   8.4707   75.590   20.412   44.067   27.337  115.308   30.685   44.754   13.604   73.687   10.096 -28.93262 16.94137 
1 1 1   10    2   35 o  191.401   4.1608  763.987   32.824  731.905   45.500  798.804   47.400  187.213   5.8926  195.589   5.8758 -8.375854 8.321526 
1 1 1   10    2   36 o   59.048   7.4974   79.064   17.312   48.825   24.389  109.778   24.579   46.244   12.492   71.853   8.2939 -25.60865 14.99485 
1 1 1   10    2   37 o   71.017   7.3949  113.195   19.838  116.997   24.613  106.148   33.512   73.982   8.0664   68.052   12.397 5.929733 14.78985 
1 1 1   10    2   38 o   87.011   4.9320  160.666   17.697  159.740   25.182  161.570   24.877   86.741   7.0387   87.282   6.9106 -0.5403671 9.864019 
1 1 1   10    2   39 o   74.513   5.7427  120.653   17.615  128.275   24.842  112.945   24.982   77.018   7.8204   72.008   8.4116 5.009956 11.48536 
1 1 1   10    2   40 o   36.650   8.9607   30.333   16.595   25.497   23.658   35.018   23.285   34.660   12.682   38.640   12.663 -3.979420 17.92150 
1 1 1   10    2   41 o   29.612   8.4117   11.157   16.237  -0.2303   22.637   23.223   23.302   25.626   11.223   33.599   12.533 -7.973198 16.82349 
1 1 1   10    2   42 o   72.100   6.8381  112.620   19.704  138.493   33.216   98.573   24.475   77.749   10.358   66.451   8.9301 11.29782 13.67617 
1 1 1   10    2   43 o   32.585   9.2184   18.940   19.766   0.4987   31.080   31.463   25.612   28.824   12.860   36.345   13.211 -7.520329 18.43672 
1 1 1   10    2   44 o   35.777   9.6210   3.8050   21.610 -28.3446   26.022   75.249   38.791   21.147   10.170   50.408   16.335 -29.26095 19.24196 
1 1 1   10    2   45 o   40.445   8.9521   43.536   16.990   53.850   23.992   33.161   24.063   45.039   12.483   35.850   12.835 9.189217 17.90419 
1 1 1   10    2   46 o   25.650   8.0034  -0.0317   16.790 -13.7846   22.006   19.126   25.972   20.950   9.8656   30.351   12.605 -9.401363 16.00680 
1 1 1   10    2   47 o   39.834   9.1935   45.778   17.705   53.851   24.544   37.020   25.563   43.526   12.812   36.141   13.189 7.385204 18.38709 
1 1 1   10    2   48 o   31.412   9.3714   25.362   20.877   20.585   29.769   29.985   29.284   30.187   13.049   32.636   13.454 -2.448383 18.74272 
1 1 1   10    2   49 o   33.792   10.645   24.176   30.380   80.590   48.555 -12.1142   38.944   41.663   17.263   25.921   12.460 15.74132 21.29036 
1 1 1   10    3    0 o  406.851   3.1055  3416.21   73.678  3416.21   73.678  3416.21   73.678  406.851   4.3919  406.851   4.3919 0.000000 0.000000 
1 1 1   10    3    1 o  261.387   2.3499  1409.61   25.333  1403.14   35.656  1416.20   36.001  260.783   3.3150  261.992   3.3316 -1.209381 4.699893 
1 1 1   10    3    2 o  250.159   2.2991  1290.99   23.719  1300.61   33.784  1281.65   33.309  251.077   3.2624  249.241   3.2403 1.835938 4.598153 
1 1 1   10    3    3 o  120.064   1.9308  297.291   9.5602  303.301   13.643  291.492   13.401  121.256   2.7279  118.872   2.7333 2.383957 3.861674 
1 1 1   10    3    4 o  277.819   2.4351  1592.16   27.900  1607.25   39.819  1577.61   39.104  279.110   3.4589  276.526   3.4286 2.583923 4.870279 
1 1 1   10    3    5 o  147.574   1.9848  449.220   12.081  452.784   17.134  445.697   17.036  148.156   2.8039  146.992   2.8100 1.164215 3.969662 
1 1 1   10    3    6 o  612.453   4.3299  7743.42  109.370  7714.90  153.783  7772.61  155.577  611.314   6.0993  613.591   6.1475 -2.277100 8.659881 
1 1 1   10    3    7 o  182.795   2.0883  689.193   15.744  686.506   22.125  691.950   22.407  182.434   2.9405  183.156   2.9662 -0.7215118 4.176677 
1 1 1   10    3    8 o  409.538   3.6301  3441.94   60.940  3626.79   92.332  3299.27   81.117  419.216   5.3401  399.861   4.9186 19.35468 7.260111 
1 1 1   10    3    9 o  229.723   2.6204  1084.20   24.743  1141.38   36.859  1037.29   33.383  235.212   3.7995  224.234   3.6096 10.97739 5.240752 
1 1 1   10    3   10 o  809.693   6.4340 13538.74  214.577 13795.92  312.825 13310.21  294.885  816.908   9.2846  802.477   8.9095 14.43103 12.86790 
1 1 1   10    3   11 f  220.635   2.6618  1004.23   24.221  1001.36   34.005  1007.19   34.507  220.316   3.7423  220.955   3.7865 -0.6392517 5.323697 
1 1 1   10    3   12 o  313.568   3.1488  2028.61   40.718  2013.85   57.086  2043.91   58.097  312.408   4.4304  314.728   4.4756 -2.320557 6.297553 
1 1 1   10    3   13 o  303.029   2.8650  1894.07   35.416  1898.51   54.278  1890.79   46.736  303.326   4.3386  302.732   3.7431 0.5944824 5.730091 
1 1 1   10    3   14 o  265.263   2.5017  1451.05   27.362  1476.97   39.259  1426.56   38.157  267.565   3.5575  262.961   3.5182 4.604095 5.003326 
1 1 1   10    3   15 o  202.569   2.3185  846.511   19.370  855.110   27.485  838.027   27.302  203.592   3.2732  201.547   3.2844 2.044174 4.636935 
1 1 1   10    3   16 o  384.972   3.5308  3057.86   56.017  3098.95   81.099  3020.36   77.465  387.438   5.0751  382.507   4.9102 4.930695 7.061673 
1 1 1   10    3   17 o   57.676   4.1266   71.578   8.9787   76.505   10.927   61.332   15.755   60.881   4.3515   54.471   7.0129 6.410175 8.253294 
1 1 1   10    3   18 o  209.998   3.0631  916.983   24.549  928.130   29.655  892.713   43.757  212.081   3.3903  207.914   5.1027 4.167206 6.126262 
1 1 1   10    3   19 o  150.699   2.6165  470.571   15.704  475.958   19.845  461.548   25.685  151.874   3.1682  149.524   4.1650 2.350189 5.233004 
1 1 1   10    3   20 o  169.574   2.8936  591.441   20.109  575.010   26.796  612.623   30.424  166.897   3.8928  172.251   4.2824 -5.353775 5.787282 
1 1 1   10    3   21 o  127.720   2.9741  336.658   15.661  344.090   22.538  329.720   21.777  129.081   4.2333  126.359   4.1785 2.721741 5.948211 
1 1 1   10    3   22 o  111.291   3.2289  255.700   14.815  264.409   21.297  247.533   20.623  113.126   4.5644  109.456   4.5681 3.669823 6.457720 
1 1 1   10    3   23 o  244.063   3.1338  1230.68   31.536  1275.45   44.989  1187.44   44.217  248.430   4.3908  239.696   4.4726 8.734177 6.267612 
1 1 1   10    3   24 o  119.739   3.9528  289.526   18.284  277.107   22.040  316.940   32.746  115.785   4.6152  123.693   6.4186 -7.908478 7.905631 
1 1 1   10    3   25 o  117.769   3.6458  286.515   17.593  290.531   26.519  283.358   23.513  118.485   5.4267  117.053   4.8703 1.431717 7.291679 
1 1 1   10    3   26 o  299.106   4.1126  1855.80   50.635  1803.97   73.329  1903.04   70.003  295.060   6.0256  303.152   5.5988 -8.091858 8.225224 
1 1 1   10    3   27 o  104.291   3.7745  224.844   16.205  245.102   23.403  206.185   22.462  108.806   5.2150   99.776   5.4582 9.029800 7.549059 
1 1 1   10    3   28 f   38.735   8.3192   31.510   14.438   35.620   21.442   28.100   19.529   40.748   11.969   36.722   11.557 4.026707 16.63831 
1 1 1   10    3   29 o  128.371   3.6463  341.661   19.226  345.408   26.116  337.228   28.409  129.167   4.9022  127.576   5.3991 1.591354 7.292586 
1 1 1   10    3   30 o  100.401   4.2140  209.730   17.385  217.537   23.866  200.903   25.376  102.428   5.6493   98.373   6.2544 4.054268 8.428083 
1 1 1   10    3   31 o  127.874   4.2673  349.965   21.360  303.131   34.987  377.794   26.969  120.690   7.0285  135.058   4.8415 -14.36773 8.534650 
1 1 1   10    3   32 o  108.386   4.5100  244.524   20.135  247.656   27.883  241.111   29.107  109.138   6.1945  107.633   6.5567 1.504494 9.020058 
1 1 1   10    3   33 o   24.254   7.5935  -8.5148   15.466   2.2942   21.469 -20.1754   22.299   26.802   11.317   21.705   10.128 5.096867 15.18696 
1 1 1   10    3   34 o  153.120   3.8293  487.936   24.105  484.350   35.477  491.012   32.852  152.542   5.6389  153.699   5.1824 -1.156204 7.658611 
1 1 1   10    3   35 o   43.952   9.1155   44.093   19.966   8.8523   32.082   66.369   25.507   33.502   13.970   54.402   11.714 -20.89987 18.23099 
1 1 1   10    3   36 o   60.635   6.9945   80.534   16.767   61.735   23.173  101.189   24.290   52.375   11.073   68.895   8.5482 -16.51983 13.98897 
1 1 1   10    3   37 f   40.087   9.6316   25.685   20.543   2.1966   26.120   63.775   33.263   28.571   12.286   51.604   14.837 -23.03356 19.26330 
1 1 1   10    3   38 o   52.571   7.8184   63.011   16.425   55.298   22.840   71.271   23.637   48.984   11.502   56.158   10.593 -7.173393 15.63670 
1 1 1   10    3   39 o   25.450   7.8309  -1.9904   15.814   9.1652   22.289 -13.2973   22.440   28.386   11.724   22.514   10.385 5.871798 15.66176 
1 1 1   10    3   40 o   38.372   9.1713   33.648   17.718   44.239   24.919   22.819   25.196   42.756   12.987   33.987   12.954 8.769375 18.34252 
1 1 1   10    3   41 o   38.909   8.8664   35.798   16.581   25.986   23.910   44.889   23.014   34.761   12.745   43.057   12.330 -8.296349 17.73284 
1 1 1   10    3   42 o   87.181   5.5346  164.178   19.714  185.504   30.541  148.946   25.812   91.799   8.0665   82.563   7.5801 9.235794 11.06918 
1 1 1   10    3   43 o   82.193   5.4987  149.097   18.620  159.146   26.844  139.779   25.848   84.938   7.6627   79.447   7.8884 5.490410 10.99741 
1 1 1   10    3   44 o   40.435   9.2132   43.401   18.298   28.711   27.686   54.793   24.381   34.956   13.513   45.914   12.527 -10.95793 18.42635 
1 1 1   10    3   45 o   23.630   7.5014  -9.8481   16.287 -31.6654   22.749   13.091   23.327   18.757   9.1358   28.502   11.900 -9.744263 15.00281 
1 1 1   10    3   46 o   42.167   9.6986   43.191   20.867   91.712   34.617   15.495   26.153   55.053   14.888   29.280   12.434 25.77231 19.39713 
1 1 1   10    3   47 o   24.734   7.7377  -7.3928   17.512 -38.7759   25.163   22.084   24.387   18.748   9.2289   30.719   12.422 -11.97093 15.47534 
1 1 1   10    3   48 o   26.995   8.5174   6.7450   20.045   21.618   27.350 -10.5150   29.463   30.081   12.741   23.909   11.307 6.171391 17.03488 
1 1 1   10    3   49 o   21.659   7.6341 -52.5423   26.825 -68.0076   43.834 -43.2829   33.918   22.169   11.116   21.149   10.467 1.020281 15.26811 
1 1 1   10    4    0 o  107.910   1.9281  240.632   12.118  240.632   12.118  240.632   12.118  107.910   2.7267  107.910   2.7267 0.000000 0.000000 
1 1 1   10    4    1 o  604.131   4.2754  7537.19  106.526  7558.94  151.311  7515.81  150.000  604.993   6.0639  603.270   6.0286 1.723022 8.550730 
1 1 1   10    4    2 o  241.689   2.2670  1205.09   22.598  1206.02   31.968  1204.16   31.949  241.782   3.2057  241.596   3.2063 0.1863403 4.534013 
1 1 1   10    4    3 o  219.040   2.1795  989.678   19.689  981.762   27.671  997.796   28.021  218.153   3.0753  219.927   3.0891 -1.773834 4.358937 
1 1 1   10    4    4 o  206.643   2.1435  880.835   18.268  877.685   25.706  884.050   25.966  206.270   3.0216  207.016   3.0411 -0.7461548 4.287009 
1 1 1   10    4    5 o  374.799   2.9390  2897.60   45.420  2868.19   63.374  2928.65   65.127  372.846   4.1212  376.752   4.1912 -3.905579 5.877958 
1 1 1   10    4    6 o  162.723   2.0328  545.985   13.640  536.959   19.060  555.459   19.529  161.346   2.8642  164.101   2.8853 -2.755814 4.065566 
1 1 1   10    4    7 o  145.433   2.0257  436.267   12.151  435.472   17.204  437.059   17.164  145.301   2.8707  145.565   2.8589 -0.2645569 4.051417 
1 1 1   10    4    8 f   99.614   3.1744  163.277   11.177  385.898   21.469   80.509   13.091  136.767   3.8060   62.460   5.0816 74.30740 6.348861 
1 1 1   10    4    9 o  319.375   2.7824  2096.72   35.315  2133.01   58.601  2076.03   44.253  321.518   4.4191  317.232   3.3822 4.286407 5.564837 
1 1 1   10    4   10 o  164.595   2.5150  558.453   17.062  547.990   23.618  569.874   24.675  162.984   3.5135  166.205   3.5996 -3.221039 5.030087 
1 1 1   10    4   11 o  279.343   5.0853  1610.35   58.589  1610.35   58.589   0.0000   0.0000  279.343   5.0853  ?   ?       ?      ? 
1 1 1   10    4   12 o  205.494   2.6936  871.205   22.830  873.296   32.387  869.141   32.186  205.739   3.8167  205.249   3.8021 0.4896698 5.387276 
1 1 1   10    4   13 o  485.481   4.7001  4853.35   91.626  4927.78  148.041  4807.13  116.655  488.415   7.3490  482.548   5.8613 5.867065 9.400152 
1 1 1   10    4   14 o  181.102   2.4369  676.569   18.036  677.104   27.430  676.162   23.938  181.160   3.6711  181.044   3.2058 0.1164246 4.873824 
1 1 1   10    4   15 o  712.953   5.4062 10467.72  156.102 10702.45  246.430 10310.41  201.740  719.463   8.3046  706.443   6.9239 13.01996 10.81233 
1 1 1   10    4   16 o  128.507   3.4937  340.311   18.391  346.106   27.780  335.789   24.539  129.471   5.2022  127.542   4.6648 1.929131 6.987408 
1 1 1   10    4   17 o  381.688   3.1842  3014.23   48.805  3037.82   62.408  2977.07   78.309  383.660   3.9439  379.716   5.0002 3.944122 6.368405 
1 1 1   10    4   18 o  117.068   3.5084  286.892   14.569  290.719   16.825  275.421   29.127  118.693   3.4368  115.444   6.1174 3.248642 7.016707 
1 1 1   10    4   19 o  255.977   2.8579  1353.38   29.848  1357.82   39.461  1347.45   45.631  256.487   3.7302  255.467   4.3307 1.020172 5.715733 
1 1 1   10    4   20 o  210.141   3.2517  911.368   26.386  910.178   32.093  913.851   46.355  209.984   3.7056  210.298   5.3443 -0.3139954 6.503314 
1 1 1   10    4   21 o  272.315   2.9874  1535.03   33.190  1556.78   44.002  1506.32   50.553  274.588   3.8853  270.042   4.5389 4.546204 5.974720 
1 1 1   10    4   22 o  175.382   3.4795  629.336   24.781  671.544   39.119  601.046   32.027  180.214   5.2630  170.550   4.5530 9.664352 6.959070 
1 1 1   10    4   23 o  116.505   3.2506  280.882   15.598  264.565   22.115  297.033   22.003  113.126   4.7397  119.884   4.4498 -6.758209 6.501250 
1 1 1   10    4   24 o  125.798   3.2978  327.054   17.032  327.909   25.347  326.350   22.997  125.934   4.8800  125.663   4.4371 0.2714005 6.595581 
1 1 1   10    4   25 o  145.393   4.2165  460.309   23.302  375.446   39.681  504.975   28.788  134.499   7.1532  156.288   4.4661 -21.78909 8.432955 
1 1 1   10    4   26 o  134.404   3.8026  373.806   21.074  362.285   29.506  385.805   30.110  132.287   5.4078  136.520   5.3474 -4.232407 7.605196 
1 1 1   10    4   27 o   77.993   4.4134  126.232   14.153  113.659   19.818  139.319   20.219   74.009   6.4925   81.977   5.9800 -7.967789 8.826858 
1 1 1   10    4   28 o  145.471   3.2524  436.944   19.428  446.912   29.004  428.832   26.166  146.954   4.7854  143.989   4.4059 2.964737 6.504798 
1 1 1   10    4   29 o   52.284   8.0488   56.398   16.296   47.724   20.103   73.019   27.828   46.770   10.659   57.799   12.063 -11.02855 16.09761 
1 1 1   10    4   30 f  156.806   3.1891  508.115   20.604  541.547   29.725  477.199   28.585  161.770   4.4552  151.842   4.5644 9.927750 6.378242 
1 1 1   10    4   31 o   85.202   4.6603  151.606   16.259  172.421   23.004  130.827   22.984   91.120   6.1211   79.284   7.0288 11.83589 9.320517 
1 1 1   10    4   32 o  120.122   4.2662  302.130   20.937  346.468   29.440  256.756   29.782  129.182   5.5254  111.063   6.5016 18.11859 8.532397 
1 1 1   10    4   33 o   62.211   6.4221   81.740   16.435   85.808   22.844   77.374   23.663   63.879   8.6706   60.544   9.4760 3.334225 12.84417 
1 1 1   10    4   34 o   65.252   6.4433   89.957   17.311   89.659   23.782   90.294   25.246   65.182   8.8462   65.322   9.3708 -0.1397934 12.88669 
1 1 1   10    4   35 o   24.204   7.8667 -20.3513   18.834 -52.8942   31.592  -2.4069   23.459   22.090   10.761   26.318   11.478 -4.227612 15.73345 
1 1 1   10    4   36 o   61.852   6.4420   82.016   16.433   83.451   23.330   80.603   23.149   62.401   9.0649   61.303   9.1557 1.097637 12.88404 
1 1 1   10    4   37 o   44.507   8.8049   46.113   16.897   40.309   24.435   51.433   23.392   41.889   12.886   47.125   12.002 -5.236050 17.60984 
1 1 1   10    4   38 o   33.353   8.1241   16.200   15.774  -7.8838   21.668   43.353   23.007   23.529   10.599   43.178   12.316 -19.64896 16.24824 
1 1 1   10    4   39 o   33.930   8.8298   23.682   16.332   19.907   23.498   27.210   22.717   32.571   12.487   35.289   12.488 -2.718151 17.65965 
1 1 1   10    4   40 o   37.399   8.6758   31.803   16.830   47.084   22.421   12.084   25.471   44.328   11.979   30.470   12.553 13.85785 17.35163 
1 1 1   10    4   41 o   58.987   7.0409   80.106   16.498   67.262   23.711   92.159   22.970   53.335   11.138   64.638   8.6161 -11.30296 14.08179 
1 1 1   10    4   42 o   39.220   10.588   34.406   22.538   41.856   40.351   31.028   27.171   41.663   16.256   36.777   13.570 4.885273 21.17544 
1 1 1   10    4   43 o   30.336   8.4258   14.871   16.380  -0.4347   23.453   29.445   22.886   25.443   11.272   35.229   12.527 -9.785872 16.85155 
1 1 1   10    4   44 f   76.122   6.1002  133.212   18.796  123.840   28.707  140.246   24.868   72.949   9.5412   79.295   7.6037 -6.346069 12.20048 
1 1 1   10    4   45 o   25.900   7.9837   4.7043   16.104   9.1275   22.845   0.3350   22.705   27.117   11.571   24.683   11.004 2.433722 15.96746 
1 1 1   10    4   46 o   75.008   6.2001  133.073   19.138  136.673   26.509  129.155   27.656   76.454   8.4069   73.562   9.1154 2.891029 12.40021 
1 1 1   10    4   47 o   34.346   9.0912   32.156   17.819   41.195   24.717   22.376   25.711   37.768   13.050   30.924   12.661 6.843161 18.18236 
1 1 1   10    4   48 o   24.461   8.0661  -3.8563   19.664   2.6494   24.083 -16.8698   34.062   24.525   11.099   24.397   11.708 0.1281109 16.13226 
1 1 1   10    4   49 o   34.751   10.458   40.314   29.166   1.7780   44.878   68.492   38.376   28.435   13.590   41.067   15.900 -12.63170 20.91688 
1 1 1   10    4   50 o   37.067   15.121   58.068   36.502   0.0000   0.0000   58.068   36.502  ?   ?    37.067   15.121      ?      ? 
1 1 1   10    5    0 o  571.276   4.0750  6736.06  135.754  6736.06  135.754  6736.06  135.754  571.276   5.7629  571.276   5.7629 0.000000 0.000000 
1 1 1   10    5    1 o  336.572   2.7260  2337.16   37.840  2326.47   53.219  2348.09   53.815  335.794   3.8427  337.350   3.8677 -1.555756 5.452080 
1 1 1   10    5    2 o  255.487   2.3324  1346.55   24.577  1344.65   34.721  1348.45   34.794  255.306   3.2974  255.667   3.2997 -0.3606567 4.664815 
1 1 1   10    5    3 o  257.215   2.3463  1364.23   24.883  1343.45   34.671  1386.31   35.734  255.196   3.2940  259.233   3.3421 -4.037674 4.692559 
1 1 1   10    5    4 o  563.474   4.0299  6553.30   93.654  6538.59  131.983  6568.22  132.915  562.838   5.6855  564.110   5.7128 -1.271545 8.059806 
1 1 1   10    5    5 o  279.033   2.4548  1606.10   28.251  1602.22   39.834  1610.02   40.073  278.694   3.4655  279.371   3.4778 -0.6764832 4.909627 
1 1 1   10    5    6 o  324.697   2.6812  2174.83   35.904  2165.35   50.464  2184.55   51.093  323.980   3.7766  325.413   3.8068 -1.432648 5.362332 
1 1 1   10    5    7 f  338.318   2.7575  2360.95   38.471  2339.89   53.814  2382.96   55.017  336.777   3.8742  339.859   3.9249 -3.082977 5.514971 
1 1 1   10    5    8 o  267.570   2.4215  1476.91   26.723  1481.14   37.897  1472.72   37.688  267.951   3.4291  267.189   3.4200 0.7621765 4.843026 
1 1 1   10    5    9 o  326.797   2.8187  2198.68   36.706  2221.42   60.413  2185.36   46.214  328.116   4.4642  325.479   3.4426 2.637299 5.637370 
1 1 1   10    5   10 o  231.280   2.6979  1103.35   25.722  1098.36   35.765  1108.69   37.020  230.740   3.7582  231.819   3.8719 -1.079559 5.395848 
1 1 1   10    5   11 o  377.500   3.4438  2920.25   53.215  3101.94   81.303  2784.06   70.388  387.689   5.0846  367.311   4.6462 20.37830 6.887682 
1 1 1   10    5   12 o  132.593   2.5667  359.007   13.947  331.340   18.494  395.498   21.239  126.731   3.5381  138.455   3.7193 -11.72412 5.133388 
1 1 1   10    5   13 o  417.196   3.5200  3560.67   59.012  3729.27   95.829  3457.68   74.898  425.047   5.4663  409.344   4.4362 15.70331 7.039965 
1 1 1   10    5   14 o  600.142   4.6420  7429.78  113.409  7493.99  175.424  7383.68  148.650  602.296   7.0618  597.988   6.0271 4.307861 9.284081 
1 1 1   10    5   15 f  335.687   3.2380  2316.81   44.650  2421.39   66.756  2232.16   60.061  342.505   4.7256  328.868   4.4280 13.63745 6.475999 
1 1 1   10    5   16 f  364.867   3.5533  2767.77   48.666  2795.36   58.022  2702.32   89.372  368.046   3.8223  361.688   5.9910 6.357666 7.106534 
1 1 1   10    5   17 o  334.290   2.9721  2307.95   39.702  2311.96   50.293  2301.31   64.677  334.714   3.6431  333.866   4.6969 0.8475037 5.944168 
1 1 1   10    5   18 o  277.254   3.0275  1580.88   34.489  1521.49   46.458  1653.80   51.478  271.484   4.1490  283.024   4.4100 -11.54001 6.054933 
1 1 1   10    5   19 o  355.798   3.5626  2632.92   47.615  2659.16   56.800  2570.88   87.331  358.922   3.8369  352.674   6.0038 6.248077 7.125182 
1 1 1   10    5   20 o  314.192   3.0416  2028.49   38.655  1988.66   49.771  2089.05   61.365  310.363   3.8881  318.021   4.6784 -7.657684 6.083164 
1 1 1   10    5   21 o  108.152   3.4637  241.145   15.416  233.917   20.990  249.611   22.716  106.402   4.7829  109.903   5.0114 -3.501106 6.927486 
1 1 1   10    5   22 o  147.905   3.5270  452.971   21.127  455.915   27.446  448.690   33.096  148.533   4.4801  147.278   5.4485 1.254913 7.053930 
1 1 1   10    5   23 o   99.887   3.4474  206.451   14.187  195.695   20.083  217.164   20.044   97.281   5.0054  102.493   4.7416 -5.211571 6.894701 
1 1 1   10    5   24 o  157.611   2.8269  513.149   18.372  528.707   26.119  497.912   25.848  159.978   3.9585  155.244   4.0369 4.734375 5.653844 
1 1 1   10    5   25 o  127.164   3.2343  334.255   16.919  332.660   23.084  336.106   24.871  126.848   4.4123  127.480   4.7302 -0.6313400 6.468646 
1 1 1   10    5   26 o  146.132   3.5018  444.153   20.966  417.314   30.905  467.039   28.538  141.988   5.2773  150.276   4.6044 -8.288284 7.003586 
1 1 1   10    5   27 o  127.632   3.2080  336.953   16.887  339.566   23.992  334.387   23.771  128.122   4.5403  127.142   4.5332 0.9801559 6.415916 
1 1 1   10    5   28 o  121.901   3.5722  308.115   17.906  314.033   24.531  301.366   26.198  123.177   4.8285  120.625   5.2657 2.551399 7.144374 
1 1 1   10    5   29 o  149.192   3.7904  460.421   23.094  455.852   30.520  466.542   35.323  148.375   4.9872  150.010   5.7092 -1.634949 7.580727 
1 1 1   10    5   30 o  115.930   3.8724  277.231   18.417  265.833   24.599  291.767   27.780  113.256   5.2662  118.604   5.6789 -5.348099 7.744826 
1 1 1   10    5   31 o  231.511   3.3177  1109.87   31.669  1106.60   44.206  1113.31   45.391  231.173   4.6363  231.849   4.7468 -0.6762543 6.635358 
1 1 1   10    5   32 o   87.702   4.8703  162.439   17.162  206.965   24.504  119.566   24.045   99.774   5.9546   75.629   7.7085 24.14494 9.740506 
1 1 1   10    5   33 o   30.239   8.4389   11.397   15.613   7.0011   21.787   16.038   22.384   28.468   11.655   32.011   12.207 -3.542866 16.87778 
1 1 1   10    5   34 o   46.621   8.4691   47.366   16.807   31.528   22.792   66.241   24.882   38.581   12.523   54.662   11.405 -16.08154 16.93816 
1 1 1   10    5   35 o   56.180   7.8404   67.666   17.710   86.913   27.454   53.951   23.176   63.488   10.485   48.873   11.660 14.61514 15.68084 
1 1 1   10    5   36 o  105.858   4.3283  235.399   18.897  232.425   26.683  238.390   26.765  105.178   6.1511  106.538   6.0912 -1.360222 8.656669 
1 1 1   10    5   37 o   18.048   6.2368 -38.9592   15.457 -49.7866   23.131 -30.2241   20.776   17.494   8.6555   18.602   8.9818 -1.108465 12.47359 
1 1 1   10    5   38 o   50.182   9.2188   54.679   18.845   40.044   23.266   82.595   32.133   41.502   12.536   58.862   13.520 -17.36038 18.43767 
1 1 1   10    5   39 o   43.904   8.5788   45.932   16.729   29.891   23.714   61.826   23.604   36.560   12.773   51.248   11.455 -14.68874 17.15758 
1 1 1   10    5   40 o   27.566   8.0989   6.0516   15.677  -5.0046   22.308   16.841   22.037   24.265   10.856   30.867   12.022 -6.601660 16.19779 
1 1 1   10    5   41 o   25.741   7.7923   0.6993   15.409 -12.8342   21.945   13.861   21.641   22.105   10.222   29.377   11.764 -7.271889 15.58467 
1 1 1   10    5   42 o   36.182   9.9860   27.984   21.536   24.945   32.399   30.389   28.825   35.650   14.353   36.714   13.888 -1.063744 19.97191 
1 1 1   10    5   43 o   24.811   7.7909  -1.9570   16.061   4.5411   22.891  -8.2577   22.541   26.496   11.448   23.126   10.571 3.370266 15.58180 
1 1 1   10    5   44 o   19.874   6.6913 -27.3866   15.722  -4.8314   22.072 -50.6178   22.400   23.336   10.587   16.413   8.1862 6.923552 13.38253 
1 1 1   10    5   45 o   31.406   8.9463   20.026   17.363   15.084   22.007   28.176   28.258   28.670   11.723   34.141   13.517 -5.471878 17.89259 
1 1 1   10    5   46 o   28.634   8.5364   14.865   17.277   11.187   24.379   18.577   24.489   27.539   11.856   29.729   12.284 -2.189840 17.07273 
1 1 1   10    5   47 o   25.645   8.0409   1.5310   17.452 -13.5527   23.988   18.493   25.437   21.701   10.244   29.590   12.397 -7.888670 16.08172 
1 1 1   10    5   48 o   26.903   8.8511   1.0348   23.956   7.9164   32.357  -7.3132   35.638   27.741   12.675   26.065   12.358 1.676235 17.70225 
1 1 1   10    5   49 o   31.679   10.216   26.384   28.200   46.484   47.606   15.519   35.002   34.535   15.619   28.823   13.174 5.711664 20.43281 
1 1 1   10    5   50 o   25.998   12.400   0.0444   36.959   0.0000   0.0000   0.0444   36.959  ?   ?    25.998   12.400      ?      ? 
1 1 1   10    6    0 o  371.473   2.9178  2847.41   63.203  2847.41   63.203  2847.41   63.203  371.473   4.1264  371.473   4.1264 0.000000 0.000000 
1 1 1   10    6    1 o  621.906   4.3845  7984.00  112.462  8004.10  159.648  7964.20  158.449  622.682   6.2163  621.131   6.1850 1.550903 8.769093 
1 1 1   10    6    2 o  111.183   1.9842  254.935   9.0975  248.615   12.784  261.418   12.949  109.787   2.8234  112.579   2.7887 -2.791656 3.968415 
1 1 1   10    6    3 o  298.130   2.5376  1833.52   31.203  1830.60   44.037  1836.46   44.219  297.892   3.5842  298.368   3.5933 -0.4761963 5.075232 
1 1 1   10    6    4 o  279.233   2.4507  1608.33   28.223  1599.97   39.691  1616.88   40.138  278.499   3.4555  279.967   3.4761 -1.467377 4.901350 
1 1 1   10    6    5 o  314.723   2.6317  2042.40   34.147  2011.91   47.476  2075.07   49.149  312.293   3.6859  317.154   3.7573 -4.861694 5.263414 
1 1 1   10    6    6 o  473.149   3.4983  4618.83   68.251  4577.33   95.277  4662.58   97.816  470.969   4.9049  475.329   4.9894 -4.359924 6.996593 
1 1 1   10    6    7 o  392.466   3.0472  3178.06   49.324  3168.24   69.428  3188.07   70.086  391.855   4.2958  393.078   4.3230 -1.222839 6.094458 
1 1 1   10    6    8 o  471.678   3.6085  4603.78   68.471  4534.44  109.250  4648.64   87.871  468.706   5.6514  474.650   4.4885 -5.943542 7.217020 
1 1 1   10    6    9 o   86.238   3.1872  136.768   10.535  243.436   18.327   84.129   12.874  108.624   4.0907   63.851   4.8887 44.77355 6.374409 
1 1 1   10    6   10 o   83.267   2.7360  142.781   9.3864  134.295   12.985  152.069   13.584   80.680   3.9021   85.854   3.8362 -5.173813 5.472055 
1 1 1   10    6   11 o  325.433   2.8110  2190.48   36.788  2160.65   58.778  2209.69   47.168  323.588   4.4041  327.277   3.4944 -3.688690 5.621974 
1 1 1   10    6   12 o  269.071   3.5891  1486.33   39.604  1424.91   52.816  1565.23   59.860  262.763   4.8734  275.379   5.2704 -12.61636 7.178240 
1 1 1   10    6   13 o  413.520   3.4682  3536.75   58.828  3452.77   87.340  3606.48   79.589  408.999   5.1775  418.042   4.6160 -9.043182 6.936470 
1 1 1   10    6   14 o  389.368   3.3274  3129.67   52.912  3125.31   80.646  3132.96   70.113  389.107   5.0251  389.630   4.3630 -0.5223999 6.654887 
1 1 1   10    6   15 o  149.224   2.9261  448.441   17.695  403.845   22.613  518.886   28.421  139.891   3.9193  158.557   4.3460 -18.66560 5.852243 
1 1 1   10    6   16 f  598.943   4.9721  7411.93  122.743  7518.15  177.363  7314.30  170.039  603.039   7.1310  594.848   6.9307 8.190735 9.944137 
1 1 1   10    6   17 o  373.194   3.3173  2870.33   50.419  2842.66   66.109  2908.80   77.951  371.083   4.3194  375.306   5.0358 -4.223145 6.634525 
1 1 1   10    6   18 o  218.477   2.8246  986.190   25.423  1038.44   35.891  933.580   36.016  224.295   3.8797  212.658   4.1063 11.63734 5.649240 
1 1 1   10    6   19 o  139.307   3.3720  396.510   16.315  392.894   18.557  408.824   34.241  137.979   3.2608  140.634   5.9032 -2.654495 6.743975 
1 1 1   10    6   20 o  125.358   2.8329  325.080   14.078  326.666   17.648  322.306   23.345  125.802   3.4013  124.915   4.5311 0.8863220 5.665712 
1 1 1   10    6   21 o  186.454   2.6460  721.607   19.649  732.721   24.857  703.095   32.079  188.409   3.1988  184.498   4.2157 3.910706 5.291907 
1 1 1   10    6   22 o   66.804   4.5788   75.848   11.258   57.875   12.851  135.135   23.341   52.875   5.8930   80.733   7.0097 -27.85794 9.157642 
1 1 1   10    6   23 o  178.848   2.7320  660.713   20.152  662.267   28.474  659.153   28.526  179.059   3.8556  178.637   3.8717 0.4227600 5.464005 
1 1 1   10    6   24 o   50.393   6.0925   53.862   12.323   48.167   17.513   59.448   17.344   47.288   9.3108   53.498   7.8602 -6.210449 12.18502 
1 1 1   10    6   25 o   23.186   6.9978  -3.6297   12.505   8.0885   17.337 -16.3355   18.053   26.683   10.580   19.688   9.1615 6.995205 13.99567 
1 1 1   10    6   26 o  146.914   3.2748  446.146   19.593  448.336   30.236  444.560   25.724  147.191   4.9806  146.638   4.2533 0.5522919 6.549605 
1 1 1   10    6   27 o   56.245   5.9765   67.157   13.391   78.928   19.080   55.731   18.799   61.604   7.5094   50.887   9.2996 10.71695 11.95300 
1 1 1   10    6   28 o  172.093   2.9641  611.844   21.028  592.349   29.175  632.918   30.333  169.245   4.1796  174.941   4.2040 -5.696777 5.928118 
1 1 1   10    6   29 o  230.741   3.5150  1105.08   33.178  1081.10   49.936  1124.04   44.393  228.430   5.3002  233.053   4.6185 -4.622925 7.030099 
1 1 1   10    6   30 o   91.340   4.4330  173.377   16.674  174.984   23.005  171.599   24.201   91.806   6.0756   90.874   6.4570 0.9318314 8.865993 
1 1 1   10    6   31 o   93.403   4.8401  182.106   18.569  188.301   25.415  175.011   27.198   95.157   6.4756   91.648   7.1953 3.508980 9.680132 
1 1 1   10    6   32 o  151.897   3.3664  477.867   21.076  464.864   29.151  492.108   30.507  149.741   4.7200  154.052   4.8013 -4.311218 6.732854 
1 1 1   10    6   33 o   56.578   6.9719   68.794   15.947   68.090   22.599   69.493   22.507   55.841   10.187   57.316   9.5207 -1.474316 13.94378 
1 1 1   10    6   34 o  115.944   5.0997  283.074   24.276  265.424   35.307  298.900   33.432  112.390   7.6166  119.497   6.7833 -7.106949 10.19932 
1 1 1   10    6   35 o  136.609   3.9984  388.895   22.321  399.214   34.140  381.190   29.500  138.072   5.9950  135.146   5.2923 2.925934 7.996825 
1 1 1   10    6   36 o   24.761   7.7306  -4.3841   15.510  -7.9056   21.734  -0.7296   22.141   23.700   10.651   25.823   11.207 -2.123102 15.46113 
1 1 1   10    6   37 o   64.727   6.2611   90.410   16.693   84.464   23.391   96.582   23.829   62.485   9.0762   66.969   8.6272 -4.483227 12.52223 
1 1 1   10    6   38 o   36.303   9.2890   28.149   18.557   37.583   22.405   7.5360   33.118   40.158   12.337   32.448   13.891 7.709549 18.57809 
1 1 1   10    6   39 o   96.913   5.1184  202.804   20.340  210.584   27.693  193.691   29.973   99.191   6.7692   94.635   7.6792 4.555679 10.23679 
1 1 1   10    6   40 o   32.888   8.1315   17.358   15.934   42.379   22.435  -8.1143   22.636   42.069   12.211   23.707   10.741 18.36181 16.26295 
1 1 1   10    6   41 o   96.151   4.5381  198.694   17.993  194.427   25.479  202.938   25.413   95.073   6.4977   97.230   6.3370 -2.156487 9.076223 
1 1 1   10    6   42 o   39.514   9.7835   38.766   19.554   35.433   31.483   40.858   24.949   38.602   14.535   40.427   13.100 -1.824318 19.56691 
1 1 1   10    6   43 o   49.048   8.6165   61.765   17.582   49.227   26.182   72.064   23.729   43.504   13.331   54.592   10.920 -11.08784 17.23300 
1 1 1   10    6   44 o   51.033   8.2196   66.179   16.939   60.233   23.849   72.234   24.064   48.306   12.019   53.760   11.216 -5.453815 16.43911 
1 1 1   10    6   45 o   45.321   8.6536   58.814   18.028   75.993   23.128   32.216   28.778   55.324   10.520   35.318   13.743 20.00531 17.30729 
1 1 1   10    6   46 o   23.557   7.6658  -6.8508   17.416   3.0800   24.333 -17.2820   24.938   25.454   11.366   21.659   10.289 3.795319 15.33170 
1 1 1   10    6   47 o   28.092   8.4576   13.766   17.402   5.9809   24.433   21.782   24.791   25.844   11.474   30.340   12.428 -4.495117 16.91530 
1 1 1   10    6   48 o   34.568   9.9634   37.897   22.542   32.431   32.763   42.812   31.064   33.078   13.974   36.058   14.205 -2.979675 19.92673 
1 1 1   10    6   49 o   34.119   10.612   41.576   28.451   61.709   44.505   27.661   36.999   37.238   16.026   31.000   13.917 6.238493 21.22486 
1 1 1   10    6   50 o   36.495   10.514   56.467   28.463   17.663   45.380   81.633   36.545   29.198   13.873   43.792   15.801 -14.59365 21.02748 
1 1 1   10    7    0 o  430.384   3.2451  3822.18   81.442  3822.18   81.442  3822.18   81.442  430.384   4.5892  430.384   4.5892 0.000000 0.000000 
1 1 1   10    7    1 o  240.669   2.2711  1194.78   22.544  1195.34   31.875  1194.22   31.889  240.725   3.2104  240.613   3.2134 0.1126709 4.542282 
1 1 1   10    7    2 o  217.653   2.1820  977.061   19.586  986.674   27.894  967.711   27.509  218.709   3.0922  216.597   3.0793 2.111588 4.363975 
1 1 1   10    7    3 o  232.720   2.2466  1116.95   21.561  1105.02   30.193  1129.38   30.800  231.452   3.1629  233.988   3.1915 -2.536270 4.493275 
1 1 1   10    7    4 o  417.802   3.1800  3601.81   54.798  3602.82   77.482  3600.81   77.509  417.860   4.4958  417.743   4.4986 0.1163635 6.359978 
1 1 1   10    7    5 o  275.591   2.4422  1566.59   27.756  1553.70   38.889  1579.97   39.627  274.436   3.4358  276.746   3.4718 -2.309937 4.884425 
1 1 1   10    7    6 f  372.230   2.9399  2857.99   45.122  2828.60   62.965  2889.02   64.695  370.264   4.1231  374.195   4.1919 -3.930969 5.879757 
1 1 1   10    7    7 o  212.416   2.3875  927.762   20.618  913.362   26.877  948.356   32.141  210.425   3.0968  214.407   3.6346 -3.982559 4.775029 
1 1 1   10    7    8 o  363.530   3.1319  2732.02   46.735  2669.25   69.126  2784.88   63.429  359.666   4.6599  367.395   4.1859 -7.728149 6.263874 
1 1 1   10    7    9 o  368.447   3.5793  2806.93   51.624  2784.66   88.024  2818.60   63.737  367.288   5.8107  369.606   4.1810 -2.318573 7.158607 
1 1 1   10    7   10 o  258.107   4.8550  1374.85   51.684   0.0000   0.0000  1374.85   51.684  ?   ?   258.107   4.8550      ?      ? 
1 1 1   10    7   11 o  242.262   2.4242  1209.36   23.471  1216.53   38.311  1205.05   29.696  242.825   3.8253  241.699   2.9789 1.125992 4.848372 
1 1 1   10    7   12 o  405.938   4.0812  3405.71   67.210  3381.08  104.785  3422.92   87.604  404.650   6.2785  407.227   5.2158 -2.577057 8.162365 
1 1 1   10    7   13 o  346.616   3.1101  2469.54   43.680  2531.08   68.900  2428.20   56.480  350.190   4.7703  343.042   3.9919 7.148132 6.220249 
1 1 1   10    7   14 o  108.061   2.5840  239.043   11.327  251.177   17.893  230.930   14.632  110.326   3.9323  105.796   3.3533 4.530563 5.167912 
1 1 1   10    7   15 o  409.184   3.6744  3437.33   61.619  3627.11   93.479  3291.52   81.940  419.091   5.4081  399.276   4.9758 19.81509 7.348827 
1 1 1   10    7   16 o  116.062   2.6787  275.357   12.238  269.377   15.112  286.756   20.863  114.260   3.2066  117.863   4.2918 -3.603027 5.357393 
1 1 1   10    7   17 o  358.677   3.0797  2662.35   44.295  2683.35   56.507  2628.86   71.338  360.565   3.7997  356.788   4.8478 3.776367 6.159477 
1 1 1   10    7   18 o  215.660   2.5888  959.343   22.250  957.600   28.046  962.302   36.546  215.420   3.1566  215.901   4.1042 -0.4807892 5.177671 
1 1 1   10    7   19 o  260.953   3.2754  1397.46   32.321  1384.06   38.553  1429.17   59.289  258.941   3.6099  262.965   5.4665 -4.023529 6.550892 
1 1 1   10    7   20 o  249.276   3.1883  1282.06   28.881  1280.37   33.646  1286.81   56.298  249.062   3.2754  249.490   5.4711 -0.4280701 6.376571 
1 1 1   10    7   21 o  315.145   3.5374  2047.03   43.424  2034.33   53.203  2072.35   75.159  313.815   4.1105  316.475   5.7581 -2.660126 7.074708 
1 1 1   10    7   22 o  139.933   3.0369  402.904   17.457  386.694   23.474  422.961   26.112  136.806   4.1603  143.060   4.4254 -6.253876 6.073866 
1 1 1   10    7   23 o  131.365   2.8884  355.585   14.855  353.549   18.299  359.519   25.440  130.853   3.3907  131.878   4.6771 -1.025131 5.776818 
1 1 1   10    7   24 f  100.771   3.4519  210.028   14.345  210.931   20.469  209.156   20.110  100.982   4.9146  100.560   4.8487 0.4215775 6.903896 
1 1 1   10    7   25 o   50.418   7.2947   60.580   14.891   25.836   22.980   85.726   19.550   36.593   12.586   64.244   7.3782 -27.65057 14.58936 
1 1 1   10    7   26 o   78.232   4.7843  127.453   15.114  125.096   23.823  129.041   19.553   77.569   7.4463   78.894   6.0091 -1.325226 9.568557 
1 1 1   10    7   27 o  119.082   3.3798  293.402   16.591  291.784   23.063  295.138   23.885  118.748   4.7089  119.416   4.8496 -0.6682129 6.759567 
1 1 1   10    7   28 o  138.066   3.1908  394.360   18.151  370.648   25.449  418.912   25.897  133.833   4.6105  142.300   4.4124 -8.467545 6.381632 
1 1 1   10    7   29 o  240.788   3.2607  1199.81   32.379  1185.41   45.398  1214.73   46.194  239.320   4.5993  242.257   4.6232 -2.936188 6.521317 
1 1 1   10    7   30 o  240.820   3.9331  1187.33   38.162  1134.20   48.519  1273.52   61.797  233.971   5.0279  247.668   6.0496 -13.69612 7.866248 
1 1 1   10    7   31 o  175.024   3.4819  635.227   25.105  639.899   34.730  630.114   36.330  175.722   4.7920  174.326   5.0529 1.396164 6.963834 
1 1 1   10    7   32 o   54.058   7.3466   63.506   15.967   73.568   22.408   53.127   22.758   59.103   9.1925   49.014   11.463 10.08883 14.69328 
1 1 1   10    7   33 o  109.677   4.0778  250.408   18.439  240.708   25.857  260.444   26.301  107.504   5.8316  111.849   5.7013 -4.344666 8.155518 
1 1 1   10    7   34 o   40.541   9.5317   35.122   19.333   19.401   30.416   45.778   25.043   35.953   14.090   45.129   12.841 -9.176723 19.06348 
1 1 1   10    7   35 o   90.508   5.3599  173.836   19.940  162.937   28.748  183.941   27.682   87.651   7.9522   93.365   7.1885 -5.714455 10.71971 
1 1 1   10    7   36 o   49.632   7.7279   56.137   15.956   75.901   22.503   36.153   22.628   59.288   9.2023   39.976   12.418 19.31199 15.45574 
1 1 1   10    7   37 o   53.544   7.5506   65.008   16.086   69.722   22.748   60.292   22.750   55.694   10.282   51.394   11.060 4.299831 15.10110 
1 1 1   10    7   38 o   26.358   8.2963  -5.4896   18.611   6.1975   23.333 -25.9306   30.858   27.973   11.804   24.742   11.661 3.231203 16.59261 
1 1 1   10    7   39 o   46.323   9.0110   52.328   17.873   58.215   24.553   45.692   26.068   49.270   12.157   43.377   13.304 5.893692 18.02202 
1 1 1   10    7   40 o   30.811   8.3425   14.832   15.557   1.8810   21.460   29.179   22.586   25.652   11.083   35.971   12.472 -10.31894 16.68494 
1 1 1   10    7   41 o   31.361   8.8051   14.631   17.556   1.7956   23.773   30.028   26.038   26.442   11.543   36.281   13.300 -9.839293 17.61024 
1 1 1   10    7   42 o   22.012   7.1908 -15.5227   15.820 -31.0404   22.506  -0.3644   22.243   19.064   9.2393   24.959   11.021 -5.895092 14.38162 
1 1 1   10    7   43 o   52.710   8.2937   70.203   17.502   61.552   26.520   76.879   23.296   48.697   12.972   56.724   10.338 -8.026669 16.58746 
1 1 1   10    7   44 o   28.216   7.9861   8.3988   15.850 -14.0274   22.421   30.801   22.409   21.490   10.069   34.942   12.399 -13.45237 15.97221 
1 1 1   10    7   45 o   32.470   8.6477   19.943   18.582 -11.4861   27.215   47.392   25.434   23.869   11.154   41.072   13.218 -17.20282 17.29537 
1 1 1   10    7   46 o   30.767   8.8838   21.100   17.966   15.377   25.312   26.909   25.503   28.955   12.261   32.578   12.859 -3.622786 17.76765 
1 1 1   10    7   47 o   36.774   9.0681   40.253   18.924   57.301   24.749   16.254   29.364   44.185   12.825   29.363   12.823 14.82191 18.13623 
1 1 1   10    7   48 f   34.084   9.8976   35.841   22.597   46.959   32.325   25.215   31.602   37.020   14.521   31.147   13.454 5.873413 19.79527 
1 1 1   10    7   49 o   37.017   11.205   59.106   29.838   77.066   47.657   47.526   38.267   39.280   16.735   34.755   14.906 4.525097 22.41096 
1 1 1   10    8    0 o  406.506   3.1146  3409.92   73.830  3409.92   73.830  3409.92   73.830  406.506   4.4047  406.506   4.4047 0.000000 0.000000 
1 1 1   10    8    1 o  427.811   3.2346  3776.39   57.071  3758.38   80.183  3794.88   81.249  426.778   4.5553  428.843   4.5936 -2.065002 6.469265 
1 1 1   10    8    2 o  668.339   4.6755  9222.67  128.873  9183.28  181.037  9263.13  183.495  666.897   6.5818  669.782   6.6424 -2.885681 9.351017 
1 1 1   10    8    3 o  170.552   2.2268  597.024   15.443  582.770   20.104  617.542   24.120  168.085   2.8999  173.019   3.3800 -4.934296 4.453549 
1 1 1   10    8    4 o  496.878   3.6400  5093.64   74.566  5041.73  103.791  5149.00  107.197  494.267   5.0913  499.490   5.2034 -5.222351 7.279924 
1 1 1   10    8    5 o  467.233   3.7399  4510.52   71.540  4462.47  107.618  4548.56   95.762  464.978   5.6116  469.487   4.9454 -4.509155 7.479777 
1 1 1   10    8    6 o  258.003   2.3743  1372.47   25.256  1396.76   36.322  1349.74   35.142  260.212   3.3844  255.795   3.3309 4.416733 4.748623 
1 1 1   10    8    7 o  286.712   2.7204  1683.08   31.516  1758.43   50.353  1634.55   40.411  291.937   4.1818  281.487   3.4807 10.44992 5.440893 
1 1 1   10    8    8 o  203.964   2.6893  857.193   21.291  861.496   37.052  855.071   26.016  204.331   4.3966  203.597   3.0981 0.7337494 5.378504 
1 1 1   10    8    9 o  625.057   5.1151  8043.19  131.292  7797.68  176.469  8347.58  196.489  614.447   6.9634  635.667   7.4945 -21.22015 10.23016 
1 1 1   10    8   10 o  442.216   4.7359  4038.47   86.378  4044.83  122.333  4032.14  121.983  442.563   6.7020  441.869   6.6933 0.6943359 9.471895 
1 1 1   10    8   11 o  305.427   2.8206  1920.00   35.010  1952.28   54.588  1897.44   45.631  307.589   4.3029  303.265   3.6481 4.324677 5.641244 
1 1 1   10    8   12 o  117.630   2.3692  284.745   11.455  293.716   17.027  277.328   15.482  119.317   3.4600  115.944   3.2375 3.373169 4.738404 
1 1 1   10    8   13 o  328.568   3.0077  2226.12   40.227  2239.60   62.197  2216.43   52.744  329.403   4.5780  327.734   3.9020 1.669159 6.015309 
1 1 1   10    8   14 o  242.039   3.1443  1219.31   30.703  1158.27   48.102  1261.29   39.886  236.859   4.9239  247.219   3.9117 -10.36060 6.288552 
1 1 1   10    8   15 o  181.620   2.5880  681.978   19.104  688.329   25.037  673.127   29.555  182.645   3.3236  180.596   3.9679 2.049774 5.175939 
1 1 1   10    8   16 o  126.412   3.1809  332.145   16.398  274.027   23.117  391.009   23.265  115.194   4.8656  137.630   4.0985 -22.43608 6.361741 
1 1 1   10    8   17 o  450.280   3.5588  4194.95   64.202  4218.13   81.742  4157.62  103.726  451.992   4.3848  448.568   5.6065 3.424805 7.117545 
1 1 1   10    8   18 o  347.157   3.0459  2486.47   42.098  2480.59   52.987  2496.54   69.325  346.659   3.7060  347.656   4.8347 -0.9965210 6.091704 
1 1 1   10    8   19 o  224.902   2.7166  1041.71   24.729  1030.96   31.952  1057.75   39.051  223.484   3.4665  226.320   4.1836 -2.835907 5.433117 
1 1 1   10    8   20 o  336.887   3.4968  2352.27   43.576  2360.65   51.366  2330.76   82.300  338.127   3.6833  335.647   5.9450 2.479828 6.993540 
1 1 1   10    8   21 o  110.609   3.4679  256.949   14.423  262.956   17.281  243.154   26.187  112.836   3.7132  108.383   5.8582 4.453171 6.935855 
1 1 1   10    8   22 o   57.426   4.5364   63.013   9.9045   55.691   11.639   82.239   18.860   51.883   5.4389   62.969   7.2619 -11.08567 9.072865 
1 1 1   10    8   23 o  102.964   3.6003  218.984   15.225  216.135   20.548  222.453   22.672  102.236   4.8731  103.693   5.3011 -1.457390 7.200634 
1 1 1   10    8   24 o   49.254   5.2709   45.666   9.7442   39.868   11.326   62.181   19.116   43.856   6.2617   54.653   8.4805 -10.79726 10.54174 
1 1 1   10    8   25 o   70.560   5.5765  105.696   15.885   85.638   23.299  123.118   21.715   64.101   8.8127   77.020   6.8357 -12.91942 11.15306 
1 1 1   10    8   26 o  125.620   3.3569  326.616   17.335  327.591   23.596  325.473   25.551  125.841   4.5463  125.398   4.9402 0.4425964 6.713738 
1 1 1   10    8   27 o  157.587   3.1316  512.711   20.289  501.878   27.485  525.684   30.076  155.777   4.2778  159.396   4.5748 -3.618851 6.263294 
1 1 1   10    8   28 o   55.065   6.3813   64.607   14.069   56.612   19.973   72.481   19.821   51.166   9.8214   58.964   8.1502 -7.797783 12.76265 
1 1 1   10    8   29 o   76.950   5.1520  121.630   16.236  138.147   24.805  109.248   21.476   81.450   7.3838   72.450   7.1869 8.999985 10.30402 
1 1 1   10    8   30 o   34.426   9.2426   18.404   17.349   18.149   21.263   18.913   30.006   32.591   12.008   36.261   14.054 -3.669529 18.48528 
1 1 1   10    8   31 o  147.737   3.4820  454.097   21.135  430.827   30.769  474.884   29.081  144.098   5.1771  151.375   4.6578 -7.276321 6.963989 
1 1 1   10    8   32 o   53.701   7.4542   62.844   16.116   48.879   22.661   77.137   22.925   46.926   11.738   60.475   9.1912 -13.54871 14.90836 
1 1 1   10    8   33 o   61.427   6.4908   79.818   16.433   76.235   23.204   83.423   23.274   60.011   9.3750   62.843   8.9795 -2.832466 12.98161 
1 1 1   10    8   34 o   84.200   5.0146  149.265   17.399  142.263   24.639  156.228   24.572   82.187   7.2686   86.213   6.9104 -4.025902 10.02928 
1 1 1   10    8   35 o   74.717   5.6840  119.091   17.414  122.862   23.636  114.614   25.752   76.154   7.5253   73.279   8.5206 2.874901 11.36794 
1 1 1   10    8   36 f   26.080   7.8555  -2.5487   15.889 -20.3894   22.788   14.331   22.165   21.581   10.124   30.578   12.014 -8.996792 15.71102 
1 1 1   10    8   37 o   49.875   8.0008   57.276   16.148   47.891   22.596   67.072   23.086   45.397   11.917   54.353   10.679 -8.956593 16.00170 
1 1 1   10    8   38 o   26.117   7.8341 -13.0952   16.748   23.697   25.208 -42.1731   22.410   34.436   12.997   17.797   8.7507 16.63912 15.66819 
1 1 1   10    8   39 o   41.554   8.0201   39.067   16.257   67.994   23.095   10.657   22.888   54.087   10.732   29.022   11.921 25.06552 16.04017 
1 1 1   10    8   40 o   48.248   8.0487   55.021   15.950   70.669   23.359   41.353   21.831   55.047   10.674   41.449   12.050 13.59801 16.09743 
1 1 1   10    8   41 o   32.906   9.2461   13.834   19.078   38.902   30.957  -1.5185   24.226   40.008   14.527   25.805   11.443 14.20270 18.49211 
1 1 1   10    8   42 o   41.449   8.6366   43.225   16.231   31.629   23.361   54.048   22.569   36.205   12.676   46.692   11.733 -10.48646 17.27318 
1 1 1   10    8   43 o   26.054   8.0060  -3.7730   17.150   20.456   25.217 -24.6231   23.393   31.787   12.710   20.322   9.7390 11.46497 16.01210 
1 1 1   10    8   44 o   24.620   7.6392   1.7598   15.091  -5.4184   21.458   8.7853   21.229   22.761   10.369   26.478   11.221 -3.716066 15.27831 
1 1 1   10    8   45 o   34.438   8.0622   20.873   18.315 -28.1127   26.955   62.880   24.961   21.035   10.174   47.841   12.509 -26.80583 16.12430 
1 1 1   10    8   46 o   31.935   8.9071   24.199   18.026   36.694   25.054   10.790   25.954   36.061   13.072   27.809   12.102 8.251280 17.81421 
1 1 1   10    8   47 o   28.291   8.9574   11.646   21.526   9.0796   31.875   13.798   29.187   28.070   12.730   28.511   12.605 -0.4407864 17.91482 
1 1 1   10    8   48 o   24.005   8.0953 -12.6047   22.178  -5.0076   32.541 -19.1944   30.307   25.348   11.955   22.663   10.918 2.685061 16.19061 
1 1 1   10    8   49 o   28.319   9.1305   15.454   24.176   30.208   33.268  -1.0554   35.192   30.937   13.576   25.700   12.213 5.236856 18.26101 
1 1 1   10    9    0 o  373.423   4.1708  2879.18   90.793  2879.18   90.793  2879.18   90.793  373.423   5.8984  373.423   5.8984 0.000000 0.000000 
1 1 1   10    9    1 o  580.151   5.0542  6963.80  114.545  6909.12  196.139  6992.10  141.109  578.289   8.2234  582.013   5.8784 -3.723083 10.10839 
1 1 1   10    9    2 o  641.967   4.8708  8515.35  127.874  8465.93  193.577  8553.62  170.328  640.258   7.3305  643.675   6.4158 -3.416382 9.741599 
1 1 1   10    9    3 o  458.796   3.6822  4348.28   69.136  4309.20  104.249  4378.96   92.371  456.933   5.5317  460.660   4.8617 -3.726593 7.364478 
1 1 1   10    9    4 o  222.006   2.3898  1017.48   21.686  1010.87   32.894  1022.57   28.841  221.362   3.6029  222.649   3.1407 -1.286942 4.779626 
1 1 1   10    9    5 o  497.372   3.9452  5096.39   79.759  5050.60  104.070  5161.57  124.163  494.705   5.1005  500.040   6.0203 -5.334198 7.890491 
1 1 1   10    9    6 o  244.695   2.3087  1233.34   23.274  1199.35   32.005  1271.49   33.905  241.123   3.2182  248.266   3.3112 -7.143707 4.617446 
1 1 1   10    9    7 o  645.635   4.6735  8626.91  121.270  8522.55  194.143  8693.68  155.292  642.326   7.3282  648.944   5.8020 -6.618225 9.346984 
1 1 1   10    9    8 o  312.154   3.0248  2001.94   38.781  2101.36   58.056  1921.84   52.114  319.117   4.4109  305.192   4.1401 13.92480 6.049528 
1 1 1   10    9    9 o  316.658   2.8854  2072.69   37.527  2024.71   55.307  2113.62   51.088  313.247   4.2808  320.068   3.8700 -6.820862 5.770785 
1 1 1   10    9   10 o  492.139   3.7489  4995.70   73.630  5014.10  120.539  4984.75   92.996  492.804   5.9304  491.475   4.5877 1.328674 7.497828 
1 1 1   10    9   11 o   82.919   2.4118  142.045   7.9431  141.124   13.121  142.577   9.9794   82.702   3.8468   83.136   2.9104 -0.4345169 4.823672 
1 1 1   10    9   12 o  310.299   2.8791  1981.30   36.382  2022.46   56.353  1951.88   47.642  313.038   4.3647  307.560   3.7557 5.478302 5.758145 
1 1 1   10    9   13 o  166.044   2.8347  571.224   17.999  563.041   32.068  574.989   21.748  165.149   4.7079  166.940   3.1586 -1.790695 5.669311 
1 1 1   10    9   14 o  390.555   3.9770  3166.47   63.383  3032.60   95.777  3270.79   84.546  383.122   6.0612  397.987   5.1506 -14.86407 7.954015 
1 1 1   10    9   15 f  137.531   3.8871  405.677   21.157  287.831   30.933  509.264   29.001  118.006   6.3556  157.057   4.4771 -39.05097 7.774173 
1 1 1   10    9   16 o  309.628   2.9845  1974.88   37.577  1953.72   49.060  2004.91   58.447  307.654   3.8663  311.603   4.5477 -3.948944 5.969090 
1 1 1   10    9   17 o  355.255   3.0914  2590.90   43.359  2554.71   53.824  2657.81   73.179  351.806   3.7094  358.705   4.9463 -6.899994 6.182719 
1 1 1   10    9   18 o  187.741   2.5516  727.052   19.064  725.525   23.981  729.673   31.423  187.498   3.1010  187.984   4.0528 -0.4859467 5.103104 
1 1 1   10    9   19 o  160.674   2.7255  535.352   17.673  544.542   22.859  521.698   27.863  162.417   3.4125  158.930   4.2507 3.486984 5.450967 
1 1 1   10    9   20 o  120.374   3.6016  298.580   14.742  297.778   16.652  301.486   31.702  120.094   3.3618  120.654   6.3706 -0.5603790 7.203199 
1 1 1   10    9   21 o  128.677   3.2915  347.093   15.996  354.619   19.217  330.119   28.862  131.043   3.5556  126.311   5.5402 4.732285 6.583015 
1 1 1   10    9   22 f   87.765   3.3772  152.860   11.444  142.185   13.718  177.292   20.754   82.961   4.0092   92.570   5.4357 -9.608978 6.754314 
1 1 1   10    9   23 o  106.224   3.4379  231.750   15.008  209.473   20.301  258.598   22.287  100.633   4.8912  111.816   4.8325 -11.18310 6.875838 
1 1 1   10    9   24 o   59.598   5.4071   84.411   11.230  103.489   14.056   50.730   18.676   70.732   4.8181   48.465   9.6816 22.26649 10.81419 
1 1 1   10    9   25 o  135.326   3.2203  375.664   17.841  354.653   23.586  403.764   27.277  130.957   4.3668  139.696   4.7341 -8.739151 6.440606 
1 1 1   10    9   26 o   90.713   4.0653  169.972   15.128  165.243   20.244  175.953   22.766   89.309   5.4958   92.118   5.9920 -2.808769 8.130653 
1 1 1   10    9   27 o   59.709   6.8554   83.862   15.035   49.470   23.599  107.359   19.507   47.518   12.030   71.900   6.5779 -24.38268 13.71074 
1 1 1   10    9   28 o   98.467   3.9379  201.356   15.936  181.068   22.451  221.957   22.624   93.435   5.8259  103.499   5.2998 -10.06438 7.875852 
1 1 1   10    9   29 o  144.548   3.2873  432.470   19.595  443.797   27.966  421.546   27.463  146.409   4.6312  142.687   4.6666 3.721680 6.574613 
1 1 1   10    9   30 o  142.879   4.0658  424.481   23.875  381.006   33.573  468.959   33.958  135.422   6.0108  150.336   5.4766 -14.91399 8.131585 
1 1 1   10    9   31 o   77.718   5.2145  126.873   16.622  114.846   23.934  138.077   23.101   74.077   7.8338   81.360   6.8843 -7.283119 10.42891 
1 1 1   10    9   32 o   32.240   8.4729   17.198   15.269   23.934   21.504   10.349   21.684   34.930   12.166   29.550   11.796 5.380615 16.94578 
1 1 1   10    9   33 o   98.342   5.6016  211.758   21.761  163.180   33.268  248.087   28.770   87.738   9.1934  108.947   6.4026 -21.20886 11.20322 
1 1 1   10    9   34 o  127.839   4.3214  348.455   21.987  317.318   35.198  368.382   28.157  122.776   6.9508  132.902   5.1367 -10.12558 8.642879 
1 1 1   10    9   35 f   48.029   8.4906   53.437   16.941   62.706   23.452   43.322   24.499   52.595   11.157   43.463   12.802 9.132145 16.98119 
1 1 1   10    9   36 o  102.049   4.6366  220.192   19.387  220.842   29.134  219.675   25.972  102.038   6.9226  102.060   6.1700 -0.2153778E-01 9.273183 
1 1 1   10    9   37 o   33.711   8.5834   22.033   15.780   11.147   22.108   33.339   22.530   29.174   11.817   38.248   12.452 -9.074110 17.16683 
1 1 1   10    9   38 o   48.051   9.2949   56.344   18.966   53.874   27.426   58.608   26.257   46.913   13.468   49.189   12.814 -2.275612 18.58989 
1 1 1   10    9   39 o   35.971   9.5034   26.633   18.404   24.148   23.060   30.993   30.546   33.981   12.507   37.961   14.312 -3.980251 19.00681 
1 1 1   10    9   40 o   53.919   7.3544   67.974   15.921   57.116   22.882   78.162   22.165   48.656   11.571   59.183   9.0805 -10.52743 14.70886 
1 1 1   10    9   41 o   43.664   8.7723   47.468   16.624   42.411   23.784   52.299   23.246   41.299   12.715   46.029   12.089 -4.730747 17.54455 
1 1 1   10    9   42 o   33.855   8.6062   25.178   16.001   12.805   22.545   37.737   22.713   28.876   11.843   38.833   12.490 -9.957148 17.21244 
1 1 1   10    9   43 o   30.778   8.4840   18.257   16.268   30.903   22.850   5.2597   23.165   35.174   12.516   26.381   11.457 8.792955 16.96799 
1 1 1   10    9   44 o   25.486   7.8109   5.4263   15.167   5.7299   21.502   5.1257   21.398   25.594   11.076   25.378   11.016 0.2158356 15.62174 
1 1 1   10    9   45 o   44.963   9.2997   57.890   18.329   60.197   26.461   55.762   25.414   45.745   13.257   44.182   13.046 1.562843 18.59938 
1 1 1   10    9   46 f   35.241   9.3875   35.829   20.425   48.498   24.891   9.7144   35.736   40.765   13.072   29.717   13.477 11.04852 18.77506 
1 1 1   10    9   47 o   34.250   9.9595   36.494   22.713   32.506   33.467   39.900   30.926   33.208   14.082   35.292   14.088 -2.084244 19.91893 
1 1 1   10    9   48 o   42.239   10.309   65.017   23.081   46.825   34.130   80.349   31.332   35.941   14.637   48.536   14.522 -12.59565 20.61844 
1 1 1   10    9   49 o   30.469   9.4474   24.659   24.624   50.634   33.512  -5.8215   36.303   35.766   14.527   25.172   12.082 10.59359 18.89481 
1 1 1   10   10    0 o  490.462   4.1531  4965.31  118.774  4965.31  118.774  4965.31  118.774  490.462   5.8734  490.462   5.8734 0.000000 0.000000 
1 1 1   10   10    1 o  223.776   2.6896  1033.77   23.492  1035.17   28.893  1031.03   40.352  224.015   3.1272  223.537   4.3768 0.4776459 5.379160 
1 1 1   10   10    2 o  273.772   2.6088  1547.74   29.215  1557.91   38.968  1534.68   44.147  274.807   3.4381  272.737   3.9245 2.070038 5.217511 
1 1 1   10   10    3 f  442.177   3.3178  4034.61   60.507  4047.30   85.960  4022.16   85.183  442.865   4.7061  441.489   4.6781 1.376007 6.635663 
1 1 1   10   10    4 o  268.162   2.5947  1483.13   28.374  1480.56   37.409  1486.61   43.540  267.897   3.3856  268.428   3.9328 -0.5304260 5.189317 
1 1 1   10   10    5 o  482.575   3.8446  4803.27   75.602  4783.45   99.407  4830.48  116.436  481.429   5.0063  483.721   5.8362 -2.292633 7.689207 
1 1 1   10   10    6 o  470.901   3.5951  4584.38   67.940  4542.94  109.291  4610.48   86.736  469.118   5.6485  472.683   4.4490 -3.564484 7.190254 
1 1 1   10   10    7 o  264.346   2.7554  1436.04   29.941  1508.68   44.577  1376.34   40.414  270.409   3.9969  258.283   3.7938 12.12558 5.510706 
1 1 1   10   10    8 o  265.377   2.7763  1444.31   30.264  1361.35   40.627  1547.74   45.364  256.869   3.8348  273.884   4.0158 -17.01492 5.552695 
1 1 1   10   10    9 o   59.203   2.9540   73.117   7.1333   64.632   10.477   80.448   9.7389   55.963   4.5393   62.443   3.7815 -6.479885 5.908048 
1 1 1   10   10   10 o  319.178   2.7598  2105.69   35.338  2086.65   56.902  2117.64   45.086  317.980   4.3387  320.377   3.4121 -2.396759 5.519660 
1 1 1   10   10   11 o  335.475   2.8541  2323.97   38.331  2316.62   62.151  2328.49   48.694  335.018   4.4979  335.933   3.5145 -0.9146729 5.708137 
1 1 1   10   10   12 o  271.437   2.5766  1516.30   27.951  1536.73   45.706  1504.10   35.326  272.873   4.0612  270.002   3.1722 2.870941 5.153263 
1 1 1   10   10   13 o   38.512   4.7242   30.460   7.2771   35.488   11.427   27.031   9.4384   41.436   6.6865   35.588   6.6754 5.847595 9.448314 
1 1 1   10   10   14 o  227.900   2.7451  1072.43   25.792  1048.05   36.703  1096.22   36.252  225.336   3.9492  230.464   3.8138 -5.127869 5.490101 
1 1 1   10   10   15 o  278.593   2.6993  1604.74   30.028  1612.99   38.026  1591.08   48.941  279.578   3.2977  277.609   4.2744 1.969238 5.398656 
1 1 1   10   10   16 o  161.219   2.9730  532.016   19.630  574.342   29.966  500.198   25.981  166.780   4.3562  155.657   4.0469 11.12357 5.945945 
1 1 1   10   10   17 o  188.516   2.5666  730.834   19.124  724.020   23.799  743.256   32.131  187.306   3.0806  189.726   4.1061 -2.419327 5.133223 
1 1 1   10   10   18 o  160.671   2.6124  532.265   16.537  530.599   20.529  535.345   27.908  160.340   3.1043  161.002   4.2027 -0.6618195 5.224847 
1 1 1   10   10   19 o  109.801   3.0999  252.128   13.545  261.357   17.217  237.141   21.940  112.500   3.7107  107.103   4.9667 5.396782 6.199767 
1 1 1   10   10   20 o  285.738   3.2720  1665.76   34.236  1640.68   39.927  1735.42   66.535  281.879   3.4343  289.598   5.5704 -7.719116 6.544001 
1 1 1   10   10   21 o  316.525   3.4476  2070.70   39.976  2069.78   46.800  2073.15   76.885  316.585   3.5842  316.465   5.8905 0.1196899 6.895230 
1 1 1   10   10   22 o  179.116   2.8215  663.605   20.700  669.269   27.761  656.511   31.067  179.999   3.7393  178.234   4.2261 1.765198 5.642931 
1 1 1   10   10   23 o  103.834   3.1808  228.662   12.862  242.005   16.039  204.623   21.529  108.237   3.5929   99.431   5.2497 8.806007 6.361509 
1 1 1   10   10   24 o   74.458   4.1445  111.079   12.003  104.098   14.511  126.206   21.361   70.927   4.9605   77.990   6.6408 -7.063751 8.288948 
1 1 1   10   10   25 o  165.026   3.5147  584.015   20.960  607.969   24.626  521.045   39.926  171.544   3.4805  158.508   6.1072 13.03635 7.029348 
1 1 1   10   10   26 o  230.839   2.9484  1095.14   27.709  1061.59   36.138  1143.01   43.165  226.619   3.8664  235.059   4.4523 -8.439285 5.896811 
1 1 1   10   10   27 o  274.413   3.4395  1558.59   38.702  1562.31   57.970  1555.60   51.985  274.652   5.1174  274.175   4.5971 0.4768066 6.879041 
1 1 1   10   10   28 f  198.488   3.4200  818.857   27.893  765.644   40.327  867.661   38.620  192.239   5.0861  204.737   4.5736 -12.49734 6.840045 
1 1 1   10   10   29 o   79.880   4.8127  132.871   15.839  127.022   22.528  138.589   22.275   78.121   6.9917   81.640   6.6154 -3.518555 9.625343 
1 1 1   10   10   30 o   57.424   7.8140   72.959   17.816   59.128   26.766   83.963   23.873   51.632   12.665   63.216   9.1563 -11.58367 15.62795 
1 1 1   10   10   31 o   78.752   6.1449  125.900   19.126  115.573   23.478  146.273   32.978   74.290   7.6626   83.214   9.6085 -8.924850 12.28981 
1 1 1   10   10   32 o  113.121   3.9689  266.418   18.512  263.354   26.404  269.379   25.961  112.467   5.6922  113.776   5.5323 -1.309143 7.937744 
1 1 1   10   10   33 o  103.691   5.4056  239.355   21.780  164.356   32.827  298.330   29.110   87.902   9.0546  119.479   5.9073 -31.57700 10.81118 
1 1 1   10   10   34 o   28.939   8.3174   9.0973   15.584   6.5200   22.262   11.574   21.823   28.184   11.685   29.694   11.840 -1.509167 16.63486 
1 1 1   10   10   35 o   69.254   5.8521  103.167   16.504  123.266   23.613   83.969   23.078   76.103   7.5229   62.405   8.9663 13.69783 11.70418 
1 1 1   10   10   36 o   63.153   6.6604   86.514   17.229   87.255   25.948   85.930   23.040   63.210   9.9530   63.096   8.8535 0.1140251 13.32087 
1 1 1   10   10   37 f   40.466   8.7008   38.493   16.097   29.769   22.927   46.974   22.605   36.476   12.570   44.457   12.034 -7.980656 17.40170 
1 1 1   10   10   38 f   41.410   8.9220   39.479   17.512   22.521   24.086   58.494   25.506   33.621   12.701   49.199   12.534 -15.57840 17.84409 
1 1 1   10   10   39 o   57.916   8.3203   77.647   18.542   73.060   23.061   86.036   31.186   56.333   10.305   59.500   13.066 -3.167568 16.64064 
1 1 1   10   10   40 o   34.707   8.9876   24.841   18.752  -1.7621   30.028   41.848   24.009   28.279   12.627   41.135   12.793 -12.85603 17.97520 
1 1 1   10   10   41 o   98.991   4.5769  211.566   18.664  226.290   26.788  197.678   26.018  102.426   6.3412   95.556   6.6015 6.869667 9.153743 
1 1 1   10   10   42 o   23.502   7.5212  -6.2189   15.702   0.5504   22.843 -12.2828   21.620   25.304   11.171   21.700   10.074 3.604652 15.04243 
1 1 1   10   10   43 o   29.045   8.4881   13.290   16.738   5.5043   23.101   21.894   24.285   26.328   11.437   31.762   12.545 -5.434168 16.97615 
1 1 1   10   10   44 o   32.904   8.8065   25.103   17.787   5.8811   26.736   40.364   23.824   27.348   12.079   38.461   12.818 -11.11275 17.61302 
1 1 1   10   10   45 o   24.421   7.7716  -1.5795   16.748   9.7878   23.903 -12.5397   23.472   27.030   11.688   21.812   10.246 5.218317 15.54318 
1 1 1   10   10   46 o   24.630   8.1235  -5.4793   19.495  -4.6426   24.183  -7.0326   32.949   23.349   10.774   25.911   12.161 -2.562326 16.24693 
1 1 1   10   10   47 o   33.487   9.7350   32.186   21.958   48.213   32.401   18.575   29.860   37.511   14.586   29.462   12.897 8.049194 19.47007 
1 1 1   10   10   48 o   27.067   8.6751   3.1337   21.469   36.076   32.786 -21.5964   28.407   32.787   13.922   21.347   10.354 11.43997 17.35020 
1 1 1   10   10   49 o   37.884   10.322   56.724   22.686   62.121   33.880   52.337   30.544   38.855   14.969   36.913   14.215 1.941280 20.64302 
1 1 1   10   11    0 o   71.103   2.1609  104.849   8.9241  104.849   8.9241  104.849   8.9241   71.103   3.0559   71.103   3.0559 0.000000 0.000000 
1 1 1   10   11    1 o  201.168   2.2921  831.120   18.745  856.301   29.279  813.631   24.401  203.733   3.4844  198.603   2.9789 5.130707 4.584158 
1 1 1   10   11    2 o  283.470   2.4713  1657.41   28.889  1640.72   40.408  1674.84   41.317  282.012   3.4741  284.928   3.5158 -2.915985 4.942672 
1 1 1   10   11    3 o  322.997   2.6637  2152.03   35.479  2132.76   49.635  2172.16   50.734  321.520   3.7430  324.474   3.7910 -2.953827 5.327419 
1 1 1   10   11    4 o  365.173   3.1086  2755.63   46.500  2716.95   69.707  2786.64   62.417  362.847   4.6578  367.499   4.1179 -4.652130 6.217141 
1 1 1   10   11    5 o  318.655   3.2370  2095.55   40.151  2095.02   69.391  2095.81   49.230  318.590   5.2809  318.721   3.7450 -0.1312866 6.473996 
1 1 1   10   11    6 o  241.185   2.6313  1193.08   26.079  1120.93   35.094  1282.07   38.974  233.091   3.6504  249.278   3.7908 -16.18707 5.262645 
1 1 1   10   11    7 o  252.939   2.5511  1322.94   26.509  1282.86   38.921  1357.63   36.205  249.352   3.7845  256.527   3.4219 -7.175171 5.102131 
1 1 1   10   11    8 o  185.905   2.6734  714.285   20.217  720.394   26.545  705.848   31.196  186.861   3.4443  184.948   4.0896 1.913177 5.346758 
1 1 1   10   11    9 o  432.326   3.7779  3858.93   67.362  3847.92   94.875  3870.11   95.658  431.706   5.3284  432.946   5.3570 -1.240479 7.555758 
1 1 1   10   11   10 o  356.626   3.6490  2637.05   53.318  2737.51   72.227  2516.75   79.038  364.150   4.8090  349.103   5.4893 15.04739 7.297902 
1 1 1   10   11   11 o  307.784   2.7089  1959.30   33.504  1935.53   53.662  1974.47   42.891  306.226   4.2488  309.342   3.3617 -3.115845 5.417863 
1 1 1   10   11   12 o  257.123   2.4922  1359.10   25.534  1384.13   42.111  1344.55   32.110  258.967   3.9426  255.279   3.0497 3.688766 4.984447 
1 1 1   10   11   13 o  119.649   2.5824  295.991   12.720  283.067   18.286  308.106   17.705  117.111   3.7859  122.187   3.5132 -5.076859 5.164815 
1 1 1   10   11   14 o  127.999   2.8917  338.059   15.253  334.513   21.092  341.947   22.084  127.298   4.0173  128.700   4.1605 -1.401985 5.783468 
1 1 1   10   11   15 o  315.253   3.0228  2045.43   38.800  2011.93   50.763  2092.51   60.174  312.186   3.9424  318.320   4.5833 -6.133209 6.045601 
1 1 1   10   11   16 o  218.294   2.6644  984.076   23.733  986.024   31.376  981.471   36.284  218.564   3.4806  218.025   4.0349 0.5391846 5.328741 
1 1 1   10   11   17 o  354.402   3.0565  2605.27   43.590  2646.35   56.062  2542.47   69.320  358.012   3.7967  350.792   4.7912 7.220825 6.113093 
1 1 1   10   11   18 o   68.972   3.9001  102.382   10.191  109.528   12.446   87.844   17.751   72.817   4.1440   65.128   6.6084 7.689018 7.800254 
1 1 1   10   11   19 o  148.169   2.8695  454.448   17.483  466.759   24.011  440.556   25.507  150.321   3.8728  146.017   4.2353 4.304016 5.739002 
1 1 1   10   11   20 o  119.937   3.3164  293.849   15.467  287.089   18.842  307.816   27.083  117.892   3.8750  121.981   5.3831 -4.088928 6.632728 
1 1 1   10   11   21 o  130.478   3.6013  356.879   16.007  360.655   18.156  343.696   33.924  132.160   3.3308  128.796   6.3862 3.363983 7.202582 
1 1 1   10   11   22 o  167.759   3.1971  582.452   22.047  522.550   30.910  644.488   31.455  158.951   4.7148  176.566   4.3194 -17.61559 6.394257 
1 1 1   10   11   23 o   98.542   3.2318  201.411   12.424  202.670   15.294  198.968   21.306   99.041   3.7439   98.042   5.2689 0.9992905 6.463592 
1 1 1   10   11   24 o  139.439   3.7024  401.315   21.208  353.696   29.176  454.665   30.882  130.677   5.4134  148.201   5.0523 -17.52429 7.404718 
1 1 1   10   11   25 f  128.511   2.9309  339.566   14.773  335.369   18.207  347.654   25.276  127.407   3.4648  129.616   4.7281 -2.209381 5.861728 
1 1 1   10   11   26 f  103.946   3.7479  224.797   15.994  237.913   22.032  210.185   23.255  107.192   4.9834  100.699   5.5993 6.493164 7.495728 
1 1 1   10   11   27 o  166.836   3.6314  582.823   24.551  457.278   34.636  709.602   34.806  148.503   5.6550  185.169   4.5574 -36.66577 7.262871 
1 1 1   10   11   28 o   44.118   6.6139   40.943   10.599   40.277   12.314   42.845   20.821   44.007   6.7842   44.228   11.356 -0.2208405 13.22787 
1 1 1   10   11   29 o  108.550   4.3344  241.668   18.975  230.342   24.161  259.896   30.652  105.349   5.5605  111.750   6.6503 -6.401260 8.668705 
1 1 1   10   11   30 o  113.227   4.0689  267.110   18.831  261.815   28.449  271.240   25.123  112.161   6.1497  114.292   5.3295 -2.130508 8.137733 
1 1 1   10   11   31 o   96.939   5.3232  199.454   20.316  205.974   25.466  188.042   33.694   99.393   6.2122   94.486   8.6460 4.907036 10.64638 
1 1 1   10   11   32 o   54.375   8.1865   68.047   17.735   50.561   28.178   79.518   22.823   47.459   13.659   61.291   9.0284 -13.83237 16.37304 
1 1 1   10   11   33 o  138.109   3.6000  397.950   20.493  409.241   28.754  386.295   29.214  140.136   4.9749  136.083   5.2049 4.052261 7.200034 
1 1 1   10   11   34 o   28.398   8.1812   8.2567   15.179   3.4660   21.098   13.398   21.855   26.525   11.210   30.272   11.919 -3.747414 16.36232 
1 1 1   10   11   35 o   30.494   8.1865   13.314   15.265  -2.4158   22.087   27.699   21.121   25.215   11.063   35.773   12.070 -10.55797 16.37298 
1 1 1   10   11   36 f   40.068   8.5766   35.939   16.100   21.536   22.389   51.364   23.169   33.253   12.308   46.884   11.947 -13.63139 17.15316 
1 1 1   10   11   37 o   35.673   8.7468   27.981   16.306   37.305   21.849   16.261   24.497   39.768   12.177   31.579   12.559 8.188307 17.49360 
1 1 1   10   11   38 o   38.179   8.4861   33.714   15.519   21.302   22.149   45.687   21.752   32.619   12.209   43.739   11.790 -11.11990 16.97220 
1 1 1   10   11   39 o   51.213   7.8100   63.041   16.545   39.927   23.704   84.997   23.102   40.572   12.727   61.853   9.0559 -21.28111 15.62009 
1 1 1   10   11   40 o   42.423   9.3170   46.621   19.335   24.187   31.485   60.204   24.500   35.317   14.173   49.529   12.097 -14.21193 18.63402 
1 1 1   10   11   41 o   30.033   8.5100   16.006   16.019   16.300   23.040   15.730   22.288   30.246   12.129   29.819   11.940 0.4268456 17.01996 
1 1 1   10   11   42 o   41.401   8.4288   43.296   16.327   63.309   23.235   23.775   22.947   50.304   11.455   32.498   12.368 17.80576 16.85764 
1 1 1   10   11   43 o   43.956   8.3420   50.790   16.034   65.340   22.375   35.433   22.988   51.098   10.946   36.813   12.591 14.28532 16.68392 
1 1 1   10   11   44 o   33.535   9.0821   26.561   18.218   44.248   27.120   12.016   24.593   39.095   13.660   27.974   11.972 11.12085 18.16413 
1 1 1   10   11   45 o   20.640   6.9690 -21.6933   16.735  -7.8398   24.138 -34.5165   23.223   22.962   10.654   18.317   8.9865 4.644680 13.93793 
1 1 1   10   11   46 o   28.366   9.4896 -10.0072   24.636   40.860   48.406 -27.7889   28.620   35.472   15.922   21.261   10.330 14.21134 18.97920 
1 1 1   10   11   47 o   40.561   10.449   58.943   23.564   44.121   34.566   71.812   32.209   35.731   14.661   45.391   14.894 -9.659321 20.89885 
1 1 1   10   11   48 o   35.517   10.740   47.545   26.200   75.525   46.765   34.746   31.630   38.917   16.579   32.117   13.657 6.799965 21.47972 
1 1 1   10   12    0 o  416.306   3.1673  3576.49   76.890  3576.49   76.890  3576.49   76.890  416.306   4.4792  416.306   4.4792 0.000000 0.000000 
1 1 1   10   12    1 o  328.429   2.6871  2225.49   36.400  2225.24   51.471  2225.74   51.483  328.410   3.8000  328.447   3.8004 -0.3726196E-01 5.374287 
1 1 1   10   12    2 o  212.948   2.1600  935.197   18.968  922.569   26.528  948.406   27.131  211.478   3.0414  214.418   3.0679 -2.940155 4.320020 
1 1 1   10   12    3 o  310.493   2.5978  1988.31   33.257  1962.38   46.335  2015.86   47.762  308.407   3.6427  312.579   3.7047 -4.172180 5.195583 
1 1 1   10   12    4 o  323.569   2.6652  2160.13   35.568  2152.78   50.088  2167.59   50.516  323.015   3.7596  324.124   3.7788 -1.108398 5.330476 
1 1 1   10   12    5 o  646.416   4.6674  8655.16  121.536  8516.97  193.129  8745.77  156.384  642.017   7.2935  650.815   5.8260 -8.798218 9.334732 
1 1 1   10   12    6 o  215.601   2.3708  953.852   20.744  987.340   32.624  931.125   26.876  218.753   3.6159  212.450   3.0672 6.303375 4.741604 
1 1 1   10   12    7 f  190.154   2.4137  743.420   18.897  696.748   25.847  797.010   27.696  183.765   3.4102  196.542   3.4167 -12.77737 4.827321 
1 1 1   10   12    8 o  317.894   2.8744  2089.64   37.540  2035.55   55.189  2136.22   51.213  314.046   4.2608  321.742   3.8593 -7.696136 5.748842 
1 1 1   10   12    9 f  268.324   2.8434  1498.76   29.055  1452.24   51.926  1519.96   35.057  265.226   4.7468  271.423   3.1316 -6.197174 5.686767 
1 1 1   10   12   10 o   66.802   2.8907   91.069   7.3775   94.846   13.345   89.406   8.8533   67.778   4.7739   65.826   3.2609 1.951973 5.781317 
1 1 1   10   12   11 o  378.285   3.4322  2945.19   53.356  3063.31   79.493  2848.35   71.979  385.150   5.0042  371.421   4.6987 13.72867 6.864350 
1 1 1   10   12   12 o   94.802   3.9450  185.514   15.425   0.0000   0.0000  185.514   15.425  ?   ?    94.802   3.9450      ?      ? 
1 1 1   10   12   13 o  141.954   2.4723  415.473   14.468  429.436   20.861  402.534   20.082  144.249   3.5063  139.658   3.4864 4.590714 4.944579 
1 1 1   10   12   14 o  271.893   3.2954  1520.67   36.237  1496.48   46.680  1557.35   57.483  269.220   4.2039  274.565   5.0761 -5.344849 6.590878 
1 1 1   10   12   15 o  129.563   2.8990  353.183   14.734  369.444   18.445  324.518   24.490  133.789   3.3427  125.337   4.7374 8.452240 5.797963 
1 1 1   10   12   16 o  111.358   3.0364  258.409   13.817  280.783   18.876  232.582   20.280  116.611   3.9247  106.104   4.6342 10.50663 6.072823 
1 1 1   10   12   17 o  367.227   3.4858  2785.64   52.771  2849.14   76.093  2726.80   73.247  371.249   4.9695  363.205   4.8896 8.044220 6.971653 
1 1 1   10   12   18 o   99.336   2.9714  205.025   11.644  207.866   14.541  199.948   19.440  100.330   3.5140   98.343   4.7927 1.986649 5.942878 
1 1 1   10   12   19 o  204.061   3.0802  860.282   24.706  859.767   30.609  861.245   41.851  204.037   3.6372  204.085   4.9720 -0.4750061E-01 6.160335 
1 1 1   10   12   20 o  134.579   2.9127  378.376   15.956  407.529   21.457  342.309   23.866  140.467   3.7036  128.690   4.4965 11.77701 5.825337 
1 1 1   10   12   21 f  185.544   3.2438  710.758   21.082  709.746   24.115  714.037   43.421  185.398   3.1537  185.691   5.6694 -0.2935486 6.487572 
1 1 1   10   12   22 f  121.887   2.9805  315.509   14.184  336.091   17.771  279.386   23.542  127.565   3.3776  116.209   4.9119 11.35609 5.961098 
1 1 1   10   12   23 o   34.484   6.6754   21.157   9.4910   13.133   11.329   40.047   17.382   26.057   8.8393   42.911   10.006 -16.85410 13.35077 
1 1 1   10   12   24 o  111.298   3.1398  250.595   13.510  240.706   16.307  272.230   24.121  107.927   3.6634  114.668   5.1002 -6.740471 6.279523 
1 1 1   10   12   25 o  165.807   3.0159  567.863   20.455  562.882   27.180  574.369   31.062  164.999   3.9939  166.615   4.5201 -1.615173 6.031806 
1 1 1   10   12   26 o   80.583   4.4846  134.756   14.901  132.720   20.770  136.915   21.389   79.960   6.2980   81.206   6.3860 -1.246422 8.969146 
1 1 1   10   12   27 o  227.037   3.2005  1065.59   29.944  1035.38   41.320  1099.00   43.456  223.661   4.4792  230.413   4.5728 -6.752396 6.401092 
1 1 1   10   12   28 o   76.130   4.3886  118.797   13.358  114.108   16.782  126.905   22.068   74.170   5.4861   78.091   6.8515 -3.921692 8.777261 
1 1 1   10   12   29 o  142.456   3.5630  417.898   19.026  413.690   22.554  428.281   35.430  141.392   3.8674  143.521   5.9853 -2.129318 7.126084 
1 1 1   10   12   30 f  236.465   3.6132  1146.87   34.546  1231.86   55.364  1092.69   44.207  243.414   5.5147  229.516   4.6700 13.89883 7.226342 
1 1 1   10   12   31 o   93.800   6.1983  185.817   21.258  186.086   24.903  185.096   40.815   94.418   6.3948   93.183   10.620 1.234795 12.39665 
1 1 1   10   12   32 o  103.328   5.1053  224.633   21.326  224.663   33.643  224.612   27.573  103.129   7.9094  103.528   6.4574 -0.3990936 10.21066 
1 1 1   10   12   33 o   62.293   6.5767   85.579   15.956  109.724   22.699   61.997   22.433   71.975   7.6466   52.612   10.702 19.36275 13.15337 
1 1 1   10   12   34 o  126.619   3.7093  335.174   19.350  315.027   26.789  357.153   27.981  122.629   5.2967  130.609   5.1942 -7.980942 7.418511 
1 1 1   10   12   35 f  128.069   3.6547  343.553   19.298  356.048   27.459  331.359   27.127  130.394   5.1057  125.745   5.2305 4.649559 7.309335 
1 1 1   10   12   36 o   38.706   8.8419   34.747   16.094   33.377   22.906   36.083   22.618   38.099   12.563   39.314   12.445 -1.214817 17.68371 
1 1 1   10   12   37 o   56.524   8.4957   75.651   19.060   77.787   28.981   74.023   25.302   56.832   12.685   56.215   11.305 0.6169014 16.99141 
1 1 1   10   12   38 o   54.536   7.6218   69.154   16.536   69.279   23.308   69.027   23.462   54.612   10.731   54.459   10.827 0.1528587 15.24357 
1 1 1   10   12   39 o   35.187   8.3715   27.204   16.328   3.0062   24.993   45.222   21.567   27.318   11.882   43.055   11.796 -15.73724 16.74306 
1 1 1   10   12   40 o   37.129   9.2701   33.168   19.142   45.905   23.722   9.3991   32.407   42.801   12.595   31.456   13.606 11.34573 18.54019 
1 1 1   10   12   41 o   46.789   8.2529   55.169   16.260   40.270   23.350   69.197   22.656   39.881   12.647   53.697   10.606 -13.81597 16.50572 
1 1 1   10   12   42 o   20.654   6.9086 -17.9006   15.627 -23.2762   22.903 -13.2179   21.376   20.170   9.6582   21.139   9.8810 -0.9697647 13.81720 
1 1 1   10   12   43 o   50.128   7.8022   63.393   15.702   70.421   22.758   57.008   21.693   53.082   10.763   47.173   11.298 5.909241 15.60449 
1 1 1   10   12   44 o   37.655   9.5086   40.093   18.677   49.584   28.043   32.527   25.038   40.756   13.907   34.554   12.971 6.202713 19.01711 
1 1 1   10   12   45 o   32.019   9.4281   24.718   19.967   23.879   24.564   26.352   34.277   31.154   12.513   32.885   14.106 -1.731077 18.85625 
1 1 1   10   12   46 o   31.638   13.314   27.078   29.551   0.0000   0.0000   27.078   29.551  ?   ?    31.638   13.314      ?      ? 
1 1 1   10   12   47 o   26.165   8.8501  -4.8256   25.878 -24.2549   49.647   2.4228   30.324   26.589   13.064   25.742   11.943 0.8471794 17.70025 
1 1 1   10   12   48 o   24.928   8.4208  -5.4104   24.474   4.3717   33.920 -16.0329   35.347   26.115   12.283   23.740   11.523 2.374807 16.84163 
1 1 1   10   13    0 o  184.137   2.0752  699.879   22.276  699.879   22.276  699.879   22.276  184.137   2.9348  184.137   2.9348 0.000000 0.000000 
1 1 1   10   13    1 o  312.531   2.6107  2015.33   33.652  2007.65   47.384  2023.14   47.801  311.931   3.6831  313.131   3.7012 -1.200317 5.221480 
1 1 1   10   13    2 o  210.804   2.1515  916.685   18.705  909.668   26.285  923.885   26.624  209.987   3.0350  211.621   3.0503 -1.634186 4.302949 
1 1 1   10   13    3 o  258.559   2.3466  1379.02   25.020  1364.91   35.008  1393.75   35.772  257.208   3.3000  259.910   3.3370 -2.702118 4.693156 
1 1 1   10   13    4 o  316.907   2.7507  2064.82   34.782  2102.44   57.168  2042.70   43.828  319.164   4.3428  314.649   3.3772 4.515228 5.501431 
1 1 1   10   13    5 o  206.312   2.2359  881.274   18.587  863.429   29.482  893.046   23.945  204.562   3.4944  208.062   2.7904 -3.499680 4.471769 
1 1 1   10   13    6 o  464.469   3.7299  4452.82   70.681  4467.66  108.285  4441.80   93.298  465.099   5.6449  463.839   4.8769 1.259125 7.459807 
1 1 1   10   13    7 o  119.155   2.1715  290.454   10.555  309.065   16.376  277.226   13.806  122.390   3.2441  115.921   2.8876 6.469193 4.343095 
1 1 1   10   13    8 o  214.124   2.4152  947.159   21.237  933.919   31.417  958.299   28.818  212.738   3.5806  215.510   3.2421 -2.771469 4.830316 
1 1 1   10   13    9 o  360.301   2.9683  2686.38   43.008  2649.16   68.711  2710.35   55.146  358.204   4.6508  362.397   3.6895 -4.192535 5.936541 
1 1 1   10   13   10 o  215.617   3.1868  862.873   26.439  1247.14   49.587  710.234   31.253  245.744   4.8924  185.489   4.0851 60.25447 6.373627 
1 1 1   10   13   11 o  165.862   2.2633  562.567   15.189  593.357   24.211  542.583   19.505  169.562   3.4619  162.163   2.9163 7.399567 4.526510 
1 1 1   10   13   12 o  385.894   3.5772  3074.51   51.627  3079.63   96.017  3072.44   61.232  385.985   6.0313  385.803   3.8481 0.1820679 7.154347 
1 1 1   10   13   13 o  193.541   2.4182  771.465   19.168  759.596   25.546  786.755   28.995  191.850   3.2285  195.232   3.6009 -3.381973 4.836303 
1 1 1   10   13   14 o  209.916   2.9330  903.344   23.541  927.518   42.375  892.552   28.312  211.881   4.8490  207.952   3.3010 3.929016 5.865930 
1 1 1   10   13   15 o  218.578   2.8944  986.085   26.080  942.702   36.443  1031.62   37.338  213.650   4.1357  223.506   4.0504 -9.856201 5.788724 
1 1 1   10   13   16 f  168.134   2.8543  590.860   17.921  600.588   21.327  567.489   33.057  170.577   3.0314  165.692   4.8373 4.885040 5.708651 
1 1 1   10   13   17 o   62.731   7.4899   81.654   19.379   81.654   19.379   0.0000   0.0000   62.731   7.4899  ?   ?       ?      ? 
1 1 1   10   13   18 o  154.649   2.5830  499.195   15.832  513.898   19.972  474.337   25.970  157.778   3.0691  151.519   4.1556 6.259369 5.166096 
1 1 1   10   13   19 o  188.508   3.4755  737.578   21.783  739.501   24.437  730.142   48.060  189.261   3.1305  187.755   6.2062 1.505463 6.951015 
1 1 1   10   13   20 o  213.107   2.9976  941.693   25.091  948.591   31.122  928.885   42.409  214.302   3.5211  211.913   4.8522 2.389221 5.995152 
1 1 1   10   13   21 o  148.466   2.7825  456.956   16.589  462.057   21.233  448.964   26.578  149.568   3.4420  147.363   4.3728 2.205109 5.564995 
1 1 1   10   13   22 o   67.602   6.9264  118.382   12.859  129.646   14.248   68.915   29.858   79.180   4.3630   56.024   13.148 23.15583 13.85277 
1 1 1   10   13   23 o  181.820   3.0747  674.051   21.772  655.265   26.535  712.750   38.085  178.079   3.6128  185.562   4.9762 -7.482986 6.149419 
1 1 1   10   13   24 f   79.522   3.6069  127.245   11.156  120.375   13.508  141.986   19.787   76.289   4.2931   82.755   5.7971 -6.466087 7.213712 
1 1 1   10   13   25 o   45.621   6.2939   51.806   10.397   62.462   12.485   27.698   18.778   54.898   5.5141   36.343   11.316 18.55499 12.58785 
1 1 1   10   13   26 o  255.042   3.0404  1343.10   31.722  1324.98   42.122  1366.84   48.215  253.109   4.0350  256.975   4.5491 -3.865860 6.080719 
1 1 1   10   13   27 o   51.578   6.2161   60.203   14.367  128.231   20.778  -2.1147   19.887   78.552   6.4134   24.604   10.650 53.94748 12.43216 
1 1 1   10   13   28 o  143.633   3.7240  428.656   21.959  421.069   32.498  435.031   29.790  142.416   5.5326  144.849   4.9864 -2.432358 7.448016 
1 1 1   10   13   29 o   25.708   6.8244   9.8083   10.586   18.034   12.268 -14.1649   20.944   29.335   9.1485   22.081   10.129 7.254116 13.64876 
1 1 1   10   13   30 o  120.133   3.8236  299.961   18.917  296.715   25.991  303.619   27.586  119.467   5.2749  120.799   5.5368 -1.332481 7.647241 
1 1 1   10   13   31 o   19.139   6.2412  -7.0724   9.6283  -4.2222   10.807 -18.0399   21.200   16.966   7.5756   21.311   9.9206 -4.345039 12.48232 
1 1 1   10   13   32 o   82.653   8.6511  138.817   27.113  123.168   31.851  180.003   51.671   75.593   10.216   89.714   13.964 -14.12173 17.30224 
1 1 1   10   13   33 o   61.159   6.5782   82.046   16.053   93.296   22.568   70.525   22.838   66.092   8.2791   56.225   10.225 9.866611 13.15644 
1 1 1   10   13   34 o  110.535   3.9813  256.839   18.132  242.979   25.584  270.826   25.702  107.486   5.7710  113.585   5.4863 -6.098602 7.962690 
1 1 1   10   13   35 o   46.309   7.6673   49.294   15.366   27.506   21.795   70.823   21.666   35.614   12.257   57.003   9.2152 -21.38953 15.33467 
1 1 1   10   13   36 o   47.693   8.3218   54.250   16.348   60.823   22.768   47.256   23.486   50.985   11.139   44.402   12.367 6.583035 16.64367 
1 1 1   10   13   37 o   37.360   9.2626   31.743   17.485   29.420   27.985   33.230   22.395   36.955   13.745   37.764   12.421 -0.8093262 18.52527 
1 1 1   10   13   38 o   28.196   7.9604   5.1208   15.179   27.535   22.891 -12.4682   20.278   35.133   12.525   21.258   9.8288 13.87430 15.92077 
1 1 1   10   13   39 o   65.289   9.2237  122.353   21.969   66.179   40.589  145.626   26.126   49.061   16.731   81.517   7.7707 -32.45633 18.44731 
1 1 1   10   13   40 o   31.198   9.0730   15.163   18.116   11.370   22.614   21.959   30.267   28.479   11.789   33.917   13.795 -5.438139 18.14596 
1 1 1   10   13   41 o   27.039   8.1472   7.6956   16.003   4.5657   23.651   10.339   21.733   26.563   11.556   27.514   11.487 -0.9510803 16.29430 
1 1 1   10   13   42 o   46.001   8.3955   55.263   16.311   43.791   23.249   66.383   22.889   40.585   12.584   51.417   11.117 -10.83203 16.79110 
1 1 1   10   13   43 o   30.141   9.2563   14.525   20.631   15.148   25.276   13.282   35.710   29.179   12.298   31.103   13.838 -1.924625 18.51253 
1 1 1   10   13   44 o   41.452   9.6043   48.248   19.938   28.428   26.694   73.256   29.986   33.162   13.135   49.743   14.016 -16.58084 19.20864 
1 1 1   10   13   45 f   20.507   7.0686 -29.2271   18.534 -20.8412   29.590 -34.6408   23.775   22.648   10.880   18.366   9.0269 4.282436 14.13730 
1 1 1   10   13   46 o   35.853   10.526   42.187   29.830  -9.6917   50.175   70.548   37.098   28.585   13.840   43.120   15.865 -14.53459 21.05298 
1 1 1   10   13   47 o   34.025   10.755   38.137   28.101   22.113   33.336   77.478   52.233   29.544   13.240   38.507   16.952 -8.963123 21.50940 
1 1 1   10   13   48 o   27.027   8.6502   10.858   22.115 -15.9909   34.128   30.295   29.037   23.368   11.337   30.686   13.068 -7.317980 17.30039 
1 1 1   10   14    0 o  355.827   2.8302  2613.04   58.724  2613.04   58.724  2613.04   58.724  355.827   4.0025  355.827   4.0025 0.000000 0.000000 
1 1 1   10   14    1 o  252.904   2.3176  1319.69   24.174  1319.13   34.181  1320.24   34.194  252.850   3.2776  252.957   3.2775 -0.1066284 4.635165 
1 1 1   10   14    2 o  152.144   1.9708  477.496   12.366  483.387   17.578  471.724   17.401  153.073   2.7842  151.215   2.7900 1.857971 3.941580 
1 1 1   10   14    3 o  229.470   2.3152  1089.26   21.387  1073.48   34.066  1099.53   27.476  228.081   3.6213  230.859   2.8856 -2.778275 4.630397 
1 1 1   10   14    4 o  128.576   2.0630  343.935   10.685  327.096   16.821  355.324   13.834  125.909   3.2392  131.242   2.5556 -5.333351 4.125943 
1 1 1   10   14    5 o  408.964   3.2205  3467.42   53.263  3376.33   83.442  3530.06   69.195  404.367   5.0031  413.561   4.0566 -9.194397 6.441093 
1 1 1   10   14    6 o  301.299   2.7779  1873.72   34.196  1873.19   52.047  1874.12   45.361  301.244   4.1890  301.353   3.6496 -0.1092224 5.555848 
1 1 1   10   14    7 o  374.147   3.0376  2895.89   45.664  2862.90   73.177  2916.93   58.438  372.352   4.7649  375.941   3.7689 -3.588745 6.075266 
1 1 1   10   14    8 o   62.261   2.8043   80.458   7.1497   75.611   10.571   84.544   9.7062   60.519   4.2352   64.002   3.6770 -3.483395 5.608660 
1 1 1   10   14    9 o  229.443   2.5940  1070.17   24.270  1193.44   37.925  984.675   31.585  240.455   3.8241  218.430   3.5059 22.02498 5.188004 
1 1 1   10   14   10 o  225.202   3.2402  938.074   27.946  1360.04   52.981  775.419   32.894  256.600   5.0061  193.805   4.1151 62.79581 6.480349 
1 1 1   10   14   11 o  112.629   2.4672  257.543   10.605  273.038   19.299  250.839   12.694  114.999   4.0689  110.259   2.7913 4.740494 4.934323 
1 1 1   10   14   12 o  219.840   3.1354  972.005   27.910  1135.16   44.996  869.974   35.582  234.425   4.6537  205.255   4.2031 29.16985 6.270852 
1 1 1   10   14   13 o  302.054   2.8336  1880.81   34.904  1863.21   45.936  1904.84   53.690  300.414   3.7074  303.694   4.2864 -3.280304 5.667264 
1 1 1   10   14   14 o  184.231   2.2965  698.809   17.426  736.596   25.463  665.522   23.899  188.902   3.2682  179.560   3.2270 9.342529 4.592911 
1 1 1   10   14   15 o   40.238   5.7344   34.809   9.1842   34.927   13.199   34.699   12.788   40.289   8.2214   40.187   7.9963 0.1019783 11.46877 
1 1 1   10   14   16 o  158.305   2.4692  515.806   15.536  511.236   19.479  523.798   25.757  157.372   3.0010  159.238   3.9218 -1.866211 4.938330 
1 1 1   10   14   17 o  102.241   4.7198  239.331   17.858  152.257   29.074  292.082   22.629   85.609   8.2342  118.872   4.6156 -33.26337 9.439561 
1 1 1   10   14   18 o  216.346   2.9512  967.913   26.313  934.374   37.480  1000.51   36.950  212.637   4.2736  220.055   4.0711 -7.418030 5.902344 
1 1 1   10   14   19 o   54.803   4.6756   58.530   9.7643   53.143   11.532   72.174   18.352   50.664   5.5187   58.942   7.5491 -8.278191 9.351175 
1 1 1   10   14   20 o   39.225   5.0148   38.960   9.8895   74.281   12.816 -13.0278   15.549   59.910   5.1867   18.541   8.5844 41.36922 10.02962 
1 1 1   10   14   21 o  177.611   3.1245  653.757   22.806  588.479   32.190  719.546   32.316  168.666   4.6273  186.556   4.1999 -17.89003 6.249076 
1 1 1   10   14   22 o  208.263   4.4441  842.458   27.235  819.520   29.357  984.143   72.961  199.156   3.5740  217.370   8.1381 -18.21394 8.888299 
1 1 1   10   14   23 o   44.958   6.5673   44.063   10.264   45.032   11.728   40.890   21.219   46.592   6.1029   43.324   11.631 3.268150 13.13456 
1 1 1   10   14   24 o  141.318   2.8816  409.750   15.852  403.395   19.365  422.657   27.597  139.732   3.3602  142.905   4.6823 -3.172897 5.763212 
1 1 1   10   14   25 o  209.679   3.5299  895.590   30.175  817.466   39.224  1008.87   47.232  198.698   4.7862  220.660   5.1897 -21.96188 7.059798 
1 1 1   10   14   26 o   80.755   4.4009  144.200   12.771  155.130   15.124  117.035   23.843   86.588   4.2349   74.921   7.7159 11.66694 8.801718 
1 1 1   10   14   27 o  253.555   3.2577  1331.27   34.054  1317.37   47.376  1346.12   48.983  252.199   4.5546  254.910   4.6590 -2.711197 6.515441 
1 1 1   10   14   28 f  137.779   3.7558  407.336   20.096  438.709   25.146  351.868   33.435  145.545   4.1889  130.012   6.2352 15.53307 7.511605 
1 1 1   10   14   29 o   92.131   5.1328  179.790   19.153  164.544   29.257  191.225   25.337   88.523   8.0131   95.738   6.4166 -7.214958 10.26563 
1 1 1   10   14   30 o   84.704   4.5120  148.180   13.920  146.310   16.202  153.447   27.197   83.943   4.6798   85.466   7.7156 -1.523315 9.023912 
1 1 1   10   14   31 o   84.664   4.3931  149.790   14.776  148.727   18.534  151.644   24.478   84.430   5.3224   84.898   6.9907 -0.4682236 8.786208 
1 1 1   10   14   32 o   93.211   5.6744  182.989   15.575  182.236   16.902  187.230   40.095   93.571   4.3796   92.851   10.470 0.7198944 11.34882 
1 1 1   10   14   33 o   34.090   7.5662   24.000   10.406   22.937   11.767   27.815   22.290   32.106   8.6789   36.074   12.396 -3.967731 15.13246 
1 1 1   10   14   34 o   84.785   4.5577  160.549   13.865  171.246   16.382  133.542   26.030   90.603   4.3839   78.967   7.9921 11.63635 9.115447 
1 1 1   10   14   35 o   34.378   8.3069   23.474   15.327   6.9743   21.463   40.642   21.894   27.325   11.413   41.431   12.073 -14.10545 16.61377 
1 1 1   10   14   36 o   25.138   7.8472  -2.3042   15.949  -4.9783   22.208   0.5439   22.919   24.236   10.838   26.040   11.351 -1.804251 15.69440 
1 1 1   10   14   37 o   89.915   4.9403  173.525   18.112  141.250   24.986  209.262   26.292   80.839   7.4938   98.991   6.4396 -18.15186 9.880575 
1 1 1   10   14   38 o   36.079   7.9074   24.281   15.385   56.310   23.043  -1.4841   20.667   48.118   11.720   24.040   10.619 24.07858 15.81478 
1 1 1   10   14   39 o   30.102   9.4772  -8.8685   20.322   32.944   41.943 -21.6954   23.231   39.206   16.125   20.997   9.9619 18.20934 18.95440 
1 1 1   10   14   40 o   37.568   9.4713   34.830   18.264   35.656   23.104   33.455   29.821   37.826   12.624   37.310   14.123 0.5166664 18.94268 
1 1 1   10   14   41 o   25.476   8.0174   0.8581   16.721  -0.5366   26.429   1.7890   21.592   26.210   11.764   24.743   10.896 1.466940 16.03478 
1 1 1   10   14   42 o   29.103   8.0865   12.925   15.377   32.604   22.526  -4.2504   21.044   35.453   12.446   22.753   10.328 12.69942 16.17296 
1 1 1   10   14   43 o   40.165   9.2153   46.382   18.747   63.292   25.793   27.443   27.296   47.420   12.862   32.909   13.201 14.51066 18.43065 
1 1 1   10   14   44 f   37.236   9.3576   38.235   19.174   19.754   26.357   59.010   27.945   30.203   12.634   44.269   13.808 -14.06606 18.71528 
1 1 1   10   14   45 o   29.178   9.2988   13.528   24.059 -10.0015   43.554   23.862   28.863   27.573   13.234   30.783   13.067 -3.210747 18.59759 
1 1 1   10   14   46 o   24.202   8.1374 -10.4705   22.370 -21.9298   33.356  -1.1032   30.158   23.187   11.240   25.217   11.770 -2.030092 16.27475 
1 1 1   10   14   47 o   24.916   8.6424 -15.8478   27.712 -11.2086   32.056 -29.5698   55.131   23.555   11.318   26.278   13.064 -2.722500 17.28473 
1 1 1   10   15    0 o   36.875   3.2241   29.319   6.6499   29.319   6.6499   29.319   6.6499   36.875   4.5596   36.875   4.5596 0.000000 0.000000 
1 1 1   10   15    1 o  286.695   2.4791  1696.19   29.315  1695.71   41.461  1696.66   41.453  286.655   3.5069  286.735   3.5052 -0.8026123E-01 4.958248 
1 1 1   10   15    2 o  397.129   3.0654  3253.68   50.173  3201.64   69.443  3310.51   72.571  393.815   4.2754  400.444   4.3939 -6.628632 6.130707 
1 1 1   10   15    3 o  274.152   2.5187  1550.33   27.644  1554.26   44.883  1547.92   35.089  274.408   3.9657  273.896   3.1061 0.5118408 5.037344 
1 1 1   10   15    4 o  120.567   2.0925  303.981   10.164  279.258   15.826  321.337   13.260  116.331   3.2984  124.803   2.5760 -8.472778 4.185078 
1 1 1   10   15    5 o  353.380   3.2673  2547.02   47.080  2383.45   61.344  2781.46   73.438  339.767   4.3775  366.993   4.8518 -27.22525 6.534681 
1 1 1   10   15    6 f  101.564   2.3068  211.447   9.6220  228.108   14.442  198.148   12.903  105.136   3.3306   97.992   3.1925 7.144653 4.613516 
1 1 1   10   15    7 o  147.002   2.2499  447.452   13.578  427.378   19.922  464.863   18.554  143.908   3.3566  150.097   2.9971 -6.189209 4.499887 
1 1 1   10   15    8 o  440.400   3.5923  4007.52   64.675  3999.39   98.149  4013.76   85.983  439.955   5.4089  440.845   4.7289 -0.8903198 7.184617 
1 1 1   10   15    9 o  296.974   2.6443  1827.71   31.675  1785.59   50.053  1855.86   40.909  294.077   4.1267  299.872   3.3076 -5.795410 5.288675 
1 1 1   10   15   10 o  255.034   2.4552  1349.39   25.272  1308.41   39.779  1377.13   32.726  251.745   3.8312  258.323   3.0716 -6.578583 4.910424 
1 1 1   10   15   11 o  160.005   2.4800  530.949   15.192  521.827   26.987  535.180   18.381  158.964   4.1162  161.045   2.7673 -2.081421 4.959932 
1 1 1   10   15   12 o  216.064   2.4184  965.924   21.364  946.258   32.244  981.312   28.523  214.084   3.6518  218.044   3.1716 -3.960358 4.836809 
1 1 1   10   15   13 o  294.243   2.6287  1786.97   31.882  1762.11   44.201  1813.93   46.031  292.117   3.6687  296.370   3.7657 -4.253143 5.257350 
1 1 1   10   15   14 o  287.199   3.3207  1709.07   38.608  1726.28   50.156  1684.05   60.481  289.046   4.2072  285.353   5.1389 3.692993 6.641428 
1 1 1   10   15   15 o  138.541   2.6635  398.461   15.131  421.017   20.699  372.579   22.173  142.787   3.5147  134.296   4.0031 8.491592 5.327091 
1 1 1   10   15   16 f  198.592   2.6661  811.895   21.601  796.846   28.407  832.528   33.262  196.439   3.5062  200.746   4.0173 -4.307724 5.332121 
1 1 1   10   15   17 o   69.143   3.3530   94.981   9.2230   85.309   11.390  113.399   15.718   64.247   4.2984   74.038   5.1472 -9.790916 6.705935 
1 1 1   10   15   18 o   75.800   3.8172  122.300   11.131  129.048   13.707  109.235   19.074   79.014   4.2061   72.587   6.3712 6.427002 7.634366 
1 1 1   10   15   19 o  148.542   2.6742  455.902   16.026  455.954   20.624  455.823   25.460  148.582   3.3655  148.501   4.1569 0.8015442E-01 5.348479 
1 1 1   10   15   20 o   70.801   3.6612  105.056   10.139  107.983   12.589   99.652   17.106   72.268   4.2234   69.334   5.9817 2.934013 7.322460 
1 1 1   10   15   21 o  145.111   2.7859  438.297   16.341  451.523   21.282  419.299   25.506  147.833   3.4904  142.389   4.3432 5.444580 5.571861 
1 1 1   10   15   22 o  186.554   3.3706  709.671   23.217  696.841   27.195  744.156   44.585  183.635   3.5906  189.473   5.7053 -5.837814 6.741137 
1 1 1   10   15   23 o  208.939   2.7095  905.873   22.420  914.940   28.108  890.017   37.172  210.453   3.2383  207.425   4.3450 3.028519 5.418976 
1 1 1   10   15   24 o  167.797   3.0009  579.843   20.634  560.753   27.464  604.582   31.266  164.665   4.0439  170.930   4.4349 -6.264908 6.001797 
1 1 1   10   15   25 o  115.913   3.1061  267.720   14.101  247.260   17.131  310.711   24.832  109.353   3.7982  122.474   4.9159 -13.12067 6.212252 
1 1 1   10   15   26 o  113.520   4.2515  271.117   19.437  250.439   30.327  285.531   25.321  109.699   6.7029  117.341   5.2320 -7.642113 8.503087 
1 1 1   10   15   27 f   69.946   6.1938   98.464   17.429  123.053   28.805   84.262   21.892   76.495   9.1301   63.397   8.3722 13.09745 12.38760 
1 1 1   10   15   28 o   63.475   5.2943   81.630   12.406   78.398   14.470   90.598   24.105   61.382   5.7155   65.568   8.9135 -4.186180 10.58851 
1 1 1   10   15   29 o   59.827   5.4980   68.509   12.173   61.117   14.051   90.741   24.369   54.117   6.2953   65.536   9.0155 -11.41895 10.99591 
1 1 1   10   15   30 o   65.922   5.9187  106.270   12.840  122.261   15.270   67.675   23.722   76.650   4.8300   55.195   10.807 21.45487 11.83746 
1 1 1   10   15   31 o  128.988   5.0439  347.927   26.015  364.058   42.737  338.432   32.790  131.005   7.9096  126.971   6.2613 4.033348 10.08790 
1 1 1   10   15   32 o   46.441   9.8804   40.879   12.235   40.026   12.608   54.632   50.635   43.465   7.0333   49.417   18.467 -5.952930 19.76077 
1 1 1   10   15   33 o  153.349   3.6421  499.690   21.660  514.745   26.699  470.705   37.047  157.204   4.1178  149.493   6.0085 7.710419 7.284131 
1 1 1   10   15   34 o  106.408   4.4912  240.432   19.689  226.368   27.692  254.811   28.000  103.185   6.5068  109.632   6.1924 -6.446327 8.982456 
1 1 1   10   15   35 o   68.179   4.9709   99.539   12.636   99.263   14.983  100.219   23.516   68.592   5.2961   67.766   8.4137 0.8254547 9.941721 
1 1 1   10   15   36 o   38.298   9.2448   33.917   17.572   30.404   24.687   37.525   25.018   36.796   13.019   39.801   13.130 -3.004780 18.48964 
1 1 1   10   15   37 o   71.682   5.7525  112.697   16.995  106.947   23.783  118.695   24.293   69.744   8.2681   73.620   8.0004 -3.876465 11.50508 
1 1 1   10   15   38 f   54.031   8.5922   71.090   18.634   76.679   27.642   66.435   25.228   55.903   12.320   52.159   11.980 3.743896 17.18440 
1 1 1   10   15   39 o   19.653   6.6358 -22.3934   14.945 -20.7855   22.301 -23.7041   20.135   20.544   9.7509   18.762   9.0032 1.781664 13.27165 
1 1 1   10   15   40 o   58.742   7.3288   81.302   17.305   91.215   26.479   73.912   22.862   62.132   10.333   55.352   10.396 6.780075 14.65755 
1 1 1   10   15   41 o   52.040   7.7948   67.579   16.551   54.437   23.319   80.921   23.496   45.562   12.176   58.518   9.7351 -12.95636 15.58959 
1 1 1   10   15   42 o   30.834   7.8595   15.944   15.685   44.418   21.892 -14.0914   22.484   40.473   12.145   21.195   9.9787 19.27725 15.71897 
1 1 1   10   15   43 o   37.198   9.0415   38.140   17.515   52.335   24.931   24.307   24.611   42.795   12.988   31.600   12.582 11.19494 18.08298 
1 1 1   10   15   44 o   41.486   9.1706   49.526   19.185   24.518   26.188   78.493   28.185   31.167   12.771   51.805   13.164 -20.63816 18.34116 
1 1 1   10   15   45 o   31.411   9.8176   24.820   24.588   17.677   44.023   28.058   29.643   31.033   14.395   31.789   13.354 -0.7556610 19.63521 
1 1 1   10   15   46 o   36.038   8.8366   38.296   21.630 -17.6998   33.923   76.659   28.078   23.511   11.382   48.566   13.520 -25.05434 17.67312 
1 1 1   10   15   47 o   20.331   7.1054 -34.7478   21.650 -40.0132   33.322 -30.9012   28.480   20.682   10.261   19.980   9.8321 0.7020054 14.21090 
1 1 1   10   16    0 o  289.428   2.4941  1728.95   42.091  1728.95   42.091  1728.95   42.091  289.428   3.5272  289.428   3.5272 0.000000 0.000000 
1 1 1   10   16    1 o  147.035   1.9733  446.024   11.966  441.805   16.834  450.335   17.013  146.332   2.7891  147.738   2.7921 -1.405731 3.946532 
1 1 1   10   16    2 f  571.678   4.2347  6742.76   96.319  6801.76  159.039  6708.58  121.043  573.479   6.7239  569.876   5.1498 3.603149 8.469425 
1 1 1   10   16    3 o  339.692   2.8520  2384.11   38.833  2373.61   62.736  2390.63   49.444  339.043   4.4864  340.341   3.5224 -1.297913 5.703910 
1 1 1   10   16    4 o  288.052   2.7058  1701.34   31.525  1769.84   50.164  1656.63   40.528  292.787   4.1541  283.316   3.4683 9.470703 5.411584 
1 1 1   10   16    5 o  304.367   2.7880  1915.37   34.769  1886.09   52.031  1938.99   46.737  302.242   4.1739  306.491   3.6972 -4.248749 5.575901 
1 1 1   10   16    6 o  226.739   2.3264  1062.66   21.177  1053.83   34.038  1068.23   27.050  225.949   3.6525  227.528   2.8824 -1.579086 4.652846 
1 1 1   10   16    7 o  398.688   3.3337  3286.48   54.427  3257.46   81.826  3309.51   72.891  397.067   4.9964  400.310   4.4148 -3.242340 6.667442 
1 1 1   10   16    8 o  309.433   2.7122  1976.76   33.623  1977.22   54.457  1976.48   42.743  309.419   4.2672  309.447   3.3490 -0.2758789E-01 5.424466 
1 1 1   10   16    9 o   62.692   2.6245   81.114   6.5858   81.271   10.697   81.017   8.3577   62.733   4.1341   62.652   3.2343 0.8088684E-01 5.249007 
1 1 1   10   16   10 o  144.521   2.1815  433.146   12.710  421.094   20.088  441.191   16.413  142.823   3.4102  146.219   2.7216 -3.395966 4.363093 
1 1 1   10   16   11 o  419.619   3.8281  3615.38   59.189  3700.68  113.395  3583.43   69.392  422.725   6.5038  416.513   4.0394 6.212677 7.656151 
1 1 1   10   16   12 f  148.742   2.4098  456.652   14.781  465.650   21.168  448.092   20.647  150.171   3.4177  147.313   3.3982 2.857315 4.819644 
1 1 1   10   16   13 o  262.405   2.4767  1419.15   26.770  1474.07   39.085  1370.62   36.741  267.173   3.5469  257.636   3.4576 9.536926 4.953355 
1 1 1   10   16   14 o  270.899   2.5189  1513.33   28.117  1563.09   40.871  1468.62   38.742  275.117   3.6019  266.682   3.5222 8.434906 5.037855 
1 1 1   10   16   15 o  105.527   2.9031  230.038   12.616  229.259   17.353  230.912   18.374  105.343   3.9940  105.712   4.2143 -0.3683701 5.806240 
1 1 1   10   16   16 o  259.115   2.7682  1390.52   29.445  1424.38   40.033  1350.61   43.460  262.587   3.6964  255.644   4.1218 6.942810 5.536460 
1 1 1   10   16   17 o  101.923   2.8264  218.533   11.386  229.325   14.397  200.513   18.603  105.377   3.3125   98.470   4.5806 6.906815 5.652812 
1 1 1   10   16   18 o  102.471   3.8368  217.223   16.114  185.685   22.311  251.607   23.297   94.681   5.7134  110.261   5.1228 -15.58031 7.673699 
1 1 1   10   16   19 o  239.308   2.8192  1183.70   27.611  1183.18   36.831  1184.37   41.720  239.283   3.7319  239.333   4.2265 -0.5044556E-01 5.638303 
1 1 1   10   16   20 o   62.972   3.9083   80.037   9.6958   75.398   11.897   89.213   16.732   60.361   4.7787   65.583   6.1856 -5.221321 7.816543 
1 1 1   10   16   21 o  186.486   2.7124  717.567   20.536  711.629   26.728  726.126   32.087  185.583   3.4919  187.389   4.1516 -1.805725 5.424884 
1 1 1   10   16   22 o  118.010   3.1993  281.572   14.933  266.208   18.424  310.993   25.496  113.473   3.9367  122.547   5.0443 -9.074448 6.398642 
1 1 1   10   16   23 o   54.116   7.9101   67.321   15.571   73.028   18.340   52.587   29.471   59.218   7.5091   49.014   13.924 10.20443 15.82018 
1 1 1   10   16   24 o  129.810   2.9371  343.092   15.007  330.855   18.473  366.837   25.734  126.517   3.5402  133.104   4.6875 -6.586639 5.874175 
1 1 1   10   16   25 o  168.844   2.8641  579.306   19.348  548.910   24.272  632.286   32.045  162.934   3.6118  174.753   4.4459 -11.81898 5.728149 
1 1 1   10   16   26 o   80.920   3.9645  133.507   12.420  128.949   15.033  143.311   22.047   78.879   4.6208   82.961   6.4434 -4.082146 7.929008 
1 1 1   10   16   27 o  101.036   4.3687  210.470   18.060  196.230   23.797  229.812   27.734   97.086   5.9429  104.985   6.4050 -7.899620 8.737391 
1 1 1   10   16   28 o   98.815   4.4648  204.307   18.142  193.579   26.220  214.160   25.129   96.265   6.6039  101.365   6.0106 -5.099518 8.929652 
1 1 1   10   16   29 f   81.492   5.4814  143.642   17.913  117.135   26.916  164.718   24.000   74.315   8.7815   88.670   6.5625 -14.35476 10.96272 
1 1 1   10   16   30 o  138.047   3.6515  393.687   20.685  349.731   27.755  448.601   31.022  129.455   5.1983  146.639   5.1293 -17.18394 7.302923 
1 1 1   10   16   31 o   37.777   7.4839   30.826   10.604   30.352   11.927   32.614   23.158   37.067   8.0337   38.488   12.629 -1.420944 14.96781 
1 1 1   10   16   32 o   24.741   7.1041   7.3386   10.183   8.3272   11.684   4.2158   20.767   23.040   8.8116   26.442   11.146 -3.401506 14.20822 
1 1 1   10   16   33 o   45.141   8.6759   48.818   12.872   50.557   13.657   34.989   38.517   48.776   6.7887   41.506   15.969 7.269650 17.35188 
1 1 1   10   16   34 o   67.141   6.7286   99.927   18.540  101.453   25.157   98.113   27.428   67.956   8.9758   66.326   10.026 1.629936 13.45717 
1 1 1   10   16   35 o   66.919   9.3488   83.013   13.950   78.525   14.459  143.444   53.058   60.850   5.7612   72.988   17.788 -12.13737 18.69754 
1 1 1   10   16   36 o   22.373   6.9428   0.5437   10.448   1.0287   11.800  -1.2154   22.475   19.477   8.3134   25.269   11.122 -5.792093 13.88550 
1 1 1   10   16   37 o   43.176   7.1931   46.604   12.050   51.520   14.200   33.963   22.773   48.740   7.0641   37.612   12.532 11.12739 14.38614 
1 1 1   10   16   38 o   63.450   9.4623  110.937   23.353   73.421   39.728  130.744   28.867   50.891   16.534   76.010   9.2078 -25.11942 18.92468 
1 1 1   10   16   39 o   49.641   7.3935   57.966   12.444   57.488   14.026   59.735   26.977   51.408   6.6150   47.874   13.225 3.534058 14.78692 
1 1 1   10   16   40 o   41.015   7.4200   47.733   12.665   54.931   14.276   21.127   27.445   49.858   6.9422   32.172   13.116 17.68660 14.84003 
1 1 1   10   16   41 o   25.277   7.8461  -5.0289   18.349   19.115   22.146 -57.9015   32.773   30.032   11.942   20.521   10.180 9.510498 15.69228 
1 1 1   10   16   42 o   31.007   8.9417   20.611   18.131   11.651   24.233   32.005   27.328   27.627   11.856   34.387   13.389 -6.760334 17.88347 
1 1 1   10   16   43 o   24.455   7.7797  -2.5196   17.013   13.775   24.430 -17.8616   23.705   28.052   11.967   20.859   9.9437 7.192770 15.55935 
1 1 1   10   16   44 o   22.202   7.5191 -18.8757   19.951 -35.7887   31.149  -7.1102   25.980   21.184   10.396   23.220   10.866 -2.036499 15.03812 
1 1 1   10   16   45 o   25.609   8.4317   0.8028   21.319   1.3021   33.756   0.4716   27.496   26.464   12.385   24.754   11.445 1.709736 16.86345 
1 1 1   10   16   46 o   22.951   7.7669 -10.2251   20.733 -17.9990   33.178  -5.2441   26.557   23.013   11.168   22.889   10.797 0.1245823 15.53383 
1 1 1   10   17    0 o  135.496   1.9511  379.185   15.405  379.185   15.405  379.185   15.405  135.496   2.7592  135.496   2.7592 0.000000 0.000000 
1 1 1   10   17    1 o  346.396   2.8841  2478.32   39.973  2474.61   64.928  2480.59   50.726  346.134   4.5480  346.658   3.5478 -0.5246582 5.768153 
1 1 1   10   17    2 o  185.395   2.3913  701.934   18.187  633.172   24.267  790.042   27.469  175.148   3.3592  195.643   3.4042 -20.49495 4.782589 
1 1 1   10   17    3 o   70.320   2.3966  102.933   6.7425   98.383   10.827  105.815   8.6173   69.032   3.8028   71.608   2.9177 -2.576256 4.793183 
1 1 1   10   17    4 o  201.721   2.4420  836.258   20.251  884.125   30.146  796.893   27.338  206.954   3.5318  196.488   3.3734 10.46611 4.883986 
1 1 1   10   17    5 o  103.829   2.2173  221.808   9.4149  227.652   14.360  217.401   12.469  105.021   3.3152  102.638   2.9454 2.382126 4.434665 
1 1 1   10   17    6 o   97.084   2.1852  196.082   8.5258  187.341   13.527  201.842   10.981   95.265   3.4428   98.902   2.6921 -3.637306 4.370389 
1 1 1   10   17    7 o   36.134   4.1482   28.459   5.8128   22.101   8.7914   33.398   7.7482   32.064   6.8554   40.204   4.6726 -8.140381 8.296389 
1 1 1   10   17    8 o  158.621   2.1466  523.491   13.759  497.424   21.453  541.707   17.934  155.224   3.3509  162.018   2.6837 -6.793564 4.293149 
1 1 1   10   17    9 o  195.866   2.2443  796.376   17.765  769.214   27.824  815.068   23.082  193.008   3.4952  198.723   2.8162 -5.714310 4.488588 
1 1 1   10   17   10 o   49.984   3.4786   55.397   6.3466   43.237   11.430   60.816   7.6309   45.697   6.0647   54.271   3.4092 -8.573818 6.957223 
1 1 1   10   17   11 o  218.485   2.3329  983.610   20.430  993.940   33.130  977.272   25.953  219.378   3.6615  217.591   2.8919 1.787308 4.665780 
1 1 1   10   17   12 o  232.842   2.6525  1119.35   25.467  1101.73   35.551  1137.93   36.500  230.962   3.7321  234.722   3.7703 -3.759903 5.305063 
1 1 1   10   17   13 o   79.051   2.6089  129.348   8.4831  119.118   12.048  139.406   11.946   75.939   3.8468   82.162   3.5252 -6.223633 5.217770 
1 1 1   10   17   14 o  455.627   3.4500  4293.16   64.830  4317.71   92.230  4269.19   91.148  456.910   4.8941  454.344   4.8640 2.566711 6.900081 
1 1 1   10   17   15 o  237.843   2.7074  1170.32   26.351  1181.07   35.221  1156.64   39.713  239.116   3.5713  236.570   4.0701 2.545868 5.414824 
1 1 1   10   17   16 f  235.120   2.8750  1142.41   27.875  1137.06   39.000  1148.01   39.857  234.561   4.0313  235.679   4.1003 -1.117844 5.750075 
1 1 1   10   17   17 o  217.322   2.8662  970.988   23.189  964.137   27.376  988.391   43.631  216.079   3.0717  218.565   4.8400 -2.485626 5.732474 
1 1 1   10   17   18 o  229.239   2.9058  1085.81   27.464  1062.57   38.219  1110.62   39.494  226.708   4.0874  231.770   4.1315 -5.062515 5.811674 
1 1 1   10   17   19 o   99.178   3.0880  205.013   12.433  213.298   16.399  193.810   19.068  101.582   3.9141   96.775   4.7773 4.807144 6.175974 
1 1 1   10   17   20 o  169.304   2.6124  593.080   17.589  594.958   22.136  589.864   28.971  169.717   3.1623  168.890   4.1590 0.8270874 5.224705 
1 1 1   10   17   21 o  101.602   3.3239  213.932   13.844  216.236   18.633  211.093   20.683  102.235   4.4189  100.969   4.9666 1.265793 6.647827 
1 1 1   10   17   22 o   55.265   4.5859   61.227   9.8007   57.399   11.783   69.821   17.656   52.621   5.4291   57.908   7.3923 -5.287392 9.171721 
1 1 1   10   17   23 o  107.312   4.4457  224.859   17.937  206.454   21.001  274.479   34.484   99.816   5.1012  114.807   7.2826 -14.99048 8.891462 
1 1 1   10   17   24 f   66.245   4.5667   98.019   11.167  109.193   13.598   74.873   19.571   72.614   4.5403   59.875   7.9250 12.73937 9.133453 
1 1 1   10   17   25 o   45.338   6.0893   46.347   10.162   50.198   12.263   37.910   18.153   49.127   6.0521   41.549   10.568 7.578247 12.17859 
1 1 1   10   17   26 o   47.829   5.8405   48.810   10.431   48.722   12.621   48.999   18.530   48.348   6.3293   47.311   9.8176 1.037045 11.68094 
1 1 1   10   17   27 o  112.846   3.7167  266.749   15.983  270.098   19.296  259.430   28.528  114.161   4.0981  111.530   6.2017 2.631485 7.433341 
1 1 1   10   17   28 o   76.661   5.0147  123.319   15.848  117.898   22.166  128.988   22.666   74.922   7.1731   78.399   7.0098 -3.476471 10.02946 
1 1 1   10   17   29 o   79.545   4.9547  133.889   16.143  151.078   22.776  116.534   22.885   84.814   6.5108   74.277   7.4702 10.53727 9.909334 
1 1 1   10   17   30 o  135.144   5.1240  410.658   25.607  327.607   45.201  449.909   31.074  123.572   8.8687  146.716   5.1352 -23.14393 10.24809 
1 1 1   10   17   31 o   89.911   3.9771  167.533   13.578  164.008   16.219  175.790   24.825   88.664   4.4351   91.158   6.6028 -2.493462 7.954107 
1 1 1   10   17   32 o   40.458   8.4070   38.605   12.192   40.947   12.897   18.924   37.383   43.871   7.1276   37.045   15.229 6.825672 16.81399 
1 1 1   10   17   33 o   37.119   7.4708   37.408   11.775   43.402   12.452 -13.2563   36.201   45.072   6.6985   29.166   13.356 15.90597 14.94151 
1 1 1   10   17   34 o   23.565   6.9789   5.4530   10.101   7.0283   11.452  -0.0674   21.438   22.018   8.6406   25.112   10.962 -3.094269 13.95788 
1 1 1   10   17   35 o   84.330   5.6189  154.150   19.429  132.947   26.776  177.729   28.236   78.013   8.3219   90.648   7.5522 -12.63564 11.23784 
1 1 1   10   17   36 o   34.034   7.4280   18.805   10.085   11.530   11.312   46.998   22.269   24.257   8.7853   43.810   11.980 -19.55289 14.85594 
1 1 1   10   17   37 o   76.821   5.5221  129.733   17.494  132.400   25.002  127.175   24.485   77.592   7.8127   76.049   7.8061 1.542519 11.04418 
1 1 1   10   17   38 o   32.731   6.9404   28.463   11.628   37.850   13.053  -7.6292   25.595   40.694   8.0622   24.769   11.300 15.92478 13.88089 
1 1 1   10   17   39 o   80.923   5.6553  147.307   18.850  137.732   26.398  157.268   26.924   78.069   8.1985   83.777   7.7920 -5.708122 11.31065 
1 1 1   10   17   40 o   22.872   7.1069   2.3338   11.175   1.9921   12.739   3.4752   23.282   20.008   8.5913   25.735   11.324 -5.726889 14.21388 
1 1 1   10   17   41 o   30.880   8.6947   21.601   12.894   23.257   13.434   2.2317   45.944   30.672   9.5748   31.089   14.516 -0.4164963 17.38949 
1 1 1   10   17   42 o   20.925   6.2659   1.6540   10.621   12.530   11.688 -49.8718   25.439   24.123   8.9002   17.726   8.8223 6.397272 12.53187 
1 1 1   10   17   43 o   29.127   7.7131   20.717   11.119   21.327   12.280   17.938   26.204   29.128   9.1640   29.126   12.409 0.1945496E-02 15.42617 
1 1 1   10   17   44 o   27.876   8.9800   9.0483   22.754   15.679   33.013   3.0480   31.404   29.222   13.130   26.530   12.254 2.692629 17.96003 
1 1 1   10   17   45 o   29.917   8.5038   21.925   13.130   18.847   14.410   36.970   31.860   26.918   9.8901   32.915   13.836 -5.997427 17.00757 
1 1 1   10   17   46 o   29.558   9.1351   15.356   22.915   55.404   33.864 -18.4701   31.123   36.854   14.731   22.263   10.807 14.59142 18.27016 
1 1 1   10   18    0 o   53.279   2.9025   59.620   8.8969   59.620   8.8969   59.620   8.8969   53.279   4.1047   53.279   4.1047 0.000000 0.000000 
1 1 1   10   18    1 f  189.566   2.1707  745.234   16.576  724.875   26.261  758.716   21.371  187.385   3.3979  191.746   2.7022 -4.361374 4.341375 
1 1 1   10   18    2 o  220.840   2.2893  1004.76   20.222  1014.78   32.969  998.721   25.603  221.695   3.6056  219.985   2.8218 1.709457 4.578588 
1 1 1   10   18    3 o  130.676   2.1463  355.311   11.464  324.978   16.920  381.053   15.587  125.469   3.2697  135.883   2.7812 -10.41364 4.292545 
1 1 1   10   18    4 o  133.403   2.1692  366.088   11.828  376.466   18.086  358.332   15.635  135.042   3.2472  131.764   2.8770 3.277786 4.338346 
1 1 1   10   18    5 o  155.510   2.3608  495.749   15.084  458.387   20.287  541.947   22.559  149.005   3.3010  162.014   3.3759 -13.00864 4.721589 
1 1 1   10   18    6 o  213.256   2.4088  939.999   21.116  926.736   31.038  951.428   28.812  211.843   3.5523  214.670   3.2541 -2.827148 4.817531 
1 1 1   10   18    7 o   70.180   2.9098  102.410   8.3267  106.658   11.112   96.971   12.575   71.861   3.7490   68.498   4.4511 3.362579 5.819557 
1 1 1   10   18    8 o  222.418   2.5849  1015.67   23.618  957.905   31.724  1087.50   35.375  215.372   3.5714  229.464   3.7378 -14.09169 5.169712 
1 1 1   10   18    9 o   86.544   2.3058  155.180   7.9892  152.347   12.900  156.942   10.175   85.889   3.6416   87.199   2.8293 -1.310516 4.611504 
1 1 1   10   18   10 o  134.492   2.3702  359.656   11.991  407.090   22.711  341.325   14.119  140.382   3.9225  128.602   2.6618 11.78003 4.740425 
1 1 1   10   18   11 o  432.092   3.5391  3860.95   62.396  3862.13   95.484  3860.08   82.431  432.060   5.3582  432.123   4.6251 -0.6295776E-01 7.078287 
1 1 1   10   18   12 o  268.545   2.6874  1486.13   29.506  1517.26   44.993  1462.64   39.085  270.978   4.0257  266.113   3.5610 4.864807 5.374713 
1 1 1   10   18   13 f  151.575   2.4421  474.873   15.001  476.361   19.499  472.715   23.482  151.889   3.1127  151.262   3.7639 0.6266174 4.884211 
1 1 1   10   18   14 o  111.277   2.3230  255.191   10.643  277.311   15.408  235.005   14.719  115.882   3.2238  106.672   3.3456 9.210625 4.646057 
1 1 1   10   18   15 o  147.085   2.5687  448.703   15.298  456.509   19.922  437.486   23.882  148.676   3.2488  145.493   3.9798 3.183304 5.137467 
1 1 1   10   18   16 o  112.823   2.8540  262.714   13.252  257.127   18.075  269.208   19.487  111.535   3.9292  114.110   4.1405 -2.575699 5.708078 
1 1 1   10   18   17 o  128.092   2.8787  341.081   13.910  343.891   16.638  334.556   25.354  129.039   3.1262  127.145   4.8348 1.893936 5.757444 
1 1 1   10   18   18 o  128.882   2.8300  347.139   14.879  386.825   20.456  302.549   21.683  136.818   3.6250  120.945   4.3468 15.87283 5.659960 
1 1 1   10   18   19 o   25.536   6.0407   12.466   8.0668   18.887   10.311   2.3377   12.951   29.648   8.1704   21.425   8.8997 8.223257 12.08141 
1 1 1   10   18   20 o   88.340   3.3375  168.585   11.531  189.888   14.779  135.437   18.436   95.846   3.7387   80.835   5.5297 15.01176 6.674951 
1 1 1   10   18   21 o  153.441   3.3281  490.755   20.898  454.225   30.816  521.858   28.435  148.074   5.0458  158.809   4.3412 -10.73524 6.656297 
1 1 1   10   18   22 o  108.228   3.6859  244.732   16.277  205.066   23.133  283.627   22.907   99.425   5.6411  117.030   4.7457 -17.60489 7.371813 
1 1 1   10   18   23 o  120.375   2.9720  299.105   14.105  297.168   17.512  302.682   23.797  119.886   3.5417  120.865   4.7736 -0.9791412 5.943976 
1 1 1   10   18   24 o   99.801   4.9221  220.104   15.033  226.836   16.598  189.350   35.474  104.696   3.8437   94.905   9.0627 9.791229 9.844121 
1 1 1   10   18   25 o   64.952   4.3909   88.286   10.920   88.947   13.219   86.864   19.376   65.463   4.8960   64.440   7.2904 1.022926 8.781878 
1 1 1   10   18   26 o  108.699   3.2995  247.014   14.117  251.398   17.607  239.120   23.624  110.167   3.8749  107.230   5.3415 2.936844 6.598951 
1 1 1   10   18   27 o   58.537   5.1012   71.831   11.348   71.604   13.623   72.347   20.511   58.594   5.6371   58.480   8.5037 0.1136360 10.20248 
1 1 1   10   18   28 o   58.043   6.0903   71.521   14.560   76.690   21.166   66.878   20.060   60.043   8.5471   56.044   8.6783 3.998840 12.18057 
1 1 1   10   18   29 o   51.282   8.4042   59.502   12.398   59.910   13.209   56.484   35.944   53.417   5.9955   49.147   15.703 4.270176 16.80832 
1 1 1   10   18   30 o   84.983   4.5982  149.509   15.167  143.646   18.395  161.956   26.803   82.757   5.3894   87.208   7.4518 -4.451302 9.196447 
1 1 1   10   18   31 o   68.298   4.7118   95.824   12.065   91.869   14.219  105.996   22.802   66.204   5.2075   70.391   7.8540 -4.187851 9.423517 
1 1 1   10   18   32 o   92.567   4.8086  184.541   18.170  170.240   26.998  196.384   24.567   88.986   7.3559   96.147   6.1953 -7.160446 9.617203 
1 1 1   10   18   33 o   37.797   7.0728   34.855   10.527   38.169   11.879   22.729   22.722   42.209   6.8235   33.384   12.391 8.825027 14.14570 
1 1 1   10   18   34 o  129.720   3.7685  353.623   20.112  328.401   27.317  383.473   29.718  124.706   5.3111  134.735   5.3478 -10.02936 7.537059 
1 1 1   10   18   35 o   20.807   6.4354   0.6768   9.7052   5.0462   10.937 -15.5149   21.053   20.596   8.3223   21.018   9.8182 -0.4224167 12.87078 
1 1 1   10   18   36 o   66.883   5.1962   99.999   12.494  103.085   14.652   91.777   23.916   69.758   5.0927   64.009   9.0590 5.748657 10.39236 
1 1 1   10   18   37 o   34.088   8.8019   11.130   17.797   57.314   30.395 -12.9651   21.954   46.349   14.391   21.827   10.139 24.52242 17.60381 
1 1 1   10   18   38 o   43.954   7.0858   49.665   11.495   53.701   13.259   37.454   23.063   49.641   6.4758   38.266   12.605 11.37497 14.17156 
1 1 1   10   18   39 o   28.732   7.2869   19.205   10.719   22.496   12.213   8.1685   22.366   30.708   9.0373   26.756   11.434 3.951597 14.57390 
1 1 1   10   18   40 o   58.229   6.3700   85.362   12.789   92.866   15.255   67.614   23.460   65.319   5.6625   51.138   11.412 14.18079 12.73997 
1 1 1   10   18   41 o   43.833   7.7808   43.473   11.687   38.707   12.958   64.252   27.057   40.379   8.0628   47.286   13.310 -6.907021 15.56167 
1 1 1   10   18   42 o   44.213   7.7229   50.958   12.487   50.627   14.089   52.169   26.967   47.013   7.2659   41.412   13.630 5.600742 15.44589 
1 1 1   10   18   43 o   24.984   7.0577   12.992   11.650   19.863   12.999 -15.0556   26.262   28.006   9.4687   21.961   10.468 6.044962 14.11539 
1 1 1   10   18   44 o   51.111   8.5305   60.820   14.764   49.122   16.376  111.628   34.128   43.464   9.4079   58.759   14.233 -15.29520 17.06103 
1 1 1   10   18   45 f   17.491   6.2031 -22.9858   11.751 -24.5705   12.879 -15.1079   28.715   12.950   6.4167   22.032   10.618 -9.081103 12.40615 
1 1 1   10   19    0 o  303.468   2.6073  1901.42   46.136  1901.42   46.136  1901.42   46.136  303.468   3.6872  303.468   3.6872 0.000000 0.000000 
1 1 1   10   19    1 o  269.270   2.4454  1497.19   27.159  1501.19   38.474  1493.22   38.343  269.628   3.4597  268.912   3.4571 0.7160950 4.890888 
1 1 1   10   19    2 o  155.175   2.1483  495.549   13.561  506.157   21.092  488.073   17.706  156.574   3.2662  153.776   2.7916 2.798309 4.296645 
1 1 1   10   19    3 o  273.517   2.6171  1549.36   29.436  1470.04   42.576  1622.01   40.743  266.772   3.8695  280.262   3.5247 -13.48950 5.234225 
1 1 1   10   19    4 o   62.588   2.5086   80.451   6.4008   83.718   9.9151   78.117   8.3812   63.666   3.7760   61.510   3.3037 2.155647 5.017190 
1 1 1   10   19    5 o  100.142   2.2655  206.869   9.3397  209.728   13.672  204.368   12.789  100.787   3.2890   99.497   3.1164 1.290283 4.530947 
1 1 1   10   19    6 o  153.934   2.4437  489.308   15.452  489.468   20.930  489.116   22.908  153.970   3.2958  153.897   3.6091 0.7357788E-01 4.887486 
1 1 1   10   19    7 o  229.785   2.6629  1090.90   25.216  1098.74   35.011  1082.44   36.347  230.652   3.6803  228.918   3.8497 1.733414 5.325817 
1 1 1   10   19    8 o  140.260   2.2503  407.117   12.986  386.090   18.691  426.741   18.056  136.744   3.3141  143.776   3.0449 -7.032455 4.500518 
1 1 1   10   19    9 o  309.074   3.2195  1975.30   39.132  1973.25   66.179  1976.41   48.524  308.835   5.1955  309.312   3.8036 -0.4767151 6.438982 
1 1 1   10   19   10 o  148.400   2.1602  454.469   12.861  455.658   20.768  453.729   16.379  148.537   3.3900  148.263   2.6785 0.2739716 4.320457 
1 1 1   10   19   11 o   42.478   3.8681   42.244   5.8042   26.409   9.5937   51.386   7.2896   35.079   6.8769   49.877   3.5436 -14.79810 7.736160 
1 1 1   10   19   12 o  132.857   2.2108  364.375   12.113  358.506   16.957  370.490   17.309  131.765   3.1201  133.949   3.1330 -2.183594 4.421650 
1 1 1   10   19   13 o  145.172   2.2147  434.158   13.236  472.609   19.199  399.326   18.273  151.287   3.0770  139.057   3.1861 12.22957 4.429319 
1 1 1   10   19   14 o  160.170   2.2589  529.989   14.918  541.615   21.026  518.204   21.169  161.943   3.1480  158.397   3.2404 3.545380 4.517707 
1 1 1   10   19   15 f  238.708   2.4163  1177.18   23.788  1179.63   33.512  1174.69   33.773  238.960   3.4002  238.456   3.4340 0.5044708 4.832580 
1 1 1   10   19   16 o  126.430   3.0286  332.530   15.394  339.728   19.800  321.530   24.478  128.212   3.7444  124.648   4.7613 3.564171 6.057292 
1 1 1   10   19   17 o  206.692   2.8577  883.332   24.360  883.819   34.277  882.836   34.626  206.752   4.0197  206.631   4.0630 0.1208801 5.715383 
1 1 1   10   19   18 o   57.673   4.0162   72.615   8.9830   83.127   11.489   56.085   14.408   63.389   4.3945   51.958   6.7235 11.43169 8.032302 
1 1 1   10   19   19 o  211.766   2.5889  924.662   21.786  918.534   27.322  935.362   36.101  210.869   3.1415  212.663   4.1159 -1.794022 5.177773 
1 1 1   10   19   20 o  107.158   3.3152  237.840   14.641  248.815   20.740  226.938   20.671  109.632   4.5868  104.683   4.7877 4.948410 6.630332 
1 1 1   10   19   21 o  216.247   3.1586  952.715   26.964  917.301   33.301  1020.14   45.949  210.611   3.8336  221.883   5.0209 -11.27107 6.317132 
1 1 1   10   19   22 o   49.759   5.4331   56.944   9.8409   66.344   12.307   40.280   16.386   56.550   5.2767   42.968   9.4990 13.58239 10.86623 
1 1 1   10   19   23 o  139.168   2.8890  399.720   15.862  396.601   19.704  405.463   26.737  138.479   3.4499  139.857   4.6352 -1.377335 5.778098 
1 1 1   10   19   24 o  193.101   3.6537  772.543   26.921  769.137   32.392  780.150   48.408  192.681   4.0759  193.520   6.0649 -0.8384552 7.307307 
1 1 1   10   19   25 o   22.003   5.7336   2.9406   9.0337   16.981   10.645 -33.1962   17.078   28.233   8.4685   15.773   7.7318 12.46048 11.46714 
1 1 1   10   19   26 o   77.015   8.2620   96.868   13.117   92.063   13.509  176.039   54.835   66.522   4.9238   87.507   15.773 -20.98433 16.52408 
1 1 1   10   19   27 o  100.878   3.6974  213.813   15.032  219.708   19.461  205.093   23.669  102.749   4.5923   99.008   5.7961 3.741783 7.394879 
1 1 1   10   19   28 o   36.184   7.9522   28.361   14.152   12.127   21.111   41.611   19.072   29.496   11.682   42.872   10.793 -13.37606 15.90448 
1 1 1   10   19   29 o   37.433   8.4410   32.314   16.274   3.6745   29.022   45.451   19.655   30.248   12.977   44.618   10.798 -14.36964 16.88194 
1 1 1   10   19   30 o  128.278   3.8228  340.910   20.018  316.557   26.160  375.318   31.095  122.919   5.1601  133.637   5.6416 -10.71811 7.645520 
1 1 1   10   19   31 o   33.357   7.0901   18.474   9.7154   10.953   11.129   42.570   19.919   24.071   8.7145   42.642   11.186 -18.57101 14.18015 
1 1 1   10   19   32 o   38.024   7.1485   31.752   10.298   30.114   11.878   36.708   20.664   36.587   8.0864   39.460   11.790 -2.872654 14.29693 
1 1 1   10   19   33 o   44.377   6.7107   46.745   10.668   49.253   12.344   39.344   21.206   48.082   6.2244   40.672   11.891 7.410076 13.42140 
1 1 1   10   19   34 o   35.120   9.6274   18.095   10.775   16.752   11.079   41.550   46.298   27.518   8.7102   42.721   17.172 -15.20279 19.25482 
1 1 1   10   19   35 o   61.884   5.3099   84.735   11.990   86.252   14.125   80.824   22.684   63.724   5.3743   60.045   9.1597 3.679256 10.61989 
1 1 1   10   19   36 o   31.782   7.3873   15.704   10.255   7.7685   11.677   42.455   21.440   22.250   8.7273   41.314   11.921 -19.06322 14.77455 
1 1 1   10   19   37 o   82.251   6.9914  164.235   21.487  109.415   31.568  211.551   29.328   66.472   11.954   98.030   7.2538 -31.55814 13.98271 
1 1 1   10   19   38 o   46.966   6.9978   53.631   11.764   54.491   13.630   51.121   23.289   49.793   6.6370   44.140   12.322 5.652622 13.99559 
1 1 1   10   19   39 o   28.453   7.3697   18.530   10.799   20.649   12.426   11.991   21.828   29.379   9.2144   27.526   11.504 1.853407 14.73932 
1 1 1   10   19   40 o   73.216   5.2087  132.355   13.367  147.339   15.971   97.307   24.427   82.812   4.6761   63.620   9.3090 19.19152 10.41748 
1 1 1   10   19   41 o   28.428   7.7973   13.263   10.706   8.4424   11.888   33.965   24.634   21.995   8.7486   34.861   12.909 -12.86539 15.59459 
1 1 1   10   19   42 o   31.112   8.3080   25.592   12.291   27.369   12.816   5.2254   43.398   32.740   9.1411   29.484   13.875 3.256159 16.61592 
1 1 1   10   19   43 o   31.026   8.5924   22.662   13.001   19.244   14.276   39.260   31.461   27.501   9.8818   34.550   14.059 -7.048504 17.18480 
1 1 1   10   19   44 o   25.900   7.3388   16.037   13.193   24.465   14.779 -17.0313   29.273   29.741   10.096   22.060   10.654 7.680334 14.67762 
1 1 1   10   20    0 o  340.045   3.1909  2388.53   63.264  2388.53   63.264  2388.53   63.264  340.045   4.5126  340.045   4.5126 0.000000 0.000000 
1 1 1   10   20    1 o   93.153   2.1675  179.142   8.3234  186.788   11.829  171.645   11.714   95.123   3.0151   91.183   3.1148 3.940346 4.335021 
1 1 1   10   20    2 o  167.090   2.1173  575.854   14.584  562.010   20.229  590.836   21.045  165.002   2.9726  169.178   3.0160 -4.176208 4.234673 
1 1 1   10   20    3 o  132.275   2.1429  362.591   11.609  348.204   17.277  374.433   15.675  129.865   3.2257  134.686   2.8218 -4.821121 4.285754 
1 1 1   10   20    4 o  209.589   2.5400  906.797   21.933  897.891   30.267  916.646   31.829  208.512   3.5194  210.666   3.6633 -2.153824 5.079934 
1 1 1   10   20    5 o  210.779   2.3869  917.837   20.654  913.563   30.691  921.376   27.923  210.316   3.5381  211.242   3.2049 -0.9260254 4.773844 
1 1 1   10   20    6 o   73.021   2.8300  110.956   8.4136  115.613   11.182  104.880   12.773   74.813   3.6240   71.230   4.3478 3.582970 5.660073 
1 1 1   10   20    7 o  134.490   2.3237  373.199   12.883  390.396   18.509  357.039   17.943  137.494   3.2638  131.487   3.3085 6.007629 4.647475 
1 1 1   10   20    8 o  195.877   2.3498  788.130   18.800  821.988   28.914  763.334   24.744  199.485   3.5143  192.270   3.1203 7.215881 4.699609 
1 1 1   10   20    9 o  197.261   2.7601  798.332   21.928  830.150   35.332  778.401   27.965  200.395   4.2748  194.126   3.4927 6.268951 5.520247 
1 1 1   10   20   10 o  248.774   2.5681  1277.33   26.152  1288.38   39.563  1268.76   34.851  249.702   3.8415  247.846   3.4093 1.856339 5.136217 
1 1 1   10   20   11 o   80.253   2.4105  132.675   7.7673  134.612   12.551  131.473   9.8885   80.712   3.7703   79.794   3.0046 0.9172211 4.821057 
1 1 1   10   20   12 o   65.357   3.2478   90.313   8.4991   98.255   11.087   78.995   13.235   68.947   3.8989   61.768   5.1952 7.179886 6.495500 
1 1 1   10   20   13 o  224.648   2.3532  1042.47   21.799  1042.06   30.510  1042.91   31.158  224.606   3.2934  224.690   3.3622 -0.8375549E-01 4.706476 
1 1 1   10   20   14 o  126.761   2.2880  331.919   11.962  335.565   16.900  328.258   16.933  127.460   3.2147  126.062   3.2567 1.398003 4.576093 
1 1 1   10   20   15 o  128.848   2.3872  343.852   12.654  364.154   17.666  322.458   18.135  132.774   3.2260  124.922   3.5197 7.852203 4.774447 
1 1 1   10   20   16 o  153.563   2.9772  487.210   18.250  485.716   23.055  489.718   29.866  153.303   3.6463  153.822   4.7075 -0.5190887 5.954461 
1 1 1   10   20   17 o  130.900   2.9602  354.417   15.980  352.642   22.714  356.157   22.487  130.572   4.2177  131.227   4.1547 -0.6548615 5.920340 
1 1 1   10   20   18 o  142.528   2.8641  416.417   16.750  384.106   22.350  457.828   25.302  136.283   3.9761  148.772   4.1234 -12.48895 5.728201 
1 1 1   10   20   19 o   94.315   3.4731  184.272   13.462  164.100   18.782  205.578   19.303   88.989   5.1174   99.640   4.6971 -10.65135 6.946251 
1 1 1   10   20   20 o   67.493   4.1995   95.711   11.537  110.564   16.058   79.864   16.587   73.015   5.3322   61.971   6.4894 11.04353 8.399060 
1 1 1   10   20   21 o  146.070   3.0686  436.399   17.711  423.393   21.932  460.780   30.028  143.063   3.7169  149.077   4.8837 -6.014267 6.137222 
1 1 1   10   20   22 f   83.370   5.1347  134.935   13.381  129.829   14.605  161.628   33.395   79.146   4.4740   87.593   9.2436 -8.447670 10.26943 
1 1 1   10   20   23 f  167.486   2.7769  580.319   18.585  578.194   23.515  583.855   30.335  167.167   3.4106  167.803   4.3831 -0.6360779 5.553704 
1 1 1   10   20   24 o  159.358   4.2833  550.233   25.693  476.392   45.320  585.206   31.190  150.777   7.2877  167.939   4.5029 -17.16231 8.566624 
1 1 1   10   20   25 o  214.615   3.6347  964.129   29.808  972.273   36.031  946.469   53.057  216.466   4.0357  212.764   6.0462 3.702225 7.269331 
1 1 1   10   20   26 o  108.841   8.1351  251.414   36.519  251.414   36.519   0.0000   0.0000  108.841   8.1351  ?   ?       ?      ? 
1 1 1   10   20   27 o   58.380   4.7177   71.383   10.561   70.517   12.747   73.279   18.862   58.056   5.3234   58.704   7.7902 -0.6483345 9.435360 
1 1 1   10   20   28 o   72.687   4.5012  120.673   12.155  138.818   15.077   86.973   20.547   81.565   4.4816   63.808   7.8075 17.75727 9.002314 
1 1 1   10   20   29 o   49.813   8.1053   63.192   17.329   26.371   28.550   84.670   21.805   36.873   13.849   62.753   8.4248 -25.87959 16.21051 
1 1 1   10   20   30 o   45.392   6.2859   49.273   10.285   53.914   12.209   37.926   19.089   50.468   5.8653   40.315   11.120 10.15288 12.57171 
1 1 1   10   20   31 o  107.483   3.4829  242.103   14.905  239.527   18.740  246.538   24.590  106.978   4.2473  107.987   5.5211 -1.008705 6.965824 
1 1 1   10   20   32 o   53.958   5.3170   58.317   10.854   52.021   12.731   75.066   20.765   49.407   6.2477   58.509   8.6050 -9.101608 10.63391 
1 1 1   10   20   33 o   95.669   3.7656  190.823   14.215  183.995   17.566  203.778   24.195   93.558   4.5523   97.779   5.9996 -4.221275 7.531184 
1 1 1   10   20   34 o   56.973   9.7505   62.120   12.920   58.718   13.360  111.202   50.749   52.333   6.1895   61.613   18.493 -9.279522 19.50101 
1 1 1   10   20   35 o   69.232   4.7487  100.076   12.178   95.271   14.233  113.203   23.528   66.951   5.1543   71.512   7.9770 -4.560875 9.497310 
1 1 1   10   20   36 o   63.137   6.0889  100.249   12.859  113.732   15.373   68.830   23.467   73.089   5.0995   53.184   11.059 19.90527 12.17773 
1 1 1   10   20   37 o   29.928   7.4390   8.8253   10.398  -0.3397   11.637   45.093   23.150   18.444   8.0631   41.411   12.504 -22.96742 14.87805 
1 1 1   10   20   38 o   47.958   6.7444   55.985   11.512   57.171   13.430   52.699   22.348   51.021   6.3822   44.894   11.883 6.127670 13.48878 
1 1 1   10   20   39 o   29.843   6.9430   23.459   10.736   29.788   12.293   3.1257   22.035   35.041   8.5757   24.644   10.921 10.39649 13.88591 
1 1 1   10   20   40 o   74.635   6.0034  125.397   18.017   95.196   23.136  171.935   28.721   63.279   8.8649   85.990   8.0980 -22.71151 12.00680 
1 1 1   10   20   41 o   43.467   7.5761   49.899   12.350   49.816   14.127   50.168   25.433   46.388   7.3836   40.547   13.231 5.841587 15.15221 
1 1 1   10   20   42 o   30.448   8.5049   23.209   12.493   23.916   13.071   15.739   42.470   30.375   9.4382   30.521   14.151 -0.1458664 17.00974 
1 1 1   10   20   43 o   27.891   7.4125   21.406   12.852   28.794   14.391  -7.7052   28.564   32.457   9.8714   23.325   11.061 9.131861 14.82510 
1 1 1   10   20   44 o   27.922   8.2294   16.439   12.718   11.756   14.079   37.205   29.649   23.306   9.4337   32.539   13.487 -9.232740 16.45880 
1 1 1   10   21    0 o  155.225   2.0863  497.710   18.874  497.710   18.874  497.710   18.874  155.225   2.9504  155.225   2.9504 0.000000 0.000000 
1 1 1   10   21    1 o  202.067   2.4791  843.029   20.656  828.598   28.798  858.319   29.643  200.288   3.4861  203.845   3.5258 -3.556717 4.958229 
1 1 1   10   21    2 o  165.116   2.1113  562.830   14.377  558.713   20.163  567.089   20.505  164.503   2.9718  165.730   2.9998 -1.226700 4.222595 
1 1 1   10   21    3 o   32.790   4.1851   22.597   5.5195   19.555   7.6070   25.980   8.0208   30.156   6.3184   35.423   5.4899 -5.267004 8.370236 
1 1 1   10   21    4 o   87.708   2.3381  158.897   8.4425  158.434   12.307  159.308   11.603   87.584   3.4069   87.833   3.2030 -0.2488556 4.676122 
1 1 1   10   21    5 o  144.112   2.2186  429.369   13.140  422.338   19.335  435.402   17.911  143.006   3.2782  145.218   2.9904 -2.212280 4.437215 
1 1 1   10   21    6 o  137.185   2.4321  387.651   13.687  378.886   18.333  398.687   20.573  135.448   3.2816  138.922   3.5905 -3.474426 4.864176 
1 1 1   10   21    7 o   93.477   3.5860  196.017   11.905  214.514   14.094  149.975   22.237  101.911   3.3532   85.042   6.3398 16.86873 7.172004 
1 1 1   10   21    8 o   79.709   2.5495  132.533   8.2945  113.220   11.922  150.649   11.547   74.014   3.9054   85.404   3.2782 -11.38963 5.098917 
1 1 1   10   21    9 o  163.769   2.5763  557.737   16.857  539.553   27.254  569.005   21.453  161.551   4.0903  165.986   3.1336 -4.435837 5.152694 
1 1 1   10   21   10 o  353.685   3.7354  2514.78   51.276  2377.96   61.947  2812.54   91.385  339.073   4.4296  368.298   6.0160 -29.22562 7.470844 
1 1 1   10   21   11 o  230.325   2.5091  1097.84   23.771  1069.77   34.667  1122.76   32.657  227.523   3.6942  233.127   3.3964 -5.604263 5.018223 
1 1 1   10   21   12 o   80.155   2.9539  134.705   9.5130  142.043   12.343  123.969   14.930   82.909   3.6095   77.401   4.6769 5.507591 5.907814 
1 1 1   10   21   13 o  185.786   2.2568  713.054   17.291  723.080   24.405  702.950   24.501  187.101   3.1626  184.472   3.2203 2.628342 4.513573 
1 1 1   10   21   14 o  212.270   2.3262  930.659   20.360  922.981   28.405  938.772   29.198  211.374   3.2582  213.167   3.3209 -1.793335 4.652352 
1 1 1   10   21   15 o  121.738   2.4689  306.803   12.358  298.404   18.065  314.191   16.942  120.157   3.6452  123.318   3.3309 -3.160271 4.937877 
1 1 1   10   21   16 o  261.760   2.6130  1414.81   27.467  1409.33   35.023  1423.57   44.270  261.174   3.2513  262.347   4.0914 -1.172882 5.225939 
1 1 1   10   21   17 o  181.796   2.8840  683.717   21.622  693.389   30.527  673.980   30.630  183.091   4.0425  180.501   4.1144 2.590424 5.768008 
1 1 1   10   21   18 o  211.190   2.7049  925.178   23.248  940.384   30.629  904.513   35.707  213.294   3.4817  209.085   4.1406 4.208466 5.409852 
1 1 1   10   21   19 o   76.665   4.9903  105.089   11.990   96.982   13.002  151.192   31.005   68.420   4.6074   84.910   8.8535 -16.48955 9.980568 
1 1 1   10   21   20 o  204.969   3.3407  867.034   28.134  828.384   37.861  914.692   42.042  199.921   4.5916  210.016   4.8537 -10.09506 6.681395 
1 1 1   10   21   21 o   95.469   4.1551  192.213   15.985  176.494   24.843  203.321   20.883   91.988   6.5479   98.949   5.1170 -6.961685 8.310155 
1 1 1   10   21   22 o  120.683   3.5410  302.245   17.507  305.189   26.386  299.929   23.399  121.159   5.2801  120.208   4.7196 0.9509659 7.081951 
1 1 1   10   21   23 o   34.739   6.5158   26.188   9.1854   25.792   11.375   26.929   15.572   34.331   8.1546   35.148   10.165 -0.8175011 13.03163 
1 1 1   10   21   24 o   75.013   3.7063  115.171   11.087  109.312   13.847  125.639   18.509   72.494   4.6311   77.533   5.7879 -5.039017 7.412611 
1 1 1   10   21   25 o  153.814   5.7888  499.798   30.495  497.493   34.583  507.855   64.654  154.290   5.4345  153.339   10.223 0.9514313 11.57768 
1 1 1   10   21   26 o   25.309   6.0672   11.879   8.8808   21.330   10.719  -8.8166   15.861   31.056   8.2342   19.562   8.9129 11.49352 12.13438 
1 1 1   10   21   27 o   71.816   4.8982  109.357   14.450  109.732   21.422  109.044   19.574   71.840   7.2298   71.792   6.6105 0.4849243E-01 9.796378 
1 1 1   10   21   28 o   71.056   4.4523  109.353   12.380  116.446   15.573   97.176   20.406   74.563   5.0640   67.549   7.3245 7.014023 8.904594 
1 1 1   10   21   29 o  101.217   4.2118  216.332   17.551  201.489   24.029  233.308   25.697   97.500   5.9753  104.934   5.9374 -7.434563 8.423569 
1 1 1   10   21   30 o   87.568   3.8142  166.308   12.913  175.945   16.012  148.380   21.839   91.690   4.2341   83.445   6.3454 8.245003 7.628345 
1 1 1   10   21   31 f   51.672   5.6826   60.549   10.745   63.571   13.048   54.185   18.938   54.745   5.7787   48.599   9.7863 6.146229 11.36511 
1 1 1   10   21   32 o   32.367   6.5282   26.350   9.6259   32.836   11.251   8.6407   18.592   38.386   7.3746   26.347   10.774 12.03950 13.05650 
1 1 1   10   21   33 o   35.879   7.0637   32.984   10.869   38.444   12.584   16.951   21.564   41.388   7.6540   30.370   11.874 11.01732 14.12748 
1 1 1   10   21   34 o   16.866   5.7650 -17.5088   8.5824 -20.5978   9.5555  -4.6170   19.521   11.296   5.5842   22.437   10.088 -11.14134 11.53007 
1 1 1   10   21   35 o   36.688   7.9254   35.654   11.563   38.841   12.227   8.6638   35.580   41.511   7.4136   31.866   14.010 9.644926 15.85080 
1 1 1   10   21   36 o   63.158   5.6339   83.168   12.952   76.126   14.895  105.001   26.227   59.184   6.1021   67.132   9.4723 -7.947872 11.26770 
1 1 1   10   21   37 f   54.897   5.7315   63.239   11.603   57.093   13.421   81.432   23.091   51.009   6.3792   58.785   9.5239 -7.775394 11.46290 
1 1 1   10   21   38 o   52.666   7.3024   70.702   15.834   33.094   21.680  113.695   23.181   35.111   12.216   70.222   8.0036 -35.11165 14.60477 
1 1 1   10   21   39 o   17.877   6.0391 -11.8115   9.5142 -13.6578   10.675  -4.6773   20.983   13.515   6.5034   22.238   10.178 -8.723248 12.07826 
1 1 1   10   21   40 o   30.269   7.7939   16.662   11.056   9.4138   12.525   42.253   23.534   22.585   8.9810   37.952   12.741 -15.36749 15.58788 
1 1 1   10   21   41 o   25.730   6.8949   14.912   11.495   23.902   13.242 -12.5641   23.151   30.376   9.5100   21.083   9.9859 9.292839 13.78979 
1 1 1   10   21   42 o   40.289   7.4876   49.433   13.237   55.970   15.548   32.213   25.235   48.278   7.8082   32.300   12.778 15.97801 14.97516 
1 1 1   10   21   43 f   39.308   7.9676   50.452   13.830   54.329   15.609   36.294   29.831   46.248   8.4962   32.367   13.481 13.88069 15.93523 
1 1 1   10   22    0 o  139.759   2.7410  404.170   22.306  404.170   22.306  404.170   22.306  139.759   3.8764  139.759   3.8764 0.000000 0.000000 
1 1 1   10   22    1 o  153.184   2.1053  484.408   13.300  476.995   18.620  492.130   19.003  151.988   2.9704  154.380   2.9844 -2.391556 4.210661 
1 1 1   10   22    2 o  218.882   2.2654  989.495   20.449  990.365   28.749  988.605   29.094  218.982   3.1830  218.783   3.2242 0.1988983 4.530719 
1 1 1   10   22    3 o  105.874   2.2936  229.844   9.9282  219.634   13.081  243.718   15.248  103.128   3.0754  108.619   3.4036 -5.490295 4.587208 
1 1 1   10   22    4 o  128.429   2.2173  341.508   11.707  327.627   17.044  353.909   16.109  125.943   3.2811  130.915   2.9834 -4.972336 4.434678 
1 1 1   10   22    5 o  145.824   2.2309  440.455   13.379  412.888   19.236  466.283   18.619  141.382   3.2989  150.266   3.0043 -8.884766 4.461853 
1 1 1   10   22    6 f  105.613   2.2701  230.816   9.8488  225.146   14.496  235.677   13.423  104.398   3.3665  106.828   3.0464 -2.430183 4.540279 
1 1 1   10   22    7 o  231.531   2.4442  1110.46   23.189  1079.63   34.561  1135.71   31.274  228.574   3.6660  234.489   3.2337 -5.914200 4.888394 
1 1 1   10   22    8 o  155.831   2.4933  514.058   15.321  456.447   24.908  549.123   19.432  148.585   4.0643  163.076   2.8891 -14.48994 4.986573 
1 1 1   10   22    9 o   37.396   4.3714   39.277   5.5769   10.585   9.5519   54.116   6.8692   23.608   8.1148   51.184   3.2539 -27.57564 8.742892 
1 1 1   10   22   10 o  153.689   2.4066  486.530   15.232  457.253   20.889  519.770   22.258  148.767   3.4044  158.611   3.4024 -9.844299 4.813190 
1 1 1   10   22   11 f   70.828   4.8130  112.067   11.022  117.562   12.417   91.652   23.934   75.405   3.9926   66.252   8.7589 9.153412 9.625982 
1 1 1   10   22   12 o   90.674   2.9739  170.229   10.936  171.052   14.244  169.047   17.068   90.966   3.7965   90.383   4.5786 0.5834274 5.947842 
1 1 1   10   22   13 o   57.444   3.8403   73.422   8.4383   88.783   10.917   50.620   13.300   65.523   4.0396   49.364   6.5325 16.15842 7.680624 
1 1 1   10   22   14 f   50.354   3.4153   52.140   7.0663   58.589   10.477   46.759   9.5708   53.193   4.7756   47.516   4.8836 5.676975 6.830509 
1 1 1   10   22   15 o   96.492   3.6395  192.477   14.484  192.477   14.484   0.0000   0.0000   96.492   3.6395  ?   ?       ?      ? 
1 1 1   10   22   16 o  218.778   2.9791  991.698   26.465  983.034   41.116  997.825   34.580  217.895   4.5751  219.661   3.8168 -1.766647 5.958162 
1 1 1   10   22   17 o  109.926   3.1373  250.071   14.214  236.915   19.851  263.914   20.362  106.955   4.5000  112.898   4.3728 -5.943314 6.274654 
1 1 1   10   22   18 o  163.920   3.0074  556.115   20.317  564.807   29.389  548.158   28.119  165.136   4.3149  162.704   4.1903 2.432144 6.014718 
1 1 1   10   22   19 o   78.386   4.6794  127.191   14.167  130.818   25.007  125.476   17.191   79.054   7.6697   77.718   5.3632 1.335777 9.358852 
1 1 1   10   22   20 o   81.845   3.4422  134.096   11.273  120.076   14.046  159.482   18.900   76.090   4.4756   87.600   5.2310 -11.51035 6.884320 
1 1 1   10   22   21 o  111.768   2.9737  260.551   13.293  265.651   16.944  252.389   21.436  113.274   3.6267  110.262   4.7137 3.012825 5.947431 
1 1 1   10   22   22 o  133.722   3.5139  377.392   19.095  319.424   27.892  428.523   26.196  123.795   5.4628  143.649   4.4215 -19.85350 7.027894 
1 1 1   10   22   23 o   85.218   3.4146  148.643   11.770  138.841   15.028  164.194   18.929   81.709   4.4593   88.728   5.1724 -7.019630 6.829274 
1 1 1   10   22   24 o  133.725   3.2472  371.633   17.887  348.690   24.669  397.068   25.974  129.374   4.6232  138.076   4.5610 -8.702133 6.494369 
1 1 1   10   22   25 o   20.662   5.9931   3.1748   8.4336   8.9720   9.8916 -12.2575   16.139   22.452   8.2024   18.871   8.7402 3.581610 11.98628 
1 1 1   10   22   26 o   63.158   7.0113   79.933   12.089   76.962   12.930  100.573   34.076   60.609   5.1723   65.708   13.034 -5.098854 14.02268 
1 1 1   10   22   27 o   89.080   3.5332  166.573   12.375  167.391   15.369  165.064   20.867   89.605   4.1585   88.555   5.7131 1.049919 7.066319 
1 1 1   10   22   28 o   22.845   6.2692   6.9402   9.1819   14.287   11.023  -9.7057   16.593   26.056   8.7198   19.634   9.0098 6.421553 12.53843 
1 1 1   10   22   29 o  116.399   3.7342  284.833   17.780  237.987   24.380  338.065   25.988  106.062   5.5732  126.737   4.9717 -20.67553 7.468450 
1 1 1   10   22   30 o   33.749   7.0481   24.469   9.7195   22.103   11.470   30.495   18.305   31.246   8.6199   36.252   11.153 -5.006044 14.09612 
1 1 1   10   22   31 o   80.439   3.9831  136.030   12.348  133.572   14.954  141.299   21.893   79.712   4.5486   81.166   6.5399 -1.454071 7.966176 
1 1 1   10   22   32 o   30.620   7.1313   17.490   9.3656   12.994   10.781   31.323   18.909   24.947   8.6184   36.294   11.364 -11.34674 14.26269 
1 1 1   10   22   33 o   64.770   5.2400   92.954   12.623   94.535   15.045   89.193   23.200   66.577   5.4790   62.964   8.9338 3.613178 10.48007 
1 1 1   10   22   34 o   18.332   5.9751  -4.9011   8.7118  -3.5746   9.7946  -9.9249   19.061   15.880   7.1421   20.783   9.5811 -4.903024 11.95023 
1 1 1   10   22   35 o   28.844   8.5593   8.9081   10.159   6.9039   10.592   31.888   35.867   21.015   8.2900   36.673   14.977 -15.65758 17.11862 
1 1 1   10   22   36 o   35.454   7.7989   26.448   10.452   22.646   11.572   43.281   24.350   30.836   8.7133   40.073   12.937 -9.236282 15.59786 
1 1 1   10   22   37 f   35.598   6.4419   36.356   11.159   47.964   13.004   3.9404   21.732   46.333   6.8050   24.864   10.940 21.46871 12.88389 
1 1 1   10   22   38 o   73.026   5.5770  122.407   16.454   93.872   22.482  155.326   24.148   63.122   8.6354   82.929   7.0599 -19.80638 11.15404 
1 1 1   10   22   39 o   34.996   7.0118   20.116   10.559   6.6995   12.096   63.077   21.645   21.186   8.6803   48.806   11.014 -27.62093 14.02366 
1 1 1   10   22   40 o   21.673   6.7370   4.2314   10.603   6.3478   12.095  -2.7949   22.039   20.810   8.6189   22.535   10.357 -1.725451 13.47399 
1 1 1   10   22   41 o   47.924   7.1609   70.456   12.879   81.631   15.117   40.867   24.599   60.056   6.1030   35.792   12.956 24.26417 14.32177 
1 1 1   10   22   42 o   19.431   6.6347  -9.3254   11.730  -9.8715   12.896  -6.7068   28.237   15.707   7.4433   23.156   10.985 -7.449409 13.26948 
1 1 1   10   23    0 o   82.494   2.3123  141.115   11.087  141.115   11.087  141.115   11.087   82.494   3.2701   82.494   3.2701 0.000000 0.000000 
1 1 1   10   23    1 o   70.406   2.4515  102.381   7.1145   97.494   9.9671  107.456   10.158   68.692   3.5180   72.120   3.4151 -3.428024 4.902995 
1 1 1   10   23    2 o  100.086   2.3493  208.645   9.5889  220.705   12.871  193.599   14.375  103.379   3.0186   96.794   3.6008 6.585106 4.698695 
1 1 1   10   23    3 o  246.457   2.6989  1255.49   27.431  1256.62   38.495  1254.34   39.099  246.574   3.7852  246.341   3.8483 0.2329102 5.397895 
1 1 1   10   23    4 o   82.879   2.4357  142.513   8.2858  134.195   12.101  149.857   11.369   80.583   3.6408   85.175   3.2364 -4.591377 4.871306 
1 1 1   10   23    5 o   73.953   2.5280  112.853   7.6894  115.108   11.351  110.940   10.453   74.630   3.6878   73.276   3.4588 1.354179 5.055966 
1 1 1   10   23    6 o  167.411   2.2655  580.647   15.596  544.800   22.450  614.083   21.682  162.389   3.3520  172.432   3.0487 -10.04361 4.531029 
1 1 1   10   23    7 o  171.905   2.3490  607.774   16.606  548.204   22.715  676.166   24.339  162.891   3.3810  180.918   3.2618 -18.02664 4.697936 
1 1 1   10   23    8 o  207.398   2.5982  878.601   20.092  913.348   37.899  865.018   23.696  210.121   4.3731  204.675   2.8070 5.446701 5.196445 
1 1 1   10   23    9 f   90.413   2.2871  169.985   8.2164  164.628   13.467  173.161   10.370   89.249   3.6586   91.577   2.7455 -2.328224 4.574179 
1 1 1   10   23   10 o  333.884   3.1662  2284.07   43.252  2138.78   57.000  2481.25   66.406  321.537   4.2981  346.231   4.6502 -24.69412 6.332358 
1 1 1   10   23   11 o   91.893   2.9032  170.657   10.828  153.627   13.888  197.057   17.291   86.194   3.9065   97.592   4.2957 -11.39864 5.806342 
1 1 1   10   23   12 o  220.977   3.0560  1009.97   27.668  1014.53   41.630  1006.36   37.030  221.380   4.5593  220.573   4.0704 0.8074951 6.111925 
1 1 1   10   23   13 o  159.460   2.6763  522.174   17.382  504.097   22.680  547.908   27.061  156.167   3.5212  162.753   4.0313 -6.586639 5.352530 
1 1 1   10   23   14 o  235.113   2.8245  1141.61   27.253  1124.84   36.637  1162.39   40.780  233.216   3.8088  237.010   4.1717 -3.793701 5.648903 
1 1 1   10   23   15 o  119.311   3.2289  292.279   15.785  273.582   20.923  316.979   24.048  114.939   4.4136  123.684   4.7141 -8.744438 6.457778 
1 1 1   10   23   16 o   33.996   5.2486   23.484   7.5014   12.361   9.8704   38.692   11.542   24.889   8.2487   43.104   6.4922 -18.21468 10.49714 
1 1 1   10   23   17 o   70.793   3.3361  102.223   9.5913   94.824   12.350  113.468   15.226   67.642   4.4267   73.944   4.9924 -6.302078 6.672273 
1 1 1   10   23   18 o  105.415   3.2574  230.699   14.145  217.553   19.997  243.864   20.011  102.389   4.7353  108.440   4.4742 -6.051094 6.514725 
1 1 1   10   23   19 o   76.509   3.6054  121.813   11.319  123.444   15.318  119.852   16.800   77.105   4.8168   75.913   5.3659 1.192238 7.210706 
1 1 1   10   23   20 o  114.663   3.1320  275.947   14.222  284.438   17.935  261.563   23.342  117.176   3.7110  112.151   5.0463 5.025810 6.263949 
1 1 1   10   23   21 o   58.752   4.2236   70.388   9.8683   65.749   12.244   78.988   16.672   56.149   5.2869   61.354   6.5882 -5.204803 8.447262 
1 1 1   10   23   22 o  118.752   3.0435  292.808   14.669  290.908   19.090  295.547   22.922  118.367   3.9103  119.137   4.6648 -0.7692566 6.086989 
1 1 1   10   23   23 o   80.251   3.5744  133.587   11.602  129.823   14.913  139.357   18.464   78.922   4.5816   81.581   5.4876 -2.659081 7.148750 
1 1 1   10   23   24 o   84.436   3.8298  152.633   12.507  159.189   15.435  140.097   21.342   87.396   4.2819   81.476   6.3511 5.920540 7.659677 
1 1 1   10   23   25 o   82.348   4.5027  146.865   14.860  121.750   22.531  166.203   19.770   75.681   7.2180   89.015   5.3849 -13.33418 9.005412 
1 1 1   10   23   26 o   32.001   8.0815   20.258   10.032   21.240   10.550   10.992   32.412   30.840   8.1655   33.163   13.949 -2.322794 16.16296 
1 1 1   10   23   27 o   60.161   4.5836   78.969   10.639   82.815   13.138   71.642   18.131   62.721   5.0786   57.602   7.6317 5.118977 9.167122 
1 1 1   10   23   28 o   90.699   3.7639  171.155   13.065  166.965   15.698  180.601   23.570   89.298   4.2621   92.099   6.2050 -2.800308 7.527785 
1 1 1   10   23   29 o   52.830   5.5688   63.500   10.643   67.088   12.857   55.691   18.968   56.308   5.5363   49.353   9.6641 6.954819 11.13757 
1 1 1   10   23   30 o   31.930   8.0460   21.386   13.382   27.634   20.091   16.404   17.941   34.717   11.771   29.142   10.972 5.574429 16.09209 
1 1 1   10   23   31 o   68.878   4.2171   99.200   11.236   95.138   13.585  107.995   19.989   67.090   4.9094   70.666   6.8582 -3.575943 8.434235 
1 1 1   10   23   32 o   24.835   6.8169   5.9432   9.2385   0.2296   10.743   22.170   18.104   18.186   7.8498   31.483   11.147 -13.29693 13.63388 
1 1 1   10   23   33 o   23.537   6.4858   9.1247   9.4071   14.698   10.938  -6.7145   18.438   25.895   8.6858   21.179   9.6343 4.715759 12.97159 
1 1 1   10   23   34 o   71.890   4.4587  111.146   12.266  108.594   14.766  116.826   22.032   71.287   5.0221   72.493   7.3689 -1.205910 8.917484 
1 1 1   10   23   35 o   23.724   6.8688   8.5834   9.9737   10.442   11.526   3.0443   19.899   23.254   8.7855   24.194   10.561 -0.9393291 13.73756 
1 1 1   10   23   36 o   52.735   6.2542   68.887   11.468   72.942   13.558   58.685   21.502   57.831   5.6841   47.638   11.142 10.19297 12.50834 
1 1 1   10   23   37 o   25.224   6.7952   13.505   10.179   18.755   11.823  -1.5359   20.011   27.895   9.0156   22.552   10.170 5.342802 13.59046 
1 1 1   10   23   38 o   27.419   6.8881   18.551   10.488   24.539   12.346   3.0282   19.878   31.360   9.0456   23.479   10.391 7.880672 13.77624 
1 1 1   10   23   39 o   42.061   7.1983   48.503   11.724   51.153   13.647   41.040   22.905   47.127   7.0209   36.995   12.568 10.13232 14.39651 
1 1 1   10   23   40 o   28.864   7.6358   19.441   10.818   16.195   12.375   29.956   22.275   25.694   9.2037   32.034   12.187 -6.340153 15.27163 
1 1 1   10   23   41 o   53.764   6.9880   75.700   13.912   74.033   16.764   79.389   24.935   55.766   7.2886   51.763   11.925 4.002785 13.97595 
1 1 1   10   24    0 o   59.540   2.7003   74.090   9.2892   74.090   9.2892   74.090   9.2892   59.540   3.8187   59.540   3.8187 0.000000 0.000000 
1 1 1   10   24    1 f   70.073   2.4902  101.465   7.1937   97.414   10.119  105.604   10.229   68.657   3.5736   71.489   3.4690 -2.831902 4.980391 
1 1 1   10   24    2 o  204.153   2.3964  862.518   20.006  872.052   26.688  850.289   30.226  205.470   3.1492  202.837   3.6130 2.632614 4.792796 
1 1 1   10   24    3 o  201.758   2.5045  840.091   20.820  817.926   28.672  864.815   30.282  198.952   3.4941  204.564   3.5891 -5.611755 5.009027 
1 1 1   10   24    4 o  258.625   2.6036  1381.05   27.551  1393.75   41.768  1371.28   36.655  259.640   3.9004  257.610   3.4499 2.030121 5.207208 
1 1 1   10   24    5 o  242.550   2.6902  1211.15   26.826  1156.78   36.232  1277.13   39.911  236.564   3.7134  248.537   3.8934 -11.97316 5.380383 
1 1 1   10   24    6 o  123.379   3.1616  320.972   13.659  326.520   15.699  303.686   27.712  125.731   3.0273  121.027   5.5515 4.703278 6.323265 
1 1 1   10   24    7 o   61.420   2.6668   81.479   6.4078   64.944   10.211   92.221   8.2302   56.021   4.4193   66.819   2.9863 -10.79895 5.333688 
1 1 1   10   24    8 o  132.195   3.2639  387.186   13.808  321.832   30.564  403.944   15.477  124.524   5.9510  139.865   2.6829 -15.34082 6.527831 
1 1 1   10   24    9 o  166.439   2.1990  562.742   14.587  608.641   24.358  537.079   18.214  171.609   3.4415  161.269   2.7383 10.33952 4.397952 
1 1 1   10   24   10 o  195.910   2.6875  761.981   19.612  867.471   37.811  723.153   22.940  204.714   4.4782  187.106   2.9726 17.60707 5.375008 
1 1 1   10   24   11 o  182.053   2.7025  672.471   19.862  626.523   25.252  747.018   32.165  174.092   3.5169  190.014   4.1042 -15.92261 5.404920 
1 1 1   10   24   12 o  144.734   2.4704  429.188   14.676  379.644   19.765  490.067   21.910  135.504   3.5366  153.964   3.4503 -18.45993 4.940872 
1 1 1   10   24   13 o  175.390   2.7057  620.876   19.142  567.274   24.240  709.678   31.199  165.620   3.5485  185.160   4.0854 -19.54010 5.411329 
1 1 1   10   24   14 o   98.352   3.1499  204.009   11.865  210.520   14.457  190.574   20.767  100.890   3.4744   95.813   5.2551 5.076820 6.299776 
1 1 1   10   24   15 o  147.333   3.7162  471.004   19.504  493.247   22.795  410.221   37.682  154.398   3.5796  140.268   6.5135 14.13025 7.432323 
1 1 1   10   24   16 o   19.554   5.5501   3.8687   6.8379   4.7896   9.4478   2.8557   9.9091   19.885   7.8339   19.224   7.8642 0.6611176 11.10025 
1 1 1   10   24   17 o  115.655   2.4181  275.220   11.501  251.342   15.621  303.484   16.996  110.207   3.4366  121.104   3.4026 -10.89711 4.836154 
1 1 1   10   24   18 o   83.430   4.0982  142.508   13.529  154.215   22.974  136.292   16.739   85.893   6.4850   80.967   5.0126 4.925972 8.196458 
1 1 1   10   24   19 o  111.331   3.3429  258.544   15.286  266.951   20.901  248.876   22.413  113.333   4.4714  109.329   4.9705 4.004051 6.685789 
1 1 1   10   24   20 o  127.990   2.7906  337.709   14.262  330.745   17.954  349.621   23.479  126.316   3.4461  129.663   4.3904 -3.346977 5.581287 
1 1 1   10   24   21 o  106.101   3.4311  235.023   14.951  207.906   20.923  263.314   21.371   99.783   5.0839  112.419   4.6091 -12.63599 6.862243 
1 1 1   10   24   22 o  109.508   2.9778  250.018   13.084  251.005   16.697  248.448   21.060  109.913   3.6831  109.102   4.6801 0.8106613 5.955536 
1 1 1   10   24   23 o   35.733   5.9845   29.018   8.6044   31.660   11.113   25.063   13.596   37.979   7.3601   33.487   9.4385 4.492645 11.96903 
1 1 1   10   24   24 o   59.560   4.3270   74.044   10.227   72.016   12.751   77.701   17.123   58.600   5.2758   60.521   6.8598 -1.921539 8.653944 
1 1 1   10   24   25 o   19.870   5.9110   2.0124   7.9129   1.2432   9.8336   3.4252   13.328   18.118   7.6552   21.622   9.0088 -3.503937 11.82208 
1 1 1   10   24   26 o   48.356   4.9362   48.157   9.4818   43.246   11.691   57.597   16.209   45.071   6.2889   51.641   7.6103 -6.569885 9.872488 
1 1 1   10   24   27 o   60.213   7.7695   92.001   13.680   96.550   15.053   70.433   32.780   67.588   5.4001   52.838   14.571 14.75027 15.53899 
1 1 1   10   24   28 o   43.813   6.2089   46.878   10.008   52.936   12.023   33.211   18.059   49.942   5.8369   37.685   10.961 12.25711 12.41784 
1 1 1   10   24   29 o   38.477   6.1819   38.120   9.6560   47.280   11.726   18.828   17.018   47.030   6.0454   29.924   10.785 17.10585 12.36384 
1 1 1   10   24   30 o   46.047   7.2740   51.590   13.924   33.482   20.813   66.260   18.734   37.340   11.951   54.754   8.2957 -17.41460 14.54801 
1 1 1   10   24   31 o   32.875   6.8770   22.232   9.4719   16.291   11.321   36.098   17.295   27.051   8.8276   38.699   10.547 -11.64851 13.75398 
1 1 1   10   24   32 o   60.348   4.9881   74.601   11.313   67.835   13.246   92.842   21.748   56.225   5.7121   64.471   8.1789 -8.246098 9.976113 
1 1 1   10   24   33 o   43.629   6.6099   47.410   10.875   51.419   13.038   38.248   19.712   48.463   6.5230   38.794   11.498 9.668823 13.21977 
1 1 1   10   24   34 o   22.086   6.6878   2.0512   9.5659  -1.0860   11.070   11.301   19.008   17.685   7.7937   26.487   10.870 -8.802286 13.37552 
1 1 1   10   24   35 o   43.948   7.2558   43.750   11.057   39.745   12.433   58.904   24.183   41.361   7.5671   46.535   12.382 -5.174149 14.51150 
1 1 1   10   24   36 o   46.082   7.6815   65.840   12.266   71.153   13.244   33.802   32.524   57.040   5.6297   35.124   14.294 21.91636 15.36295 
1 1 1   10   24   37 f   73.180   4.5681  119.670   12.647  119.337   15.191  120.421   22.827   74.205   4.9635   72.155   7.6703 2.050575 9.136194 
1 1 1   10   24   38 o   30.374   7.3705   17.652   10.173   9.7042   11.670   42.807   20.761   22.232   8.7232   38.515   11.883 -16.28309 14.74108 
1 1 1   10   24   39 o   25.903   7.8421   7.8143   15.805   26.487   22.984  -8.9369   21.770   30.801   12.192   21.004   9.8666 9.797033 15.68420 
1 1 1   10   24   40 o   25.815   7.1951   16.546   11.043   19.153   12.728   8.6132   22.203   27.038   9.3632   24.593   10.927 2.445463 14.39024 
1 1 1   10   24   41 o   26.402   7.2619   18.290   12.547   25.837   14.339  -6.3706   25.921   30.415   9.9356   22.389   10.594 8.025616 14.52373 
1 1 1   10   25    0 o  232.090   2.3342  1112.61   31.585  1112.61   31.585  1112.61   31.585  232.090   3.3011  232.090   3.3011 0.000000 0.000000 
1 1 1   10   25    1 o   59.850   2.7539   74.079   6.7975   73.304   9.6266   74.850   9.5997   59.536   3.9204   60.163   3.8687 -0.6269035 5.507790 
1 1 1   10   25    2 o  163.926   2.6075  548.233   17.278  520.969   22.085  591.245   27.740  158.776   3.3724  169.077   3.9779 -10.30125 5.215047 
1 1 1   10   25    3 o  202.182   2.8204  848.609   23.107  828.097   35.990  862.994   30.140  200.038   4.3622  204.326   3.5764 -4.288635 5.640851 
1 1 1   10   25    4 o  116.442   2.2937  280.766   10.985  270.193   15.953  290.300   15.149  114.343   3.3828  118.541   3.0985 -4.198410 4.587387 
1 1 1   10   25    5 o   68.983   2.6055   98.420   7.4102   95.475   10.504  101.337   10.455   67.953   3.7478   70.014   3.6207 -2.061050 5.211089 
1 1 1   10   25    6 o   57.750   3.4317   68.989   8.1567   67.683   11.137   70.500   11.980   57.168   4.7232   58.331   4.9796 -1.163876 6.863322 
1 1 1   10   25    7 o   82.346   2.9861  140.689   10.058  143.307   13.459  137.378   15.135   83.236   3.9206   81.457   4.5050 1.779388 5.972105 
1 1 1   10   25    8 o  109.750   2.5013  230.746   10.892  180.725   13.396  328.287   18.707   93.498   3.4739  126.003   3.5996 -32.50485 5.002546 
1 1 1   10   25    9 o  138.974   2.2100  400.651   12.488  389.805   19.215  408.581   16.431  137.313   3.3929  140.635   2.8327 -3.321396 4.419957 
1 1 1   10   25   10 o  106.968   2.2453  235.453   9.6211  240.907   15.671  232.154   12.189  107.930   3.5204  106.007   2.7878 1.923088 4.490514 
1 1 1   10   25   11 o   34.455   4.4036   24.674   5.8813   28.965   9.6826   22.166   7.4036   36.736   6.6347   32.175   5.7921 4.560966 8.807224 
1 1 1   10   25   12 o  100.251   2.4440  207.657   10.045  178.200   13.900  239.861   14.534   92.801   3.6316  107.701   3.2718 -14.89921 4.888088 
1 1 1   10   25   13 o  104.696   2.3875  225.558   10.271  254.910   15.093  200.243   14.017  111.014   3.2964   98.378   3.4545 12.63580 4.774950 
1 1 1   10   25   14 o   51.329   3.5276   55.816   7.3183   46.183   10.806   63.977   9.9467   47.112   5.5611   55.547   4.3416 -8.434795 7.055222 
1 1 1   10   25   15 o  109.720   4.1918  260.243   14.536  265.834   16.141  236.253   33.433  113.334   3.4530  106.107   7.6395 7.227341 8.383651 
1 1 1   10   25   16 o  147.939   3.6216  440.897   17.737  431.492   19.762  479.869   40.228  144.384   3.3185  151.494   6.4382 -7.110580 7.243114 
1 1 1   10   25   17 o   95.000   2.6118  187.380   10.218  181.151   14.710  193.187   14.203   93.455   3.8164   96.545   3.5668 -3.089706 5.223689 
1 1 1   10   25   18 o   65.557   3.6116   89.868   9.7244   92.661   13.290   86.650   14.266   66.695   4.8315   64.419   5.3694 2.275658 7.223162 
1 1 1   10   25   19 o   53.441   4.8428   59.918   10.492   61.872   16.533   58.600   13.577   54.066   7.4139   52.816   6.2327 1.249908 9.685697 
1 1 1   10   25   20 o   19.776   5.4338   2.5501   7.2033   11.693   9.7769  -8.3064   10.654   24.160   8.2114   15.391   7.1188 8.769761 10.86761 
1 1 1   10   25   21 o   23.517   5.9367   10.162   7.5083   14.181   10.012   4.9976   11.350   25.891   8.2892   21.142   8.5009 4.748373 11.87335 
1 1 1   10   25   22 o   35.656   5.7752   29.047   8.2997   33.576   10.924   22.861   12.766   39.242   7.0063   32.071   9.1828 7.170734 11.55041 
1 1 1   10   25   23 o   35.495   5.9841   27.745   8.5013   25.398   10.933   31.335   13.521   33.719   7.9845   37.270   8.9155 -3.551010 11.96821 
1 1 1   10   25   24 o   47.269   4.9697   48.162   9.5468   49.574   12.602   46.260   14.625   48.257   6.3317   46.281   7.6616 1.975742 9.939358 
1 1 1   10   25   25 o   52.404   4.7265   60.362   9.7925   65.868   12.591   51.936   15.578   55.824   5.4688   48.984   7.7105 6.839603 9.453058 
1 1 1   10   25   26 o   60.628   4.3088   80.354   10.210   86.030   12.858   70.668   16.797   63.942   4.8755   57.314   7.1058 6.627926 8.617572 
1 1 1   10   25   27 o  115.721   4.1800  291.939   19.174  254.134   30.468  316.729   24.672  108.802   6.7895  122.639   4.8776 -13.83697 8.359935 
1 1 1   10   25   28 o   43.854   8.0042   45.311   10.938   45.604   11.642   43.112   31.923   46.143   6.1173   41.564   14.793 4.578709 16.00836 
1 1 1   10   25   29 o   61.259   4.3871   80.523   10.481   80.466   12.902   80.634   17.974   61.625   5.0761   60.892   7.1568 0.7334747 8.774145 
1 1 1   10   25   30 o   25.385   6.4505   13.198   9.1132   18.790   10.974   0.7765   16.357   28.649   8.5996   22.121   9.6169 6.528578 12.90107 
1 1 1   10   25   31 o   50.586   6.7274   59.217   13.725   67.257   20.206   52.330   18.701   54.362   9.0117   46.809   9.9909 7.553429 13.45475 
1 1 1   10   25   32 o   32.937   6.0272   28.689   9.9272   40.650   11.900   1.3067   18.004   42.998   6.7098   22.876   10.014 20.12199 12.05431 
1 1 1   10   25   33 o   68.106   4.5796  104.126   11.765  107.948   14.246   95.928   20.865   71.037   4.8623   65.174   7.7621 5.862343 9.159239 
1 1 1   10   25   34 o   20.443   6.3176  -4.1467   9.1981 -10.6196   10.748   13.574   17.783   14.340   6.7955   26.546   10.652 -12.20550 12.63523 
1 1 1   10   25   35 o   31.379   7.3788   21.166   10.045   16.237   11.607   35.870   20.048   26.312   8.9470   36.446   11.736 -10.13422 14.75756 
1 1 1   10   25   36 o   28.213   7.2111   18.991   10.060   19.333   11.639   17.983   20.005   28.090   8.9314   28.336   11.324 -0.2459526 14.42219 
1 1 1   10   25   37 o   20.351   6.2087   2.9045   9.8220   9.3805   11.459 -15.0327   19.070   21.990   8.6389   18.712   8.9197 3.277851 12.41739 
1 1 1   10   25   38 f   20.983   6.5128   4.0785   9.9790   7.0447   11.267  -6.7193   21.496   20.639   8.4078   21.327   9.9486 -0.6884041 13.02558 
1 1 1   10   25   39 o   21.968   7.1999  -2.5597   15.542  -4.5228   22.366  -0.7269   21.612   21.714   10.135   22.222   10.229 -0.5084076 14.39979 
1 1 1   10   25   40 o   21.921   6.9174   0.4444   11.317  -6.2229   13.246   18.472   21.780   16.790   7.8244   27.053   11.410 -10.26356 13.83476 
1 1 1   10   26    0 o   56.219   3.2291   66.602   10.428   66.602   10.428   66.602   10.428   56.219   4.5667   56.219   4.5667 0.000000 0.000000 
1 1 1   10   26    1 o   61.878   2.9187   79.448   7.4198   76.724   10.876   81.821   10.148   60.872   4.3319   62.885   3.9128 -2.012848 5.837391 
1 1 1   10   26    2 o   57.582   3.8412   65.025   8.3378   60.030   9.7890   78.226   15.914   53.839   4.4084   61.325   6.2916 -7.486374 7.682348 
1 1 1   10   26    3 o  109.002   2.7624  246.594   12.028  248.895   15.260  242.820   19.545  109.722   3.3722  108.282   4.3763 1.440147 5.524847 
1 1 1   10   26    4 f   63.508   2.7264   83.556   7.1237   90.741   10.110   76.472   10.039   66.231   3.7011   60.785   4.0043 5.446232 5.452741 
1 1 1   10   26    5 o   94.311   2.6023  186.110   9.8215  193.387   12.600  174.841   15.679   96.727   3.1583   91.896   4.1366 4.830498 5.204503 
1 1 1   10   26    6 o   91.192   2.3978  170.309   8.9542  144.407   12.078  201.915   13.342   83.559   3.5047   98.825   3.2734 -15.26542 4.795580 
1 1 1   10   26    7 o  120.601   2.4015  300.285   11.863  304.999   17.923  296.610   15.825  121.423   3.5788  119.779   3.2033 1.644402 4.803067 
1 1 1   10   26    8 f   58.004   2.8954   69.845   6.9074   66.816   10.010   72.598   9.5441   56.789   4.2735   59.218   3.9077 -2.428726 5.790716 
1 1 1   10   26    9 o   89.805   2.7320  167.945   9.7417  112.823   13.305  231.642   14.303   73.777   4.3725  105.832   3.2767 -32.05508 5.463998 
1 1 1   10   26   10 o  101.428   2.4516  213.763   10.199  202.708   14.996  223.277   13.912   98.957   3.6743  103.899   3.2465 -4.942329 4.903127 
1 1 1   10   26   11 o   48.594   3.6027   52.636   6.7037   33.859   10.179   67.017   8.9086   40.300   6.1239   56.887   3.7969 -16.58683 7.205453 
1 1 1   10   26   12 o  206.329   2.8066  866.370   23.282  816.115   29.417  950.623   38.089  198.550   3.5922  214.107   4.3133 -15.55646 5.613239 
1 1 1   10   26   13 o  103.725   2.4233  222.744   10.365  217.385   14.654  228.108   14.662  102.472   3.4673  104.979   3.3862 -2.506332 4.846519 
1 1 1   10   26   14 o  107.830   2.6654  238.922   11.789  207.650   15.917  276.921   17.546  100.070   3.8565  115.590   3.6803 -15.52034 5.330726 
1 1 1   10   26   15 f   41.663   3.7997   35.284   6.4348   42.106   10.212   30.792   8.2872   44.903   5.5139   38.423   5.2293 6.479317 7.599310 
1 1 1   10   26   16 f   76.393   2.8090  122.946   8.7201  103.696   12.717  140.027   11.980   70.612   4.3667   82.174   3.5347 -11.56169 5.617971 
1 1 1   10   26   17 o  112.156   2.8668  249.561   12.846  216.767   15.934  310.459   21.713  102.169   3.7812  122.144   4.3101 -19.97556 5.733643 
1 1 1   10   26   18 o   74.390   2.8619  115.590   8.7075  111.309   13.049  119.025   11.691   73.097   4.3284   75.684   3.7452 -2.587097 5.723779 
1 1 1   10   26   19 o   29.986   5.4898   18.725   7.3271   8.7756   9.8248   31.193   10.998   22.268   8.1687   37.704   7.3366 -15.43513 10.97967 
1 1 1   10   26   20 o   50.782   5.0373   55.211   10.196   52.951   16.498   56.608   12.969   49.731   8.0433   51.833   6.0667 -2.101608 10.07465 
1 1 1   10   26   21 o   81.490   3.1974  137.622   10.548  133.001   13.568  144.680   16.768   79.867   4.1189   83.113   4.8916 -3.246025 6.394761 
1 1 1   10   26   22 o   26.001   6.0965   13.883   7.6546   10.746   10.268   17.809   11.484   23.555   8.3893   28.447   8.8480 -4.892214 12.19296 
1 1 1   10   26   23 o   27.536   6.2393   16.378   7.8791   16.094   10.047   16.830   12.698   27.037   8.2539   28.036   9.3588 -0.9988251 12.47856 
1 1 1   10   26   24 o   42.251   5.2342   38.349   8.7626   35.431   11.228   42.894   14.014   40.680   6.6922   43.822   8.0501 -3.142673 10.46849 
1 1 1   10   26   25 o   82.014   3.6214  142.334   12.165  146.932   16.439  136.768   18.086   83.603   4.7676   80.425   5.4524 3.178375 7.242823 
1 1 1   10   26   26 o   32.100   5.6591   24.365   8.6772   37.246   11.292   5.7947   13.559   41.634   6.5762   22.566   9.2117 19.06743 11.31818 
1 1 1   10   26   27 o   36.164   6.3037   30.750   9.0279   32.304   11.046   27.624   15.668   37.989   7.3153   34.340   10.268 3.648502 12.60741 
1 1 1   10   26   28 o   34.655   7.6464   30.601   10.674   33.614   11.312   6.1130   32.247   38.679   7.3595   30.631   13.406 8.048567 15.29284 
1 1 1   10   26   29 o   27.501   6.2778   17.625   8.6801   23.339   10.487   5.1916   15.469   31.850   7.9951   23.152   9.6811 8.697226 12.55565 
1 1 1   10   26   30 f   59.772   4.3893   73.569   10.428   63.741   12.832   92.679   17.894   54.416   5.7173   65.128   6.6614 -10.71244 8.778521 
1 1 1   10   26   31 o   28.302   7.5630   15.598   12.892   3.2312   19.061   26.026   17.502   23.947   10.396   32.658   10.987 -8.711260 15.12591 
1 1 1   10   26   32 o   51.224   5.8288   64.494   10.918   73.669   13.662   48.281   18.161   58.276   5.6842   44.172   10.178 14.10425 11.65765 
1 1 1   10   26   33 o   33.146   6.9201   26.059   9.5045   23.332   11.368   32.394   17.325   31.007   8.5921   35.284   10.850 -4.276903 13.84012 
1 1 1   10   26   34 o   27.682   7.3355   17.006   10.643   16.125   12.677   19.113   19.593   26.379   9.3294   28.985   11.323 -2.605688 14.67098 
1 1 1   10   26   35 o   42.174   6.8437   41.562   10.784   36.195   12.719   55.278   20.334   38.696   8.2232   45.652   10.942 -6.956566 13.68746 
1 1 1   10   26   36 o   22.807   6.8258   6.9021   9.8174   5.1827   11.335   12.064   19.639   19.923   8.3052   25.690   10.835 -5.766962 13.65151 
1 1 1   10   26   37 o   29.382   8.4050   12.815   10.886   7.8542   11.595   49.667   31.606   21.158   8.5623   37.605   14.466 -16.44776 16.81005 
1 1 1   10   26   38 o   23.896   6.8911   0.4556   10.259 -10.5536   11.854   33.306   20.476   14.840   7.0624   32.952   11.835 -18.11242 13.78221 
1 1 1   10   26   39 f   43.538   7.4265   47.729   11.909   40.563   13.786   68.807   23.643   39.589   8.6820   47.488   12.051 -7.898254 14.85299 
1 1 1   10   27    0 o  132.549   2.6240  363.836   20.252  363.836   20.252  363.836   20.252  132.549   3.7110  132.549   3.7110 0.000000 0.000000 
1 1 1   10   27    1 o   86.035   2.5054  153.058   8.8422  152.162   11.885  154.168   13.233   85.768   3.3597   86.302   3.7176 -0.5340195 5.010826 
1 1 1   10   27    2 o  112.385   2.4073  260.869   11.146  252.586   15.338  270.140   16.226  110.502   3.3654  114.269   3.4430 -3.767044 4.814529 
1 1 1   10   27    3 o  134.248   2.1999  372.423   12.176  364.925   16.922  380.472   17.533  132.851   3.0882  135.646   3.1338 -2.795181 4.399777 
1 1 1   10   27    4 o   95.239   2.4745  184.498   9.5997  207.748   15.082  168.663   12.447  100.183   3.6500   90.295   3.3421 9.887497 4.948975 
1 1 1   10   27    5 o   66.902   3.1695   92.564   8.3918   91.886   10.467   93.783   14.040   66.613   3.8098   67.191   5.0664 -0.5776062 6.339053 
1 1 1   10   27    6 o  188.904   2.3931  736.098   18.370  725.514   23.928  751.292   28.669  187.306   3.0973  190.501   3.6488 -3.195908 4.786143 
1 1 1   10   27    7 o   87.440   2.6313  159.045   9.3788  153.231   14.257  163.480   12.453   85.995   4.0196   88.885   3.3968 -2.889793 5.262665 
1 1 1   10   27    8 o   81.155   2.8593  138.720   9.4053  120.281   14.048  153.699   12.662   76.143   4.4732   86.167   3.5628 -10.02404 5.718654 
1 1 1   10   27    9 o  167.513   2.9370  579.980   20.221  515.320   27.828  652.309   29.432  157.624   4.2805  177.401   4.0225 -19.77698 5.873956 
1 1 1   10   27   10 o  127.088   4.5697  332.193   18.077  329.240   19.838  346.645   43.889  126.038   3.8162  128.137   8.3046 -2.099258 9.139445 
1 1 1   10   27   11 o   96.779   2.7461  195.104   10.854  200.839   14.498  187.794   16.370   98.446   3.5707   95.111   4.1730 3.335274 5.492179 
1 1 1   10   27   12 f   47.358   3.5732   43.116   6.5673   57.835   12.020   36.852   7.8410   52.622   5.5383   42.094   4.5163 10.52795 7.146312 
1 1 1   10   27   13 o   64.825   3.0768   85.943   8.0132   93.598   13.117   81.385   10.121   67.039   4.7438   62.610   3.9195 4.429230 6.153594 
1 1 1   10   27   14 o  172.907   2.2933  619.469   16.348  614.997   22.759  624.236   23.498  172.273   3.2031  173.541   3.2829 -1.268112 4.586619 
1 1 1   10   27   15 o   24.195   5.3944   11.590   6.0208   16.493   9.4792   8.2740   7.7952   27.507   7.9238   20.884   7.3220 6.622297 10.78882 
1 1 1   10   27   16 f   64.190   2.9783   86.423   7.7727   81.900   11.863   89.825   10.289   62.648   4.5912   65.731   3.7951 -3.083637 5.956661 
1 1 1   10   27   17 o   69.253   3.0980   99.744   8.6025  101.268   13.944   98.807   10.931   69.589   4.8582   68.917   3.8455 0.6725616 6.195946 
1 1 1   10   27   18 o   48.422   4.4079   49.054   8.5269   47.843   10.739   51.120   14.026   47.748   5.4532   49.096   6.9268 -1.348679 8.815810 
1 1 1   10   27   19 o  112.975   4.2953  279.895   14.798  285.374   16.285  253.942   35.446  117.198   3.3690  108.753   7.9024 8.445244 8.590548 
1 1 1   10   27   20 o  114.512   2.8096  269.810   12.838  258.785   16.078  289.202   21.324  111.489   3.4966  117.535   4.3987 -6.045761 5.619183 
1 1 1   10   27   21 o   69.012   3.9970   98.292   11.233  118.613   17.631   84.406   14.574   74.849   5.7110   63.174   5.5935 11.67536 7.993932 
1 1 1   10   27   22 o   18.759   5.4841   2.5912   6.9986   5.3444   9.3416  -0.9312   10.566   19.780   7.7907   17.739   7.7206 2.041477 10.96828 
1 1 1   10   27   23 o   42.279   4.9513   39.157   8.2333   40.121   10.684   37.747   12.918   43.455   5.9613   41.103   7.9072 2.352749 9.902634 
1 1 1   10   27   24 o   77.460   3.3934  125.505   10.673  121.816   13.839  130.922   16.769   76.189   4.4038   78.731   5.1640 -2.541344 6.786812 
1 1 1   10   27   25 o   40.169   5.5078   37.475   8.5631   42.046   10.904   30.120   13.831   44.348   5.9617   35.991   9.2629 8.356518 11.01557 
1 1 1   10   27   26 o  100.839   3.6434  215.624   15.133  214.470   21.933  216.674   20.906  100.507   5.2910  101.172   5.0101 -0.6651993 7.286714 
1 1 1   10   27   27 o   55.261   4.4999   66.244   9.9012   67.144   12.546   64.758   16.123   56.104   5.4217   54.418   7.1834 1.685532 8.999803 
1 1 1   10   27   28 o   58.786   4.3753   74.411   10.127   73.898   12.580   75.356   17.071   58.896   5.1786   58.677   7.0537 0.2195778 8.750592 
1 1 1   10   27   29 o   76.206   5.7764  117.939   12.911  112.566   13.906  151.505   34.758   72.784   4.6323   79.629   10.583 -6.844872 11.55273 
1 1 1   10   27   30 o   34.826   6.3873   29.023   8.9499   29.085   11.014   28.902   15.357   35.384   7.7602   34.268   10.147 1.116199 12.77462 
1 1 1   10   27   31 o   29.073   6.2098   12.723   9.0387  -0.4318   11.009   39.935   15.833   17.831   7.8175   40.315   9.6506 -22.48385 12.41963 
1 1 1   10   27   32 o   50.578   6.5704   62.380   13.316   56.077   19.289   68.119   18.407   47.080   10.226   54.076   8.2528 -6.996296 13.14081 
1 1 1   10   27   33 o   35.445   7.0665   30.678   10.319   27.504   12.625   37.066   17.911   33.385   8.9753   37.506   10.917 -4.121155 14.13307 
1 1 1   10   27   34 o   29.853   7.0091   23.318   9.9464   25.885   11.486   15.624   19.886   32.396   8.4929   27.310   11.153 5.085983 14.01826 
1 1 1   10   27   35 o   23.455   6.5406   11.130   9.6284   15.796   11.516   0.2899   17.552   25.562   8.9030   21.348   9.5842 4.214291 13.08125 
1 1 1   10   27   36 o   31.992   7.2281   24.803   10.055   19.341   11.946   38.072   18.619   27.543   9.0722   36.440   11.255 -8.896914 14.45613 
1 1 1   10   27   37 o   29.372   7.0687   12.486   10.051   0.9115   11.492   50.132   20.727   17.954   7.9253   40.790   11.707 -22.83589 14.13746 
1 1 1   10   27   38 o   37.105   8.6709   41.976   12.814   41.187   13.406   50.316   43.592   40.210   8.3563   34.000   15.196 6.209728 17.34174 
1 1 1   10   28    0 o  172.413   2.1888  614.546   21.996  614.546   21.996  614.546   21.996  172.413   3.0954  172.413   3.0954 0.000000 0.000000 
1 1 1   10   28    1 o  100.386   2.3381  208.868   9.6225  211.632   12.967  205.482   14.355  101.147   3.1083   99.626   3.4935 1.520836 4.676174 
1 1 1   10   28    2 o   98.353   2.5623  201.020   10.328  207.221   13.975  193.556   15.332  100.056   3.3865   96.649   3.8462 3.407074 5.124605 
1 1 1   10   28    3 o  109.897   2.3436  249.389   10.551  245.134   14.070  254.856   15.949  108.850   3.1339  110.945   3.4854 -2.094711 4.687179 
1 1 1   10   28    4 o  108.506   2.2250  243.675   9.9520  253.756   14.114  233.706   14.035  110.745   3.0899  106.267   3.2022 4.478096 4.449945 
1 1 1   10   28    5 o  208.510   2.9086  897.177   24.234  882.628   30.569  921.786   39.756  206.399   3.5910  210.622   4.5765 -4.222855 5.817193 
1 1 1   10   28    6 o   26.113   5.6798   15.663   6.3343   3.4980   15.149   18.241   6.9731   23.206   9.6313   29.019   6.0233 -5.813215 11.35964 
1 1 1   10   28    7 o  109.715   2.9599  260.901   12.361  219.759   21.206  282.072   15.212  102.712   5.0058  116.718   3.1600 -14.00638 5.919734 
1 1 1   10   28    8 o   41.420   3.6643   37.179   6.0134   28.182   9.0649   44.251   8.0363   36.691   5.9901   46.150   4.2221 -9.458443 7.328536 
1 1 1   10   28    9 o  124.324   2.5630  311.954   12.959  267.763   16.735  378.139   20.480  113.633   3.5707  135.015   3.6778 -21.38190 5.125994 
1 1 1   10   28   10 o  143.427   2.7259  425.043   16.001  411.345   21.202  443.166   24.389  140.805   3.6509  146.048   4.0488 -5.243332 5.451770 
1 1 1   10   28   11 o  132.549   2.6400  365.425   13.943  367.342   17.609  362.204   22.830  133.133   3.2069  131.965   4.1945 1.167282 5.279930 
1 1 1   10   28   12 o  187.822   2.7994  737.349   19.276  742.082   22.624  724.811   36.822  189.282   2.8979  186.363   4.7906 2.918961 5.598872 
1 1 1   10   28   13 o  117.761   2.3939  288.282   11.606  297.954   16.114  277.858   16.729  119.844   3.2601  115.678   3.5063 4.165833 4.787720 
1 1 1   10   28   14 o  101.181   2.3913  212.624   9.9737  209.919   14.292  215.192   13.925  100.541   3.4465  101.822   3.3158 -1.281258 4.782588 
1 1 1   10   28   15 o   69.734   3.3102  101.500   9.5154  104.078   13.740   99.124   13.190   70.577   4.7203   68.892   4.6421 1.685135 6.620482 
1 1 1   10   28   16 o  106.256   2.8383  235.331   12.199  178.300   16.756  299.645   17.794   92.442   4.3947  120.070   3.5931 -27.62815 5.676619 
1 1 1   10   28   17 o   45.738   4.3840   48.677   7.2530   33.732   11.928   57.446   9.1362   39.027   7.6838   52.449   4.2234 -13.42238 8.767972 
1 1 1   10   28   18 o  117.229   3.1081  293.641   14.605  217.329   20.808  367.734   20.503  101.662   4.9626  132.795   3.7435 -31.13269 6.216155 
1 1 1   10   28   19 o   73.125   3.3287  113.193   9.8655  117.851   12.976  106.813   15.187   75.057   4.1917   71.192   5.1722 3.864944 6.657489 
1 1 1   10   28   20 o   78.154   5.2780  121.448   12.196  117.096   13.160  147.932   32.467   74.778   4.2669   81.531   9.6551 -6.752930 10.55591 
1 1 1   10   28   21 o   30.103   6.6612   20.349   8.8998   17.613   15.969   21.582   10.719   29.290   10.459   30.915   8.2521 -1.624985 13.32246 
1 1 1   10   28   22 o   82.865   3.8836  145.809   13.204  128.738   18.635  163.018   18.710   77.854   5.8035   87.876   5.1623 -10.02145 7.767229 
1 1 1   10   28   23 o   38.067   5.2370   32.425   7.9719   34.921   10.686   29.293   11.971   40.313   6.4269   35.820   8.2704 4.492737 10.47396 
1 1 1   10   28   24 o   32.651   5.4887   24.933   7.6260   32.037   10.071   15.387   11.675   38.621   6.3227   26.681   8.9736 11.93977 10.97734 
1 1 1   10   28   25 o   37.260   5.6961   31.851   8.4515   32.885   11.300   30.539   12.732   38.197   7.4406   36.323   8.6266 1.873234 11.39213 
1 1 1   10   28   26 f   48.713   5.2519   57.108   9.2873   67.574   11.725   39.484   15.215   56.389   5.0415   41.037   9.2148 15.35197 10.50376 
1 1 1   10   28   27 o   26.924   6.1908   16.273   8.5702   23.458   11.098   5.6566   13.489   31.713   8.3643   22.135   9.1292 9.578419 12.38162 
1 1 1   10   28   28 o   32.810   6.3223   24.255   8.4975   20.303   10.509   31.717   14.441   29.429   8.2994   36.190   9.5397 -6.761251 12.64460 
1 1 1   10   28   29 f   44.127   5.1570   41.792   8.9673   34.394   11.238   54.761   14.879   38.749   7.2992   49.506   7.2869 -10.75661 10.31397 
1 1 1   10   28   30 o   25.130   8.2769   2.2718   9.4504   1.6415   9.6947   14.305   42.358   17.661   7.5368   32.598   14.739 -14.93690 16.55385 
1 1 1   10   28   31 o   77.854   3.8451  130.375   12.026  124.797   15.238  139.587   19.583   76.097   4.8551   79.612   5.9639 -3.514908 7.690272 
1 1 1   10   28   32 o   18.124   6.0454 -15.4420   11.608  -2.0204   18.054 -24.8993   15.155   21.392   9.6518   14.855   7.2822 6.537316 12.09076 
1 1 1   10   28   33 o   25.821   6.9041   15.086   9.7979   14.797   12.186   15.615   16.477   25.208   9.1202   26.435   10.368 -1.227142 13.80814 
1 1 1   10   28   34 o   22.264   6.4898   7.7887   9.1272   6.1350   11.114   11.214   15.996   20.223   8.3073   24.305   9.9729 -4.081688 12.97956 
1 1 1   10   28   35 o   56.650   5.1021   74.967   11.287   74.420   13.958   76.001   19.185   57.499   5.8855   55.801   8.3359 1.698002 10.20419 
1 1 1   10   28   36 o   27.621   8.1317   11.691   11.515   5.8319   12.517   43.950   29.371   20.368   8.6231   34.874   13.789 -14.50570 16.26341 
1 1 1   10   29    0 o  201.930   2.5067  843.995   29.504  843.995   29.504  843.995   29.504  201.930   3.5450  201.930   3.5450 0.000000 0.000000 
1 1 1   10   29    1 o  137.456   2.7116  392.166   15.371  384.926   21.671  399.497   21.806  136.173   3.8586  138.738   3.8108 -2.564514 5.423182 
1 1 1   10   29    2 o   78.362   2.4977  126.177   8.0353  113.012   10.797  142.522   12.030   73.821   3.5461   82.904   3.5183 -9.083420 4.995332 
1 1 1   10   29    3 o   67.621   2.5473   94.861   7.1036   93.252   10.054   96.464   10.038   67.045   3.6358   68.197   3.5687 -1.152283 5.094616 
1 1 1   10   29    4 o   44.280   3.2782   41.341   5.9106   36.154   8.6972   45.793   8.0570   41.625   5.0660   46.935   4.1621 -5.310558 6.556426 
1 1 1   10   29    5 o   84.603   2.9570  148.500   10.305  139.152   14.222  158.835   14.953   81.800   4.2154   87.406   4.1479 -5.605743 5.913999 
1 1 1   10   29    6 o   88.580   2.5323  162.546   9.1707  164.927   13.965  160.740   12.160   89.115   3.7994   88.045   3.3487 1.069450 5.064510 
1 1 1   10   29    7 o  103.356   2.2463  221.471   9.5739  225.571   13.503  217.327   13.576  104.325   3.1382  102.388   3.2149 1.936890 4.492660 
1 1 1   10   29    8 o   66.105   2.7081   91.919   7.2589   73.085   10.307  110.450   10.224   59.251   4.2178   72.959   3.3977 -13.70858 5.416134 
1 1 1   10   29    9 o   67.227   3.2451   88.751   8.5416   77.996   10.316  112.197   15.231   61.213   4.0862   73.240   5.0423 -12.02726 6.490117 
1 1 1   10   29   10 f   17.212   5.0250  -1.3943   6.1544  -7.8248   8.0196   7.8189   9.5992   12.863   6.0251   21.561   8.0438 -8.697888 10.05008 
1 1 1   10   29   11 o   66.490   3.1906   91.701   8.3091   90.462   10.226   94.107   14.254   65.955   3.7593   67.024   5.1563 -1.069534 6.381221 
1 1 1   10   29   12 o   39.913   4.6957   35.229   7.0283   37.309   8.6884   31.293   11.955   42.225   4.9889   37.601   7.9566 4.623665 9.391358 
1 1 1   10   29   13 o   78.150   3.0833  117.339   9.0866  104.342   10.619  152.872   17.558   70.846   3.6342   85.454   4.9818 -14.60740 6.166518 
1 1 1   10   29   14 o   36.368   4.9415   28.402   7.0186   27.594   8.8128   29.803   11.606   36.148   5.9110   36.587   7.9205 -0.4386177 9.883060 
1 1 1   10   29   15 o   43.927   3.9725   41.716   6.9872   31.204   10.057   51.525   9.7148   38.301   6.3663   49.553   4.7534 -11.25178 7.945064 
1 1 1   10   29   16 o   40.837   3.8711   33.601   6.1055   39.907   11.097   30.863   7.3117   43.318   6.2111   38.355   4.6220 4.962704 7.742119 
1 1 1   10   29   17 o   21.261   5.2648   8.7374   5.2572   8.1309   10.324   8.9498   6.1086   21.981   8.3123   20.542   6.4636 1.439365 10.52954 
1 1 1   10   29   18 o   81.239   2.9985  142.369   9.7281  114.746   14.739  163.689   12.949   73.858   4.8385   88.619   3.5428 -14.76038 5.996907 
1 1 1   10   29   19 o   23.955   4.6932   13.652   5.5564   0.2379   9.7629   20.078   6.7576   17.557   7.5296   30.353   5.6044 -12.79570 9.386361 
1 1 1   10   29   20 o   52.147   3.5252   56.009   7.3440   62.587   12.252   52.321   9.1748   54.367   5.4641   49.927   4.4555 4.439831 7.050411 
1 1 1   10   29   21 o   30.751   7.7628   21.706   10.102   24.833   10.410 -28.7917   41.834   33.093   7.7614   28.409   13.446 4.684082 15.52569 
1 1 1   10   29   22 o   28.780   6.6762   7.7705   8.4627   39.349   19.150   0.1065   9.4339   40.433   11.131   17.128   7.3747 23.30465 13.35241 
1 1 1   10   29   23 o   53.284   5.6656   67.571   11.123   49.293   18.005   78.851   14.144   45.799   9.8261   60.770   5.6432 -14.97046 11.33130 
1 1 1   10   29   24 o   77.810   3.3452  128.393   10.406  129.055   13.218  127.314   16.875   78.330   4.0914   77.291   5.2935 1.038651 6.690338 
1 1 1   10   29   25 o   74.283   3.5921  116.305   10.903  109.232   14.309  126.096   16.835   71.727   4.8368   76.838   5.3120 -5.111298 7.184123 
1 1 1   10   29   26 o   32.376   5.7443   22.003   8.0960   10.618   10.333   40.105   13.029   22.991   8.3858   41.761   7.8527 -18.77018 11.48857 
1 1 1   10   29   27 o   17.242   5.4136  -2.4196   7.5199  -4.7817   9.6295   1.2725   12.039   15.183   6.9283   19.300   8.3204 -4.116962 10.82730 
1 1 1   10   29   28 o   24.152   6.2761   11.755   8.0414   9.9142   10.263   14.682   12.941   22.379   8.3236   25.926   9.3956 -3.546215 12.55225 
1 1 1   10   29   29 o   27.465   6.3975   18.031   8.2968   18.673   10.489   16.957   13.562   27.912   8.4137   27.018   9.6395 0.8936901 12.79493 
1 1 1   10   29   30 o   37.242   6.1646   31.712   9.1400   24.290   11.459   44.693   15.155   31.585   8.5753   42.900   8.8584 -11.31417 12.32913 
1 1 1   10   29   31 o   31.281   8.4203   19.023   10.430   16.628   11.021   39.557   32.272   26.360   8.7154   36.203   14.410 -9.842695 16.84052 
1 1 1   10   29   32 o   25.034   6.6782   14.303   9.7107   18.565   11.888   5.7592   16.833   27.329   9.0526   22.739   9.8206 4.589251 13.35637 
1 1 1   10   29   33 o   36.817   10.273   27.789   17.369   16.188   18.830   93.951   44.970   26.828   10.892   46.806   17.420 -19.97856 20.54530 
1 1 1   10   29   34 o   24.419   7.8142   8.5386   12.070   10.348   12.552 -13.6749   43.977   22.522   8.9798   26.316   12.791 -3.793402 15.62832 
1 1 1   10   29   35 o   28.942   9.4913   18.457   25.950   16.004   31.663   23.477   45.286   27.786   12.634   30.098   14.167 -2.311790 18.98255 
1 1 1   10   30    0 f  145.915   2.1204  440.757   18.030  440.757   18.030  440.757   18.030  145.915   2.9988  145.915   2.9988 0.000000 0.000000 
1 1 1   10   30    1 o  120.889   2.3768  303.302   11.848  301.832   16.561  304.842   16.957  120.597   3.3296  121.182   3.3927 -0.5853500 4.753623 
1 1 1   10   30    2 o  105.650   2.2176  231.463   9.6625  229.205   13.556  233.795   13.777  105.129   3.1263  106.172   3.1461 -1.043594 4.435264 
1 1 1   10   30    3 o   84.651   2.3287  148.733   8.1273  153.697   11.513  143.802   11.475   86.067   3.2432   83.235   3.3426 2.832405 4.657386 
1 1 1   10   30    4 o   51.578   3.4134   56.989   6.8830   50.970   11.408   60.433   8.6307   49.260   5.6152   53.895   3.8826 -4.635559 6.826854 
1 1 1   10   30    5 o   48.629   3.4854   47.312   6.7616   33.365   8.6914   68.696   10.762   39.894   5.2822   57.365   4.5486 -17.47099 6.970748 
1 1 1   10   30    6 o   93.338   2.4455  181.585   9.3360  175.548   14.008  186.409   12.523   91.891   3.6960   94.786   3.2033 -2.894997 4.890951 
1 1 1   10   30    7 f  128.658   2.2517  338.121   11.776  314.414   15.201  373.698   18.622  123.150   2.9928  134.166   3.3652 -11.01564 4.503445 
1 1 1   10   30    8 o   82.857   2.8218  144.571   9.0541  147.920   11.118  137.977   15.600   84.438   3.1925   81.276   4.6538 3.161789 5.643577 
1 1 1   10   30    9 o   71.860   3.0946  105.720   8.3520  102.937   9.8800  112.688   15.634   70.400   3.4027   73.320   5.1699 -2.919975 6.189141 
1 1 1   10   30   10 o  120.968   2.5032  299.850   11.665  292.140   14.079  316.726   20.830  118.695   2.8760  123.241   4.0980 -4.545723 5.006495 
1 1 1   10   30   11 o   33.248   5.9656   24.901   8.1969   24.007   11.699   25.763   11.488   32.646   8.5772   33.850   8.2937 -1.203632 11.93122 
1 1 1   10   30   12 o   51.460   4.4765   56.337   9.4967   55.816   13.210   56.894   13.662   51.233   6.2517   51.686   6.4087 -0.4529419 8.952905 
1 1 1   10   30   13 o   78.544   3.4701  129.730   11.239  128.374   15.995  131.054   15.796   78.121   4.9641   78.967   4.8501 -0.8464508 6.940140 
1 1 1   10   30   14 o   26.550   5.5114   15.888   6.2684   17.244   7.5703   12.932   11.180   27.872   6.6737   25.228   8.7729 2.644508 11.02278 
1 1 1   10   30   15 o   75.794   2.9644  112.478   8.6806   99.707   10.349  142.781   15.942   69.147   3.6289   82.441   4.6885 -13.29349 5.928824 
1 1 1   10   30   16 f   33.484   4.4295   29.712   5.6278   9.8424   9.2653   41.328   7.0844   22.484   7.9733   44.484   3.8613 -22.00020 8.859054 
1 1 1   10   30   17 o   75.701   2.6594  120.380   8.2424  111.324   12.113  128.190   11.248   72.967   4.0248   78.436   3.4770 -5.469215 5.318742 
1 1 1   10   30   18 o   93.791   2.5289  185.025   9.6474  149.409   13.588  221.233   13.700   84.512   3.8981  103.070   3.2227 -18.55783 5.057800 
1 1 1   10   30   19 f   70.636   2.7186  102.894   7.8499  116.519   12.130   93.076   10.297   74.572   3.9438   66.701   3.7429 7.870392 5.437157 
1 1 1   10   30   20 o   59.713   3.4060   79.213   7.8581   61.734   12.698   90.063   10.004   53.805   5.7219   65.621   3.6963 -11.81589 6.811953 
1 1 1   10   30   21 o   30.731   4.8511   21.964   6.0451   15.751   9.6006   26.046   7.7814   26.489   8.0643   34.974   5.3945 -8.485050 9.702212 
1 1 1   10   30   22 o   72.931   3.2248  108.730   9.5390   91.019   12.246  136.061   15.212   65.640   4.5232   80.222   4.5976 -14.58257 6.449608 
1 1 1   10   30   23 o   25.114   7.9293   0.5478   13.389  -0.4301   14.867   4.7452   30.800   20.758   9.0931   29.469   12.993 -8.710529 15.85868 
1 1 1   10   30   24 o   34.783   6.0666   30.663   9.1702   15.855   15.402   38.796   11.414   27.456   10.199   42.111   6.5717 -14.65504 12.13327 
1 1 1   10   30   25 o   40.052   5.0302   36.590   7.9343   39.091   10.432   33.159   12.220   42.415   5.9636   37.689   8.1023 4.725719 10.06034 
1 1 1   10   30   26 o   31.860   5.8337   24.784   7.9639   30.821   10.576   16.876   12.103   36.634   7.2561   27.086   9.1367 9.548273 11.66746 
1 1 1   10   30   27 o   52.293   4.2187   57.673   8.9002   44.637   11.451   77.566   14.145   45.008   6.1686   59.577   5.7566 -14.56988 8.437441 
1 1 1   10   30   28 o   50.711   4.6095   56.256   9.5495   48.735   12.540   66.638   14.734   46.762   6.5020   54.660   6.5355 -7.897762 9.218920 
1 1 1   10   30   29 o   40.482   5.9487   39.428   9.4229   39.369   12.095   39.519   15.030   41.081   7.4110   39.882   9.3073 1.198711 11.89738 
1 1 1   10   30   30 o   30.585   7.9303   22.188   10.451   21.912   11.152   24.176   29.963   29.744   8.6021   31.427   13.325 -1.683058 15.86058 
1 1 1   10   30   31 o   24.219   6.7744   12.104   10.810   19.192   11.573 -36.4422   30.286   27.677   8.9170   20.760   10.201 6.916536 13.54874 
1 1 1   10   30   32 o   21.322   7.0316  -1.4266   11.638  -0.5567   12.669  -6.1258   29.446   18.382   8.2053   24.262   11.421 -5.879795 14.06324 
1 1 1   10   30   33 o   28.197   7.9520   4.4855   19.059   48.934   24.797 -59.6619   29.790   38.379   13.077   18.016   9.0510 20.36360 15.90392 
1 1 1   10   30   34 o   26.906   8.4931   11.643   19.251  -2.6663   25.376   31.041   29.547   22.892   10.721   30.921   13.175 -8.028788 16.98615 
1 1 1   10   31    0 o   58.836   2.8229   72.729   9.5852   72.729   9.5852   72.729   9.5852   58.836   3.9921   58.836   3.9921 0.000000 0.000000 
1 1 1   10   31    1 o   62.467   2.6979   81.694   6.9103   88.922   9.5876   73.880   9.9687   65.398   3.5545   59.537   4.0596 5.861172 5.395848 
1 1 1   10   31    2 o  150.063   2.2730  465.806   13.927  455.635   18.348  479.632   21.393  148.203   3.0017  151.924   3.4141 -3.721069 4.546021 
1 1 1   10   31    3 o   44.377   3.5820   40.963   6.2976   42.601   10.566   40.060   7.8427   44.959   5.6983   43.795   4.3418 1.163132 7.163917 
1 1 1   10   31    4 o   32.633   3.9160   22.727   5.1351   23.057   7.6467   22.456   6.9304   32.569   5.9101   32.696   5.1392 -0.1262093 7.832024 
1 1 1   10   31    5 o  148.354   2.1382  456.494   13.051  450.972   17.800  462.915   19.193  147.416   2.9276  149.293   3.1170 -1.876923 4.276309 
1 1 1   10   31    6 o   54.568   3.0105   62.534   6.6855   60.466   10.230   64.076   8.8328   53.711   4.6177   55.425   3.8639 -1.713856 6.021024 
1 1 1   10   31    7 o   78.562   2.7357  121.657   8.2098  111.086   9.7248  147.880   15.317   73.093   3.2258   84.032   4.4193 -10.93900 5.471407 
1 1 1   10   31    8 o   16.810   5.2675  -2.6919   7.2556  -4.8609   10.861  -0.9437   9.7506   16.561   7.4778   17.059   7.4208 -0.4978828 10.53497 
1 1 1   10   31    9 o   58.485   3.8899   72.680   9.3155   76.629   12.675   68.042   13.738   60.323   5.0943   56.648   5.8799 3.674835 7.779752 
1 1 1   10   31   10 o   22.181   5.9051   8.4048   7.3476   8.2330   10.620   8.5626   10.176   22.206   8.4228   22.155   8.2786 0.5051422E-01 11.81011 
1 1 1   10   31   11 o   57.836   3.8575   71.603   9.0738   81.804   12.538   60.383   13.149   62.360   4.8746   53.313   5.9800 9.047199 7.715050 
1 1 1   10   31   12 o   35.437   5.5271   27.603   8.1674   17.515   11.181   39.142   11.959   28.140   8.7269   42.733   6.7851 -14.59264 11.05425 
1 1 1   10   31   13 f   52.921   4.2411   58.998   9.0915   45.126   12.279   75.832   13.527   45.964   6.4769   59.879   5.4771 -13.91525 8.482269 
1 1 1   10   31   14 o   35.024   7.9177   24.619   10.512   22.703   11.523   34.119   25.661   31.644   8.6030   38.405   13.295 -6.760777 15.83550 
1 1 1   10   31   15 o   87.429   3.4195  161.168   12.291  145.242   17.237  177.642   17.531   82.952   5.0381   91.905   4.6248 -8.953316 6.838933 
1 1 1   10   31   16 o   23.039   6.1810   8.7703   8.5005  -0.1406   13.899   14.094   10.744   20.423   8.8720   25.655   8.6085 -5.232100 12.36198 
1 1 1   10   31   17 o   54.163   4.4431   62.871   9.9173   60.508   13.695   65.477   14.381   53.105   6.2525   55.221   6.3142 -2.115902 8.886103 
1 1 1   10   31   18 o   73.183   2.9514  114.461   8.5483  104.946   13.893  120.258   10.844   70.486   4.7789   75.881   3.4649 -5.395256 5.902855 
1 1 1   10   31   19 o   56.735   3.0951   70.713   6.9243   53.291   10.523   84.016   9.1953   50.092   5.0936   63.379   3.5177 -13.28645 6.190209 
1 1 1   10   31   20 o   54.530   3.2070   64.398   6.9850   55.028   10.824   71.085   9.1439   50.852   5.1608   58.208   3.8087 -7.356174 6.414054 
1 1 1   10   31   21 o   65.124   3.0399   91.552   7.9681   74.122   11.785  106.229   10.815   59.085   4.8360   71.163   3.6846 -12.07827 6.079748 
1 1 1   10   31   22 o   68.383   3.3545  105.854   8.8193   74.759   13.793  127.357   11.470   58.880   5.6799   77.886   3.5707 -19.00597 6.708997 
1 1 1   10   31   23 o   61.436   3.5252   78.813   8.7821   61.598   11.550  102.402   13.521   53.562   5.2285   69.309   4.7298 -15.74733 7.050389 
1 1 1   10   31   24 o   28.089   7.0888   18.905   9.8593   22.610   10.550  -6.6483   27.707   30.954   8.1511   25.225   11.600 5.728598 14.17756 
1 1 1   10   31   25 o   20.641   6.0534   5.2963   8.0452   3.2344   14.536   6.2067   9.6595   21.371   9.1771   19.910   7.8966 1.461178 12.10685 
1 1 1   10   31   26 o   16.562   5.1176  -0.7561   6.7529   2.9961   9.4281  -4.7090   9.6769   18.021   7.5486   15.103   6.9122 2.918206 10.23520 
1 1 1   10   31   27 o   34.115   7.7176   28.747   9.7488   28.875   10.329   27.707   29.507   35.106   7.3683   33.124   13.563 1.982395 15.43514 
1 1 1   10   31   28 o   68.932   7.3024  135.021   13.631  144.439   15.075   92.794   31.920   82.000   4.4573   55.863   13.908 26.13667 14.60472 
1 1 1   10   31   29 o   26.363   8.3483   7.9673   11.022   6.5322   11.477   25.004   39.544   20.638   8.4555   32.088   14.397 -11.44952 16.69666 
1 1 1   10   31   30 o   30.847   9.0244   21.310   19.354   4.0895   25.764   43.616   29.323   25.243   11.447   36.451   13.955 -11.20810 18.04873 
1 1 1   10   31   31 o   22.248   7.5120 -12.7323   18.919 -15.0592   24.664  -9.4060   29.489   20.977   10.039   23.520   11.178 -2.542963 15.02406 
1 1 1   10   31   32 o   24.707   8.1911   0.4666   20.908   11.323   23.730 -37.2192   44.211   25.554   11.328   23.860   11.834 1.693600 16.38227 
1 1 1   10   31   33 o   37.198   9.8787   51.756   20.509   51.379   27.103   52.260   31.370   37.775   13.611   36.620   14.321 1.155167 19.75734 
1 1 1   10   32    0 o   18.756   5.9229   10.713   6.8860   10.713   6.8860   10.713   6.8860   18.756   8.3763   18.756   8.3763 0.000000 0.000000 
1 1 1   10   32    1 o   44.347   3.1604   41.286   5.7714   43.375   8.0979   39.130   8.2277   45.513   4.3139   43.181   4.6198 2.332779 6.320778 
1 1 1   10   32    2 o   31.522   3.9532   21.255   5.0133   24.220   7.3277   18.646   6.8739   33.887   5.2429   29.157   5.9181 4.729706 7.906450 
1 1 1   10   32    3 o  118.366   3.5400  293.984   17.043  289.192   22.250  300.787   26.510  117.393   4.5954  119.339   5.3859 -1.945786 7.079991 
1 1 1   10   32    4 o   76.681   2.3210  122.431   7.3346  124.855   10.236  119.873   10.515   77.477   3.2034   75.884   3.3595 1.593712 4.641988 
1 1 1   10   32    5 o  101.668   2.4416  214.117   10.189  186.731   13.903  245.896   14.976   94.651   3.5613  108.685   3.3410 -14.03384 4.883112 
1 1 1   10   32    6 o   74.212   4.4087  114.017   12.195  125.268   23.222  109.733   14.329   76.186   7.3904   72.238   4.8094 3.948738 8.817478 
1 1 1   10   32    7 o  121.854   2.9487  311.286   14.790  299.981   21.343  321.730   20.514  119.655   4.3247  124.054   4.0094 -4.399132 5.897314 
1 1 1   10   32    8 o   38.065   6.3931   42.512   10.426   52.796   11.616  -0.1022   23.645   49.923   5.6415   26.208   11.474 23.71545 12.78617 
1 1 1   10   32    9 o   33.821   5.6068   25.754   7.6807   25.960   11.078   25.564   10.658   33.924   8.0404   33.719   7.8163 0.2058411 11.21352 
1 1 1   10   32   10 o   52.924   4.0898   59.310   8.8865   51.947   12.286   67.390   12.870   49.422   6.0271   56.427   5.5298 -7.004631 8.179528 
1 1 1   10   32   11 o   35.490   5.4562   28.052   8.0119   38.141   11.514   18.583   11.155   42.178   6.6189   28.802   8.6759 13.37574 10.91238 
1 1 1   10   32   12 o  127.662   3.0233  346.949   15.504  366.656   20.142  318.300   24.286  132.461   3.6868  122.863   4.7925 9.598869 6.046576 
1 1 1   10   32   13 o   59.338   3.8398   74.712   9.3897   72.255   12.962   77.425   13.620   58.326   5.3883   60.350   5.4719 -2.023285 7.679615 
1 1 1   10   32   14 o   32.890   7.9707   21.009   10.261   19.242   11.139   30.913   26.368   29.113   8.6469   36.667   13.393 -7.553982 15.94147 
1 1 1   10   32   15 o   57.596   4.3824   71.037   10.384   73.351   15.330   69.075   14.116   58.400   6.3644   56.793   6.0263 1.606987 8.764761 
1 1 1   10   32   16 o   44.742   4.9137   43.892   8.8296   38.478   12.166   49.916   12.834   41.414   7.3940   48.069   6.4735 -6.655071 9.827384 
1 1 1   10   32   17 o   25.650   6.2200   14.142   7.9377   14.432   11.106   13.839   11.349   25.803   8.7520   25.498   8.8406 0.3043118 12.44000 
1 1 1   10   32   18 f  121.956   4.1895  325.132   19.206  333.663   23.088  305.966   34.607  125.687   4.4538  118.225   7.0973 7.461685 8.379018 
1 1 1   10   32   19 o   55.071   7.5540   97.634   14.036  115.202   15.818   32.568   30.441   73.426   5.2231   36.716   14.177 36.70955 15.10808 
1 1 1   10   32   20 o   49.812   4.3395   62.093   7.2248   37.364   12.642   74.086   8.8041   40.239   7.8997   59.385   3.5945 -19.14622 8.679059 
1 1 1   10   32   21 o   24.861   4.6866   12.604   4.6605   19.192   8.4017   9.6751   5.6013   28.883   7.1023   20.840   6.1166 8.043303 9.373113 
1 1 1   10   32   22 o   20.558   4.9131   8.8687   5.4058   1.4443   8.8972   13.213   6.8062   17.037   7.2441   24.078   6.6390 -7.040985 9.826159 
1 1 1   10   32   23 o   45.691   3.5081   44.183   6.4992   48.866   10.362   41.146   8.3445   47.526   5.2864   43.856   4.6132 3.669987 7.016253 
1 1 1   10   32   24 f   20.887   6.7295   0.1889   10.238   3.0638   11.057 -17.1081   27.120   19.139   8.1036   22.635   10.746 -3.495626 13.45905 
1 1 1   10   32   25 o   31.251   6.8517   29.031   10.881   35.309   11.312 -48.6419   39.792   38.959   7.3085   23.542   11.592 15.41775 13.70337 
1 1 1   10   32   26 o   31.398   8.1699   20.618   17.518   46.013   22.348 -19.8603   28.214   40.335   12.309   22.461   10.746 17.87378 16.33976 
1 1 1   10   32   27 o   23.973   7.7775  -1.1280   17.216   0.1740   22.154  -3.1132   27.356   23.389   10.609   24.558   11.376 -1.169439 15.55509 
1 1 1   10   32   28 o   28.584   8.9590   4.7728   18.968 -10.4437   22.290   44.722   36.117   21.090   9.9308   36.079   14.914 -14.98974 17.91801 
1 1 1   10   32   29 o   20.612   7.0935 -33.0966   19.708 -62.0760   28.062  -4.8877   27.686   17.351   8.7262   23.873   11.186 -6.521873 14.18709 
1 1 1   10   32   30 o   27.934   8.6736   17.374   18.762   13.561   23.886   23.516   30.313   26.315   11.527   29.553   12.964 -3.238268 17.34726 
1 1 1   10   32   31 o   31.020   9.4976   30.332   24.894  -6.5688   43.789   47.953   30.260   26.369   12.804   35.671   14.031 -9.302423 18.99512 
1 1 1   10   33    0 o  182.167   2.5974  689.147   27.574  689.147   27.574  689.147   27.574  182.167   3.6733  182.167   3.6733 0.000000 0.000000 
1 1 1   10   33    1 o   73.911   2.4028  113.775   7.3244  113.465   10.297  114.092   10.421   73.813   3.3823   74.010   3.4139 -0.1968689 4.805650 
1 1 1   10   33    2 o   89.099   2.5990  166.700   9.4746  155.010   14.001  176.575   12.869   86.121   3.9416   92.076   3.3886 -5.955116 5.197998 
1 1 1   10   33    3 o   38.557   3.5348   32.433   5.2728   23.000   7.4930   41.687   7.4213   32.471   5.8083   44.644   4.0304 -12.17381 7.069642 
1 1 1   10   33    4 o   64.317   2.4435   86.518   6.4545   90.495   8.8658   82.033   9.4149   65.932   3.2603   62.701   3.6406 3.230724 4.887080 
1 1 1   10   33    5 o   87.334   3.1878  160.801   11.428  152.792   16.732  167.804   15.646   85.196   4.7616   89.472   4.2397 -4.275848 6.375607 
1 1 1   10   33    6 o   93.334   3.8966  170.899   12.874  213.184   27.313  158.822   14.597   99.594   6.6494   87.074   4.0645 12.51934 7.793222 
1 1 1   10   33    7 o   17.834   5.3075  -0.0211   7.1742 -10.5685   11.554   6.5967   9.1522   15.374   7.2110   20.293   7.7896 -4.919050 10.61494 
1 1 1   10   33    8 o   76.441   3.2493  123.602   10.200  132.891   14.189  113.668   14.673   79.517   4.3264   73.364   4.8492 6.152267 6.498606 
1 1 1   10   33    9 o   30.931   5.7810   21.288   7.7402   30.244   11.425   13.692   10.523   36.545   7.8166   25.316   8.5193 11.22909 11.56195 
1 1 1   10   33   10 o  122.150   2.8026  311.185   14.042  299.045   18.754  326.675   21.184  119.528   3.8042  124.771   4.1165 -5.242554 5.605128 
1 1 1   10   33   11 o   25.267   5.9770   12.723   7.6675   19.969   11.203   6.3376   10.517   29.589   8.6403   20.946   8.2611 8.643764 11.95404 
1 1 1   10   33   12 o   85.902   3.2206  157.318   11.274  171.505   15.308  140.499   16.667   90.359   4.1074   81.444   4.9616 8.915237 6.441145 
1 1 1   10   33   13 o   58.387   3.8269   72.566   9.1954   70.914   12.540   74.488   13.525   57.719   5.2674   59.054   5.5528 -1.334454 7.653706 
1 1 1   10   33   14 o   17.235   6.0981 -20.1870   8.9605 -20.7337   9.5558 -16.2052   25.791   11.262   5.5705   23.208   10.850 -11.94673 12.19626 
1 1 1   10   33   15 o   19.028   5.7125   0.0577   7.9218   7.1147   12.165  -5.1375   10.438   22.149   8.8375   15.906   7.2408 6.242565 11.42500 
1 1 1   10   33   16 o   47.628   4.5245   48.347   8.7800   39.404   11.625   60.223   13.396   42.507   6.6308   52.748   6.1575 -10.24105 9.048912 
1 1 1   10   33   17 o   77.996   3.5063  124.199   11.003  105.026   13.823  157.349   18.176   70.237   4.7717   85.756   5.1388 -15.51900 7.012543 
1 1 1   10   33   18 o   57.416   4.0334   69.960   9.4262   56.281   12.501   87.984   14.350   50.912   5.9534   63.921   5.4432 -13.00827 8.066730 
1 1 1   10   33   19 o   81.120   3.3909  141.633   11.227  150.437   15.158  130.937   16.708   84.173   4.3663   78.067   5.1892 6.106071 6.781760 
1 1 1   10   33   20 o   46.922   4.6726   48.291   8.9926   45.347   11.979   52.092   13.611   45.394   6.3983   48.450   6.8114 -3.056389 9.345292 
1 1 1   10   33   21 o   30.031   6.4407   21.946   8.6636   22.613   12.589   21.346   11.941   30.405   9.2294   29.656   8.9860 0.7490559 12.88139 
1 1 1   10   33   22 o   21.660   7.0246  -3.6090   9.5752  -6.0136   10.301   11.665   25.963   15.218   7.0252   28.103   12.167 -12.88513 14.04926 
1 1 1   10   33   23 o   32.902   8.7350   26.503   12.052   0.0000   0.0000   26.503   12.052  ?   ?    32.902   8.7350      ?      ? 
1 1 1   10   33   24 o   39.074   7.5764   37.391   11.223   47.015   23.175   34.442   12.828   40.531   12.563   37.617   8.4719 2.913471 15.15271 
1 1 1   10   33   25 o   37.427   9.3692   43.275   18.310   47.160   23.736   37.565   28.773   39.768   12.766   35.086   13.717 4.681545 18.73831 
1 1 1   10   33   26 o   45.958   9.2153   61.325   18.229   46.840   23.404   83.668   29.066   39.353   12.681   52.562   13.375 -13.20979 18.43067 
1 1 1   10   33   27 o   31.013   8.5771   13.046   18.064 -16.0665   23.134   58.532   28.917   20.360   9.7382   41.666   14.122 -21.30596 17.15414 
1 1 1   10   33   28 o   28.441   8.9900  -3.3255   18.983 -24.3620   21.810   62.399   38.551   18.281   8.9129   38.600   15.615 -20.31874 17.97995 
1 1 1   10   33   29 o   31.696   9.0865   30.425   20.273   51.006   27.698   6.6793   29.752   37.640   13.729   25.752   11.906 11.88713 18.17294 
1 1 1   10   34    0 o  121.122   2.1046  304.470   14.849  304.470   14.849  304.470   14.849  121.122   2.9764  121.122   2.9764 0.000000 0.000000 
1 1 1   10   34    1 o   36.756   4.1134   29.712   5.9087   26.774   9.2042   31.771   7.7062   34.724   6.6691   38.787   4.8171 -4.062469 8.226858 
1 1 1   10   34    2 o   70.689   2.4557  103.732   7.1389   95.071   9.6847  114.039   10.564   67.475   3.4800   73.904   3.4659 -6.429100 4.911480 
1 1 1   10   34    3 o   44.035   2.8488   40.669   5.1720   40.798   7.2209   40.534   7.4114   44.118   3.9684   43.953   4.0883 0.1647263 5.697579 
1 1 1   10   34    4 o   89.510   3.1262  168.826   11.478  166.481   17.077  170.760   15.503   88.842   4.6604   90.178   4.1682 -1.335876 6.252459 
1 1 1   10   34    5 o   29.763   4.9264   22.286   5.6151   12.316   11.188   25.643   6.4919   24.640   8.7590   34.887   4.5118 -10.24693 9.852700 
1 1 1   10   34    6 o   29.877   6.2661   21.831   7.2843   4.7320   21.616   24.021   7.7368   26.189   11.217   33.564   5.5889 -7.374245 12.53226 
1 1 1   10   34    7 o   39.673   4.9540   34.650   7.9363   36.816   11.443   32.643   11.016   41.216   6.7314   38.130   7.2703 3.086052 9.908029 
1 1 1   10   34    8 o   58.366   3.7425   72.382   8.9949   66.956   12.447   78.315   13.014   56.049   5.3842   60.683   5.1996 -4.634315 7.485002 
1 1 1   10   34    9 o   68.028   3.4502   98.663   9.6226  106.477   13.300   90.081   13.939   70.995   4.5423   65.062   5.1944 5.932526 6.900305 
1 1 1   10   34   10 o   30.256   6.1718   22.230   8.5533   11.739   14.276   28.105   10.683   25.376   9.7317   35.135   7.5934 -9.759024 12.34368 
1 1 1   10   34   11 o   82.001   3.8433  144.543   12.866  121.760   18.213  167.236   18.177   75.275   5.8663   88.727   4.9671 -13.45205 7.686685 
1 1 1   10   34   12 o   50.516   5.3132   60.328   10.053   40.761   15.218   75.482   13.392   41.653   9.1116   59.379   5.4682 -17.72646 10.62648 
1 1 1   10   34   13 o   35.197   5.4284   29.155   7.9082   38.719   10.848   18.306   11.553   42.224   6.2289   28.170   8.8923 14.05469 10.85688 
1 1 1   10   34   14 o   29.929   7.8320   17.232   9.7070   16.117   10.407   24.693   26.923   26.549   8.4458   33.310   13.192 -6.761009 15.66409 
1 1 1   10   34   15 o   24.486   7.0583   6.8992   9.3613   17.663   20.682   4.1260   10.498   29.449   11.594   19.522   8.0529 9.927242 14.11668 
1 1 1   10   34   16 o   18.873   5.7146   1.1963   8.1312  -8.9669   14.190   6.1647   9.9216   17.580   8.1613   20.165   8.0014 -2.584629 11.42926 
1 1 1   10   34   17 o   19.231   5.8841   0.0848   8.1959   5.9824   14.004  -2.9874   10.108   22.269   9.2529   16.194   7.2715 6.075623 11.76821 
1 1 1   10   34   18 o   21.299   5.8197   4.9500   8.7903 -17.5989   15.312   16.035   10.736   16.345   7.8454   26.252   8.5980 -9.907135 11.63940 
1 1 1   10   34   19 o   43.734   5.4384   44.666   9.4440   35.172   13.274   54.399   13.440   38.099   8.6452   49.368   6.6004 -11.26892 10.87684 
1 1 1   10   34   20 o   40.882   7.9551   41.847   12.225   49.317   26.241   39.776   13.815   41.114   13.441   40.650   8.5130 0.4641838 15.91023 
1 1 1   10   34   21 f   26.726   7.4904   13.387   10.049   19.101   24.044   12.177   11.061   29.720   12.215   23.731   8.6732 5.989140 14.98079 
1 1 1   10   34   22 o   20.122   6.6895  -9.6948   10.162   7.7257   24.418 -13.3443   11.176   26.290   11.581   13.953   6.6988 12.33666 13.37903 
1 1 1   10   34   23 o   33.298   8.9800   28.051   12.615   0.0000   0.0000   28.051   12.615  ?   ?    33.298   8.9800      ?      ? 
1 1 1   10   34   24 o   26.953   7.6158   16.185   11.417   15.490   25.033   16.368   12.828   27.898   12.013   26.008   9.3649 1.890734 15.23163 
1 1 1   10   34   25 o   28.079   6.9590   21.529   11.345  -8.6272   25.589   28.906   12.656   22.598   10.641   33.561   8.9710 -10.96222 13.91799 
1 1 1   10   34   26 o   27.245   8.3854   15.117   16.963   11.531   21.105   21.660   28.511   25.311   10.964   29.179   12.691 -3.867779 16.77089 
1 1 1   10   34   27 o   20.161   6.8783 -20.2853   17.732  -4.9145   22.435 -45.8690   28.944   21.573   10.096   18.749   9.3444 2.823465 13.75668 
1 1 1   10   34   28 o   24.547   7.9622   0.0522   17.800 -14.8006   22.517   24.794   29.063   19.786   9.5016   29.307   12.779 -9.521000 15.92431 
1 1 1   10   35    0 o   22.905   5.5292   14.346   6.6297   14.346   6.6297   14.346   6.6297   22.905   7.8195   22.905   7.8195 0.000000 0.000000 
1 1 1   10   35    1 o   13.668   4.1401  -0.1949   4.2096   1.7664   6.0644  -2.0189   5.8482   14.840   6.1208   12.496   5.5765 2.343936 8.280203 
1 1 1   10   35    2 o   90.603   2.7484  177.293   9.3827  185.421   11.343  159.686   16.696   94.340   2.9153   86.866   4.6601 7.473938 5.496821 
1 1 1   10   35    3 o   58.351   3.6346   71.923   8.7139   79.373   13.017   65.873   11.730   61.059   5.1689   55.643   5.1111 5.415173 7.269167 
1 1 1   10   35    4 o   43.929   3.7830   40.452   6.2010   42.954   11.689   39.472   7.3151   44.549   6.3618   43.308   4.0953 1.241257 7.565968 
1 1 1   10   35    5 o   35.898   4.9220   35.552   6.1809   15.406   11.871   43.044   7.2396   26.529   9.0482   45.266   3.8777 -18.73715 9.844092 
1 1 1   10   35    6 o   47.456   7.9578   55.615   15.557   69.887   22.364   42.235   21.654   54.005   10.418   40.906   12.032 13.09872 15.91550 
1 1 1   10   35    7 o   40.971   4.7828   37.257   7.8493   41.906   11.129   32.655   11.073   44.004   6.1319   37.938   7.3416 6.065289 9.565541 
1 1 1   10   35    8 o   86.216   4.5387  157.623   16.139   0.0000   0.0000  157.623   16.139  ?   ?    86.216   4.5387      ?      ? 
1 1 1   10   35    9 o   17.103   5.2621  -0.2672   6.9402  -0.7744   9.7537   0.2528   9.8773   16.839   7.3711   17.368   7.5118 -0.5289803 10.52422 
1 1 1   10   35   10 o   27.913   5.1649   17.319   7.2693   31.671   10.010   1.3024   10.574   37.503   6.7182   18.324   7.8466 19.17893 10.32975 
1 1 1   10   35   11 o   19.856   5.5153   3.7426   7.0244  -3.1162   9.3949   12.438   10.578   15.579   7.0017   24.134   8.5236 -8.555238 11.03068 
1 1 1   10   35   12 o   29.988   5.6245   21.489   7.1964   25.537   9.6062   16.312   10.864   33.340   7.1968   26.637   8.6457 6.702991 11.24906 
1 1 1   10   35   13 o   74.919   3.1497  115.551   9.4725  103.804   11.872  136.132   15.714   70.017   4.1110   79.821   4.7732 -9.803535 6.299469 
1 1 1   10   35   14 o   32.938   6.6279   28.751   8.4012   31.129   8.9530   11.227   24.307   37.833   5.7376   28.043   11.950 9.789818 13.25579 
1 1 1   10   35   15 o   11.787   4.0711 -15.7847   6.2444 -19.9346   8.1491  -9.8824   9.7186   9.9411   4.9551   13.633   6.4609 -3.691997 8.142256 
1 1 1   10   35   16 o   26.735   7.2748   15.269   10.295   12.536   21.828   16.052   11.676   27.247   11.453   26.222   8.9731 1.025551 14.54956 
1 1 1   10   35   17 o   38.248   6.8833   41.297   11.027   21.568   22.497   47.535   12.651   30.393   12.052   46.104   6.6530 -15.71080 13.76650 
1 1 1   10   35   18 o   25.633   7.2017   12.838   9.7134   9.9574   23.302   13.443   10.686   26.847   11.575   24.419   8.5722 2.428146 14.40334 
1 1 1   10   35   19 o   19.125   6.3144  -6.4453   9.4985   0.0146   21.488  -8.0140   10.589   23.425   10.553   14.824   6.9371 8.601237 12.62887 
1 1 1   10   35   20 o   22.448   7.0700   1.4659   9.6223   14.249   24.690  -0.8234   10.448   27.906   11.971   16.991   7.5254 10.91547 14.14000 
1 1 1   10   35   21 o   29.275   7.3279   3.1287   10.359   56.189   24.418  -8.5154   11.439   43.303   12.788   15.247   7.1590 28.05552 14.65580 
1 1 1   10   35   22 o   21.962   6.7564   5.7726   10.243  -7.4820   24.079   8.7012   11.318   22.368   10.465   21.555   8.5482 0.8129635 13.51283 
1 1 1   10   35   23 o   44.455   7.8447   49.056   12.169   68.228   27.294   44.299   13.595   46.361   13.472   42.549   8.0417 3.811626 15.68943 
1 1 1   10   35   24 o   25.236   7.2703   14.464   11.359   5.3516   24.301   17.012   12.849   24.530   11.120   25.942   9.3682 -1.412785 14.54053 
1 1 1   10   35   25 o   24.143   7.2955   10.828   11.132   11.724   24.945   10.605   12.439   25.865   11.532   22.420   8.9394 3.444624 14.59103 
1 1 1   10   35   26 o   26.170   6.9757   18.122   11.741 -11.5416   25.490   26.110   13.228   21.422   10.239   30.917   9.4761 -9.495543 13.95143 
1 1 1   10   36    0 o   43.576   3.8725   41.777   9.4211   41.777   9.4211   41.777   9.4211   43.576   5.4766   43.576   5.4766 0.000000 0.000000 
1 1 1   10   36    1 o   28.739   3.9925   18.371   4.5627   17.272   6.3911   19.512   6.5161   27.804   5.7625   29.674   5.5276 -1.869831 7.985003 
1 1 1   10   36    2 o   35.155   4.7443   29.059   6.2279   23.614   10.786   31.782   7.6278   31.707   8.1903   38.603   4.7908 -6.896528 9.488546 
1 1 1   10   36    3 f   29.919   4.8101   17.752   5.3778   28.343   10.324   13.808   6.3001   35.127   7.3612   24.711   6.1936 10.41678 9.620157 
1 1 1   10   36    4 o   25.834   5.0936   13.952   5.0688   18.582   10.149   12.413   5.8507   28.205   8.2205   23.464   6.0170 4.740719 10.18727 
1 1 1   10   36    5 f   56.971   3.8384   69.245   8.9734   77.594   13.530   62.689   11.989   59.988   5.4687   53.955   5.3877 6.033661 7.676813 
1 1 1   10   36    6 o   24.637   7.2133   8.3065   11.696   7.5953   14.848   9.4693   18.985   23.408   9.6070   25.866   10.762 -2.457960 14.42655 
1 1 1   10   36    7 o   22.023   5.8740   9.1659   7.3377   6.0705   11.454   11.320   9.5561   20.983   8.5035   23.064   8.1058 -2.081480 11.74791 
1 1 1   10   36    8 o   19.427   5.4631   5.4807   6.5867   3.8350   9.3662   7.0909   9.2647   18.567   7.6264   20.287   7.8243 -1.720201 10.92623 
1 1 1   10   36    9 o   37.521   5.2105   35.675   7.6723   48.011   10.013   18.135   11.940   47.240   5.1393   27.801   9.0655 19.43908 10.42091 
1 1 1   10   36   10 o   26.067   6.4187   15.794   8.6874   6.6466   15.974   19.636   10.352   23.377   9.8104   28.758   8.2797 -5.380844 12.83733 
1 1 1   10   36   11 o   51.855   6.0094   64.468   11.526   59.213   19.975   67.091   14.113   48.555   10.294   55.154   6.2040 -6.598278 12.01886 
1 1 1   10   36   12 o   49.147   5.9599   55.002   10.747   62.340   20.000   52.023   12.743   49.893   10.066   48.401   6.3835 1.492409 11.91977 
1 1 1   10   36   13 o   86.934   4.3453  165.171   13.988  171.487   26.411  162.708   16.491   86.782   7.3789   87.087   4.5912 -0.3048553 8.690604 
1 1 1   10   36   14 o   24.369   10.966   0.4420   23.130   0.0000   0.0000   0.4420   23.130  ?   ?    24.369   10.966      ?      ? 
1 1 1   10   36   15 o   51.304   6.9048   71.421   11.997   51.916   23.775   78.083   13.896   42.902   12.604   59.706   5.6427 -16.80410 13.80960 
1 1 1   10   36   16 o   22.810   6.7667   7.6561   10.093  -1.7281   20.998   10.476   11.510   22.775   10.330   22.844   8.7436 -0.6943512E-01 13.53339 
1 1 1   10   36   17 o   41.332   7.3023   46.819   11.659   38.203   24.109   49.449   13.320   36.078   12.854   46.586   6.9325 -10.50830 14.60469 
1 1 1   10   36   18 o   28.589   6.9862   21.979   10.661   3.0715   22.836   27.248   12.055   24.251   10.906   32.927   8.7337 -8.675278 13.97236 
1 1 1   10   36   19 o   50.204   6.9720   57.928   12.613   81.603   25.320   50.114   14.547   54.231   11.666   46.177   7.6380 8.054234 13.94404 
1 1 1   10   36   20 o   54.547   6.9112   67.627   12.728   94.641   27.796   60.461   14.317   57.779   12.054   51.316   6.7643 6.462784 13.82232 
1 1 1   10   36   21 o   26.967   8.3249   13.224   17.962   22.478   24.208   1.8906   26.790   29.241   12.159   24.693   11.375 4.547363 16.64984 
1 1 1   10   36   22 o   28.909   9.4549   22.322   12.984   0.0000   0.0000   22.322   12.984  ?   ?    28.909   9.4549      ?      ? 
1 1 1   10   36   23 o   26.355   7.5888   8.3701   10.713   40.332   24.584   0.8774   11.903   34.573   12.878   18.138   8.0329 16.43522 15.17759 
1 1 1   10   36   24 o   34.120   8.1629   29.426   11.631   52.665   25.638   23.403   13.052   38.922   13.297   29.318   9.4723 9.604506 16.32576 
1 1 1   10   37    0 o   14.147   5.2143   6.3300   5.6166   6.3300   5.6166   6.3300   5.6166   14.147   7.3741   14.147   7.3741 0.000000 0.000000 
1 1 1   10   37    1 o   26.769   5.1547   17.221   5.9689   12.356   9.3796   20.532   7.7379   23.562   8.0427   29.977   6.4498 -6.414190 10.30945 
1 1 1   10   37    2 o   53.408   3.7871   62.080   8.2763   59.444   12.329   64.241   11.166   52.185   5.7283   54.631   4.9555 -2.445995 7.574290 
1 1 1   10   37    3 f   35.595   4.6140   29.633   5.7978   26.148   11.043   30.959   6.8122   33.086   8.1467   38.105   4.3346 -5.018833 9.228022 
1 1 1   10   37    4 o   42.188   4.2436   40.475   6.1404   37.499   12.003   41.530   7.1464   40.120   7.5302   44.256   3.9151 -4.135880 8.487181 
1 1 1   10   37    5 o   68.982   4.0026  104.834   10.750  101.175   18.272  106.771   13.294   67.373   6.5755   70.592   4.5658 -3.218994 8.005219 
1 1 1   10   37    6 o   38.805   7.0244   34.713   10.829   0.0000   0.0000   34.713   10.829  ?   ?    38.805   7.0244      ?      ? 
1 1 1   10   37    7 o   71.196   4.0633  107.972   11.284  121.142   19.837  101.672   13.720   73.701   6.5259   68.692   4.8427 5.009460 8.126511 
1 1 1   10   37    8 o   23.100   6.2895   10.413   8.1496   9.4700   14.315   10.866   9.9127   23.565   9.5217   22.635   8.2200 0.9302292 12.57903 
1 1 1   10   37    9 o   22.185   6.3065   8.0817   8.9184   1.1053   15.353   11.635   10.957   20.949   9.2069   23.421   8.6211 -2.472914 12.61309 
1 1 1   10   37   10 f   29.776   6.6451   22.363   9.0090   17.325   16.546   24.486   10.741   27.655   10.507   31.898   8.1378 -4.242792 13.29019 
1 1 1   10   37   11 o   29.410   6.9947   21.350   9.7185   19.865   17.447   22.018   11.702   28.870   10.830   29.949   8.8552 -1.078926 13.98930 
1 1 1   10   37   12 o   18.404   5.5773  -0.8920   8.5981 -25.3560   16.168   8.7542   10.153   15.436   7.5575   21.372   8.2042 -5.935552 11.15460 
1 1 1   10   37   13 o   59.634   5.2509   78.278   11.858   92.057   22.140   72.735   14.042   62.011   8.6564   57.256   5.9461 4.755703 10.50189 
1 1 1   10   37   14 o   24.002   10.983  -0.9016   24.414   0.0000   0.0000  -0.9016   24.414  ?   ?    24.002   10.983      ?      ? 
1 1 1   10   37   15 o   20.737   6.0315   4.1120   9.5705 -23.6970   18.810   13.826   11.117   17.120   8.3316   24.354   8.7234 -7.233879 12.06291 
1 1 1   10   37   16 o   35.289   7.4380   26.170   11.378   58.699   21.702   13.841   13.361   45.815   11.502   24.762   9.4339 21.05365 14.87598 
1 1 1   10   37   17 o   30.610   7.6493   19.180   10.448   42.475   22.434   12.729   11.806   37.462   12.437   23.758   8.9093 13.70389 15.29868 
1 1 1   10   37   18 o   27.123   7.4596   10.015   10.020   39.245   23.000   3.1688   11.131   35.475   12.564   18.772   8.0450 16.70233 14.91929 
1 1 1   10   37   19 o   26.599   7.1619   18.455   11.191   4.3709   23.012   22.817   12.807   23.903   10.830   29.296   9.3745 -5.393114 14.32389 
1 1 1   10   37   20 o   21.871   6.8806   5.0348   10.570   4.8480   23.738   5.0809   11.805   24.019   10.928   19.722   8.3631 4.297689 13.76115 
1 1 1   10   37   21 o   26.231   8.2088   11.010   18.443   27.000   25.361  -6.9405   26.870   29.852   12.432   22.610   10.723 7.241793 16.41757 
1 1 1   10   38    1 o   41.800   6.6665   56.780   12.193   70.415   13.784   7.7389   26.140   56.530   5.9119   27.070   11.951 29.46036 13.33296 
1 1 1   10   38    2 o   26.527   7.3573   14.902   9.9348   16.356   10.694   5.7407   26.844   26.258   8.5805   26.797   11.954 -0.5386715 14.71469 
1 1 1   10   38    3 o   15.200   6.9687  -4.9068   9.8955  -4.9068   9.8955   0.0000   0.0000   15.200   6.9687  ?   ?       ?      ? 
1 1 1   10   38    4 o   22.696   7.2587   1.0326   10.354  -0.1637   11.170   8.3365   27.599   17.857   7.8505   27.536   12.212 -9.679199 14.51748 
1 1 1   10   38    5 o   30.356   8.2041   20.864   11.840   19.953   12.922   25.635   29.567   28.484   9.4379   32.228   13.422 -3.743576 16.40819 
1 1 1   10   38    6 o   33.417   11.482   30.065   19.121   0.0000   0.0000   30.065   19.121  ?   ?    33.417   11.482      ?      ? 
1 1 1   10   38    7 o   32.025   7.3135   27.720   11.995   36.177   15.009   12.767   19.958   37.657   9.6264   26.392   11.013 11.26451 14.62691 
1 1 1   10   38    8 o   15.907   5.2244  -5.6224   7.6523  -8.2088   13.913  -4.5006   9.1627   17.192   8.0142   14.622   6.7045 2.569500 10.44882 
1 1 1   10   38    9 o   24.505   6.2402   6.5998   8.8380   28.968   15.134  -4.9762   10.887   33.145   10.132   15.865   7.2868 17.27968 12.48043 
1 1 1   10   38   10 o   33.339   6.9378   27.519   9.5706   34.239   17.449   24.628   11.446   35.315   10.894   31.362   8.5939 3.953230 13.87550 
1 1 1   10   38   11 o   63.708   5.0283   91.213   12.514  102.188   21.843   85.852   15.267   65.475   8.0884   61.940   5.9762 3.534855 10.05665 
1 1 1   10   38   12 o   48.158   6.5667   65.126   11.403   41.917   20.529   75.481   13.713   38.055   11.829   58.260   5.7067 -20.20501 13.13346 
1 1 1   10   38   13 o   57.306   5.5733   76.692   11.925   81.236   22.106   74.826   14.163   56.839   9.4295   57.772   5.9438 -0.9324760 11.14651 
1 1 1   10   38   14 o   23.686   10.853   0.5044   23.950   0.0000   0.0000   0.5044   23.950  ?   ?    23.686   10.853      ?      ? 
1 1 1   10   38   15 o   20.120   6.4050  -0.1043   9.4833   7.6641   19.538  -2.4984   10.847   23.814   10.428   16.426   7.4397 7.387499 12.80998 
1 1 1   10   38   16 o   27.290   7.5088   18.580   11.011   20.496   23.117   18.018   12.523   28.151   11.807   26.429   9.2797 1.722696 15.01758 
1 1 1   10   38   17 o   27.357   7.4442   18.629   10.556   23.374   22.349   17.267   11.976   28.819   11.802   25.895   9.0758 2.924747 14.88846 
1 1 1   10   38   18 o   19.207   6.3215  -2.7560   10.041  -1.0341   21.778  -3.2208   11.315   22.036   10.187   16.378   7.4876 5.657948 12.64305 
1 1 1   10   39   10 o   40.962   8.4708   58.012   17.311   67.993   19.942   27.500   34.868   50.804   9.8730   31.120   13.767 19.68356 16.94156 
1 1 1   10   39   11 o   41.889   11.194   50.521   19.710   50.521   19.710   0.0000   0.0000   41.889   11.194  ?   ?       ?      ? 
1 1 1   10   39   12 o   27.066   8.5511   12.158   15.884   8.0752   17.667   29.379   36.283   23.159   10.031   30.972   13.851 -7.813681 17.10216 
1 1 1   10   39   13 o   29.811   9.1489   17.138   17.134   7.0680   19.237   55.792   37.688   23.254   10.260   36.369   15.151 -13.11468 18.29777 
1 1 1   10   39   14 o   20.433   10.211 -51.6077   35.603   0.0000   0.0000 -51.6077   35.603  ?   ?    20.433   10.211      ?      ? 
1 1 1   10   39   15 o   23.942   8.0916  -5.5836   17.874 -12.1348   20.217   17.868   38.251   19.240   9.1749   28.643   13.331 -9.403574 16.18324 
1 1 1   11    0    1 o   14.569   5.5156   6.2495   6.4208   6.2495   6.4208   6.2495   6.4208   14.569   7.8002   14.569   7.8002 0.000000 0.000000 
1 1 1   11    0    2 o  385.510   2.9953  3066.83   67.335  3066.83   67.335  3066.83   67.335  385.510   4.2360  385.510   4.2360 0.000000 0.000000 
1 1 1   11    0    3 o  427.237   3.2305  3766.66   80.482  3766.66   80.482  3766.66   80.482  427.237   4.5686  427.237   4.5686 0.000000 0.000000 
1 1 1   11    0    4 o  225.271   2.5724  1047.53   33.781  1047.53   33.781  1047.53   33.781  225.271   3.6379  225.271   3.6379 0.000000 0.000000 
1 1 1   11    0    5 o  123.091   2.9141  313.571   20.869  313.571   20.869  313.571   20.869  123.091   4.1212  123.091   4.1212 0.000000 0.000000 
1 1 1   11    0    6 o  226.672   2.2355  1060.33   29.544  1060.33   29.544  1060.33   29.544  226.672   3.1615  226.672   3.1615 0.000000 0.000000 
1 1 1   11    0    7 o   64.044   2.5798   85.420   9.5656   85.420   9.5656   85.420   9.5656   64.044   3.6484   64.044   3.6484 0.000000 0.000000 
1 1 1   11    0    8 o  224.379   3.1405  1039.76   41.066  1039.76   41.066  1039.76   41.066  224.379   4.4413  224.379   4.4413 0.000000 0.000000 
1 1 1   11    0    9 o   19.116   7.6562   9.8549   13.169   9.8549   13.169   9.8549   13.169   19.116   10.828   19.116   10.828 0.000000 0.000000 
1 1 1   11    0   10 o  329.707   3.8520  2244.51   74.034  2244.51   74.034  2244.51   74.034  329.707   5.4476  329.707   5.4476 0.000000 0.000000 
1 1 1   11    0   11 o  141.259   3.1467  412.841   25.869  412.841   25.869  412.841   25.869  141.259   4.4501  141.259   4.4501 0.000000 0.000000 
1 1 1   11    0   12 o  367.051   3.3905  2780.78   72.562  2780.78   72.562  2780.78   72.562  367.051   4.7949  367.051   4.7949 0.000000 0.000000 
1 1 1   11    0   13 o  319.014   3.8471  2101.54   71.538  2101.54   71.538  2101.54   71.538  319.014   5.4406  319.014   5.4406 0.000000 0.000000 
1 1 1   11    0   14 o   56.391   3.3284   66.963   10.772   66.963   10.772   66.963   10.772   56.391   4.7071   56.391   4.7071 0.000000 0.000000 
1 1 1   11    0   15 f   18.754   6.8827   10.578   9.7540   10.578   9.7540   10.578   9.7540   18.754   9.7336   18.754   9.7336 0.000000 0.000000 
1 1 1   11    0   16 o  266.351   3.4895  1465.35   54.171  1465.35   54.171  1465.35   54.171  266.351   4.9349  266.351   4.9349 0.000000 0.000000 
1 1 1   11    0   17 o   36.669   5.6500   31.404   10.588   31.404   10.588   31.404   10.588   36.669   7.9903   36.669   7.9903 0.000000 0.000000 
1 1 1   11    0   18 o   51.946   3.8546   57.511   11.385   57.511   11.385   57.511   11.385   51.946   5.4513   51.946   5.4513 0.000000 0.000000 
1 1 1   11    0   19 o  264.688   2.5846  1446.23   39.886  1446.23   39.886  1446.23   39.886  264.688   3.6552  264.688   3.6552 0.000000 0.000000 
1 1 1   11    0   20 o  111.730   2.6718  258.457   17.367  258.457   17.367  258.457   17.367  111.730   3.7784  111.730   3.7784 0.000000 0.000000 
1 1 1   11    0   21 o  373.205   3.1311  2875.86   68.138  2875.86   68.138  2875.86   68.138  373.205   4.4281  373.205   4.4281 0.000000 0.000000 
1 1 1   11    0   22 o   43.432   7.8883   46.000   17.273   46.000   17.273   46.000   17.273   43.432   11.156   43.432   11.156 0.000000 0.000000 
1 1 1   11    0   23 f   89.731   4.8987  169.419   25.288  169.419   25.288  169.419   25.288   89.731   6.9278   89.731   6.9278 0.000000 0.000000 
1 1 1   11    0   24 o  298.102   2.8639  1835.27   49.777  1835.27   49.777  1835.27   49.777  298.102   4.0502  298.102   4.0502 0.000000 0.000000 
1 1 1   11    0   25 o  202.670   2.7751  848.859   32.778  848.859   32.778  848.859   32.778  202.670   3.9246  202.670   3.9246 0.000000 0.000000 
1 1 1   11    0   26 o  108.094   3.7512  243.143   23.521  243.143   23.521  243.143   23.521  108.094   5.3050  108.094   5.3050 0.000000 0.000000 
1 1 1   11    0   27 o   13.426   6.7803 -35.8762   23.951 -35.8762   23.951 -35.8762   23.951   13.426   9.5887   13.426   9.5887 0.000000 0.000000 
1 1 1   11    0   28 o  122.835   3.2997  313.028   23.564  313.028   23.564  313.028   23.564  122.835   4.6665  122.835   4.6665 0.000000 0.000000 
1 1 1   11    0   29 f   96.877   4.0458  196.074   22.679  196.074   22.679  196.074   22.679   96.877   5.7217   96.877   5.7217 0.000000 0.000000 
1 1 1   11    0   30 f  135.182   3.3998  379.059   26.730  379.059   26.730  379.059   26.730  135.182   4.8080  135.182   4.8080 0.000000 0.000000 
1 1 1   11    0   31 o  122.451   3.5821  311.553   25.485  311.553   25.485  311.553   25.485  122.451   5.0659  122.451   5.0659 0.000000 0.000000 
1 1 1   11    0   32 o   34.069   11.128   35.725   24.363   35.725   24.363   35.725   24.363   34.069   15.737   34.069   15.737 0.000000 0.000000 
1 1 1   11    0   33 f   68.433   6.3576  102.428   24.162  102.428   24.162  102.428   24.162   68.433   8.9910   68.433   8.9910 0.000000 0.000000 
1 1 1   11    0   34 o   28.485   10.579   25.198   23.252   25.198   23.252   25.198   23.252   28.485   14.961   28.485   14.961 0.000000 0.000000 
1 1 1   11    0   35 o   45.239   14.199   64.753   39.581   64.753   39.581   64.753   39.581   45.239   20.080   45.239   20.080 0.000000 0.000000 
1 1 1   11    0   36 o   28.778   12.506   18.180   40.633   18.180   40.633   18.180   40.633   28.778   17.686   28.778   17.686 0.000000 0.000000 
1 1 1   11    0   37 o   29.263   11.060   27.605   25.778   27.605   25.778   27.605   25.778   29.263   15.641   29.263   15.641 0.000000 0.000000 
1 1 1   11    0   38 o   26.773   10.277   22.815   22.582   22.815   22.582   22.815   22.582   26.773   14.534   26.773   14.534 0.000000 0.000000 
1 1 1   11    0   39 o   40.330   10.946   48.568   24.349   48.568   24.349   48.568   24.349   40.330   15.480   40.330   15.480 0.000000 0.000000 
1 1 1   11    0   40 o   44.746   10.703   56.579   24.999   56.579   24.999   56.579   24.999   44.746   15.136   44.746   15.136 0.000000 0.000000 
1 1 1   11    0   41 o   17.651   8.3427  -5.2204   23.659  -5.2204   23.659  -5.2204   23.659   17.651   11.798   17.651   11.798 0.000000 0.000000 
1 1 1   11    0   42 o   18.394   8.4817   0.6530   22.167   0.6530   22.167   0.6530   22.167   18.394   11.995   18.394   11.995 0.000000 0.000000 
1 1 1   11    0   43 o   65.536   11.908  115.635   39.347  115.635   39.347  115.635   39.347   65.536   16.841   65.536   16.841 0.000000 0.000000 
1 1 1   11    0   44 o   33.352   10.666   37.627   22.335   37.627   22.335   37.627   22.335   33.352   15.084   33.352   15.084 0.000000 0.000000 
1 1 1   11    0   45 o   30.399   10.439   32.593   21.683   32.593   21.683   32.593   21.683   30.399   14.763   30.399   14.763 0.000000 0.000000 
1 1 1   11    0   46 o   33.998   10.392   39.257   21.226   39.257   21.226   39.257   21.226   33.998   14.697   33.998   14.697 0.000000 0.000000 
1 1 1   11    0   47 o   20.133   9.3650   4.2041   27.907   4.2041   27.907   4.2041   27.907   20.133   13.244   20.133   13.244 0.000000 0.000000 
1 1 1   11    0   48 o   17.391   8.5082 -11.8276   29.468 -11.8276   29.468 -11.8276   29.468   17.391   12.032   17.391   12.032 0.000000 0.000000 
1 1 1   11    1    0 o   85.631   2.0774  151.773   10.348  151.773   10.348  151.773   10.348   85.631   2.9378   85.631   2.9378 0.000000 0.000000 
1 1 1   11    1    1 o  141.844   1.9833  414.999   11.603  411.796   16.334  418.262   16.485  141.292   2.8029  142.397   2.8069 -1.104828 3.966667 
1 1 1   11    1    2 o  305.784   2.5769  1929.06   32.500  1929.54   45.987  1928.59   45.936  305.822   3.6459  305.746   3.6427 0.7553101E-01 5.153810 
1 1 1   11    1    3 o  407.720   3.1205  3430.10   52.474  3432.38   74.275  3427.82   74.145  407.856   4.4154  407.585   4.4106 0.2709961 6.240905 
1 1 1   11    1    4 o  309.340   2.5989  1974.07   33.158  1975.23   46.895  1972.92   46.892  309.430   3.6745  309.249   3.6764 0.1814880 5.197841 
1 1 1   11    1    5 o  229.918   2.2412  1090.39   21.252  1084.96   29.962  1095.89   30.150  229.342   3.1675  230.494   3.1715 -1.152161 4.482315 
1 1 1   11    1    6 o  420.335   3.1955  3644.92   55.391  3618.04   77.547  3672.92   79.146  418.754   4.4899  421.915   4.5482 -3.160919 6.391036 
1 1 1   11    1    7 o  533.831   3.8626  5881.42   85.042  5902.05  120.923  5861.22  119.623  534.755   5.4826  532.906   5.4425 1.849548 7.725297 
1 1 1   11    1    8 o  441.599   3.3268  4024.13   60.593  4022.89   85.704  4025.36   85.677  441.531   4.7063  441.667   4.7033 -0.1358948 6.653578 
1 1 1   11    1    9 o  612.097   5.3011  7751.16  126.780  7778.44  156.189  7698.46  217.063  613.833   6.1693  610.362   8.6225 3.470032 10.60222 
1 1 1   11    1   10 o  765.526   7.4916 12121.69  236.535 12103.57  333.786 12139.97  335.239  764.954   10.580  766.097   10.610 -1.142761 14.98311 
1 1 1   11    1   11 o  531.242   4.5466  5839.47   90.632  5797.21  167.255  5857.04  107.836  529.743   7.6550  532.741   4.9078 -2.998108 9.093162 
1 1 1   11    1   12 f  615.794   4.3816  7828.52  111.268  7778.37  155.819  7880.70  158.942  613.786   6.1551  617.801   6.2377 -4.014404 8.763250 
1 1 1   11    1   13 o  559.627   4.0437  6465.26   93.335  6468.06  132.063  6462.47  131.928  559.748   5.7204  559.506   5.7170 0.2416992 8.087420 
1 1 1   11    1   14 o  228.947   2.4077  1081.21   22.733  1095.45   32.411  1067.43   31.894  230.430   3.4103  227.464   3.3996 2.966248 4.815330 
1 1 1   11    1   15 o  181.817   3.2216  662.451   23.580  772.334   38.755  597.856   29.714  193.430   4.8577  170.204   4.2327 23.22597 6.443101 
1 1 1   11    1   16 o  388.390   3.5616  3112.69   57.027  3172.00   82.179  3057.60   79.201  391.953   5.0835  384.828   4.9900 7.124542 7.123297 
1 1 1   11    1   17 o  350.802   2.9027  2539.62   41.992  2517.37   58.803  2562.78   59.986  349.236   4.0824  352.368   4.1275 -3.132599 5.805370 
1 1 1   11    1   18 o  356.367   2.9336  2621.65   43.118  2616.26   60.835  2627.08   61.123  356.000   4.1432  356.734   4.1543 -0.7339783 5.867231 
1 1 1   11    1   19 o  170.732   2.9399  601.842   20.700  607.045   29.164  596.560   29.385  171.477   4.1236  169.986   4.1913 1.490463 5.879767 
1 1 1   11    1   20 f  136.238   2.7999  382.290   15.315  379.231   19.501  387.215   24.740  135.546   3.4881  136.930   4.3806 -1.383743 5.599748 
1 1 1   11    1   21 o   98.602   3.2634  204.035   12.401  210.160   15.181  191.752   21.498  100.894   3.6481   96.310   5.4121 4.584435 6.526783 
1 1 1   11    1   22 o  273.088   2.9569  1541.54   33.072  1534.07   49.740  1547.45   44.277  272.465   4.4262  273.711   3.9221 -1.246246 5.913890 
1 1 1   11    1   23 o   50.544   7.3127   55.297   14.702   56.835   20.157   53.548   21.492   51.385   9.8696   49.704   10.793 1.680927 14.62538 
1 1 1   11    1   24 o  122.594   3.3766  306.375   16.808  334.691   26.643  287.657   21.662  127.213   5.0780  117.975   4.4519 9.237755 6.753177 
1 1 1   11    1   25 o   50.494   6.2123   53.979   12.631   58.943   18.001   49.166   17.728   53.230   8.1994   47.757   9.3349 5.472946 12.42457 
1 1 1   11    1   26 o  100.165   3.7992  207.425   15.681  201.411   21.618  214.102   22.780   98.639   5.3138  101.690   5.4313 -3.051506 7.598400 
1 1 1   11    1   27 o  142.401   3.6563  420.755   21.381  430.449   29.108  409.397   31.507  144.216   4.8937  140.586   5.4338 3.629456 7.312629 
1 1 1   11    1   28 f   70.253   4.9470  102.662   14.305  104.314   19.710  100.824   20.795   70.870   6.7432   69.636   7.2403 1.233452 9.894063 
1 1 1   11    1   29 o  141.233   3.3722  411.487   19.546  399.617   26.208  426.365   29.341  138.966   4.5726  143.499   4.9575 -4.532501 6.744313 
1 1 1   11    1   30 f   31.701   7.8316   14.459   14.258   33.328   19.963  -5.1885   20.371   39.362   11.546   24.040   10.585 15.32227 15.66315 
1 1 1   11    1   31 o   61.004   7.6728   82.884   17.447   88.687   21.401   71.386   30.125   65.184   7.9604   56.824   13.119 8.359310 15.34554 
1 1 1   11    1   32 o  144.605   5.3078  434.025   31.657  434.025   31.657   0.0000   0.0000  144.605   5.3078  ?   ?       ?      ? 
1 1 1   11    1   33 o  122.974   4.1475  308.700   20.819  360.827   32.373  271.933   27.188  131.636   5.9626  114.312   5.7665 17.32391 8.294933 
1 1 1   11    1   34 o   51.923   7.5104   61.534   16.628   20.275   23.537  102.642   23.493   34.007   12.614   69.838   8.1563 -35.83027 15.02089 
1 1 1   11    1   35 o   40.068   10.360   30.062   20.939   36.701   38.083   27.185   25.068   43.235   16.043   36.900   13.112 6.335262 20.71955 
1 1 1   11    1   36 o  193.885   4.8684  793.736   38.858  732.354   54.515  857.130   55.402  186.120   7.1017  201.650   6.6613 -15.52969 9.736864 
1 1 1   11    1   37 o   45.668   8.5251   48.143   16.409   40.081   22.763   56.866   23.676   41.717   12.355   49.620   11.750 -7.903271 17.05011 
1 1 1   11    1   38 o   73.196   5.7172  115.393   17.232  113.097   24.925  117.496   23.849   72.397   8.3473   73.994   7.8146 -1.597160 11.43440 
1 1 1   11    1   39 o   34.223   9.2347   14.467   18.222   44.461   31.425  -0.7269   22.366   42.983   14.721   25.463   11.154 17.51981 18.46935 
1 1 1   11    1   40 o   45.381   8.4411   47.095   17.819   18.368   24.326   80.355   26.176   32.146   12.600   58.617   11.236 -26.47129 16.88211 
1 1 1   11    1   41 o   36.633   9.0217   27.143   17.632   49.430   26.950   10.464   23.314   44.406   13.509   28.861   11.961 15.54554 18.04344 
1 1 1   11    1   42 f   44.318   8.5686   49.803   17.587   70.478   23.748   24.689   26.173   54.375   10.968   34.262   13.168 20.11272 17.13710 
1 1 1   11    1   43 o   47.793   9.4869   67.089   21.256   26.305   41.373   81.715   24.776   37.110   15.692   58.476   10.666 -21.36550 18.97389 
1 1 1   11    1   44 o   36.871   9.0733   33.355   17.149   47.037   25.983   22.793   22.828   41.808   13.350   31.935   12.291 9.873810 18.14655 
1 1 1   11    1   45 o   36.776   8.6596   35.251   15.463   40.878   22.300   30.040   21.460   39.194   12.352   34.359   12.140 4.834705 17.31917 
1 1 1   11    1   46 o   20.872   6.8930 -10.4740   14.643 -10.2655   21.285 -10.6613   20.176   21.195   9.8911   20.549   9.6032 0.6458073 13.78603 
1 1 1   11    1   47 o   38.463   9.1907   40.306   20.297   7.9852   28.974   71.451   28.442   27.737   12.393   49.189   13.575 -21.45192 18.38140 
1 1 1   11    1   48 f   27.196   8.6012   8.6480   20.174   19.545   27.966  -3.1766   29.132   29.472   12.694   24.921   11.610 4.551956 17.20241 
1 1 1   11    1   49 o   21.714   10.632 -29.7754   32.030   0.0000   0.0000 -29.7754   32.030  ?   ?    21.714   10.632      ?      ? 
1 1 1   11    2    0 o  517.512   3.7558  5527.19  113.344  5527.19  113.344  5527.19  113.344  517.512   5.3115  517.512   5.3115 0.000000 0.000000 
1 1 1   11    2    1 o  262.150   2.3704  1417.50   25.627  1431.15   36.569  1404.32   35.922  263.390   3.3663  260.911   3.3382 2.479156 4.740802 
1 1 1   11    2    2 f  483.314   3.5535  4820.12   70.824  4786.37   99.160  4855.28  101.192  481.589   4.9922  485.039   5.0583 -3.449646 7.106954 
1 1 1   11    2    3 o  196.247   2.1205  794.063   17.159  811.280   24.596  777.739   23.950  198.318   3.0070  194.176   2.9905 4.142609 4.240912 
1 1 1   11    2    4 o  509.543   3.7102  5357.75   77.968  5334.78  109.574  5381.31  110.966  508.438   5.2252  510.648   5.2687 -2.209595 7.420389 
1 1 1   11    2    5 o   84.879   2.1581  148.606   7.5551  148.411   10.651  148.803   10.718   84.823   3.0446   84.935   3.0595 -0.1121216 4.316276 
1 1 1   11    2    6 o  119.410   2.3238  292.687   11.416  319.680   16.822  269.640   15.544  124.489   3.2763  114.331   3.2964 10.15787 4.647602 
1 1 1   11    2    7 o  718.382   4.9914 10657.54  147.891 10666.95  209.429 10648.17  208.870  718.698   7.0652  718.067   7.0525 0.6310425 9.982759 
1 1 1   11    2    8 o  375.561   3.2245  2891.43   48.866  3000.50   78.270  2821.76   62.556  381.306   4.9768  369.817   4.1013 11.48947 6.448977 
1 1 1   11    2    9 o  275.101   3.0001  1571.60   32.482  1596.14   40.468  1527.17   54.460  278.160   3.5273  272.043   4.8538 6.117126 6.000104 
1 1 1   11    2   10 o  272.956   2.8449  1536.48   32.020  1506.47   44.702  1568.10   45.888  270.220   4.0109  275.691   4.0357 -5.471130 5.689814 
1 1 1   11    2   11 o  207.696   2.6342  882.779   20.496  907.120   38.257  872.981   24.273  209.670   4.4240  205.722   2.8608 3.947891 5.268328 
1 1 1   11    2   12 o  230.371   2.3599  1094.75   22.421  1089.05   31.501  1100.61   31.921  229.763   3.3241  230.979   3.3507 -1.216461 4.719839 
1 1 1   11    2   13 o  542.993   3.9454  6086.16   88.356  6110.27  125.664  6062.59  124.256  544.055   5.6002  541.932   5.5591 2.122925 7.890868 
1 1 1   11    2   14 o  366.178   2.9637  2766.51   44.753  2789.76   63.942  2744.18   62.659  367.685   4.2164  364.672   4.1660 3.013489 5.927348 
1 1 1   11    2   15 o  235.418   2.7353  1135.94   26.413  1214.55   39.946  1074.87   35.208  242.602   3.9922  228.234   3.7402 14.36760 5.470559 
1 1 1   11    2   16 o  423.853   3.7756  3709.34   65.987  3687.62   92.187  3732.17   94.495  422.586   5.2892  425.120   5.3893 -2.533844 7.551137 
1 1 1   11    2   17 o  198.105   2.5433  808.532   20.524  801.384   26.931  818.435   31.700  197.073   3.3133  199.138   3.8596 -2.064911 5.086696 
1 1 1   11    2   18 o  431.948   3.6319  3859.84   64.238  3802.10   96.439  3905.88   86.126  428.997   5.4504  434.899   4.8015 -5.902679 7.263751 
1 1 1   11    2   19 o  404.857   3.2040  3383.89   53.486  3417.40   76.674  3352.12   74.647  406.804   4.5698  402.909   4.4920 3.894684 6.407904 
1 1 1   11    2   20 o  223.911   2.8274  1030.25   25.815  1003.85   33.844  1066.99   39.919  220.515   3.7212  227.307   4.2580 -6.792145 5.654863 
1 1 1   11    2   21 o   86.745   4.0156  154.095   14.297  138.004   19.171  174.257   21.459   81.692   5.6899   91.798   5.6679 -10.10592 8.031192 
1 1 1   11    2   22 o   50.955   7.0897   55.426   14.175   53.008   18.391   58.966   22.249   49.681   9.3177   52.229   10.688 -2.548038 14.17950 
1 1 1   11    2   23 o   85.759   4.0680  152.436   14.336  154.976   19.550  149.483   21.086   86.547   5.4768   84.971   6.0166 1.576256 8.136028 
1 1 1   11    2   24 o  147.509   4.1086  475.707   23.256  372.137   38.331  536.038   29.256  133.970   6.9371  161.048   4.4044 -27.07787 8.217202 
1 1 1   11    2   25 o   72.409   4.4982  108.749   13.427  111.108   18.838  106.313   19.144   73.215   6.2382   71.603   6.4823 1.611519 8.996399 
1 1 1   11    2   26 o  105.557   4.1798  230.224   17.974  234.963   27.803  226.822   23.558  106.451   6.3325  104.663   5.4573 1.787262 8.359580 
1 1 1   11    2   27 o  102.765   3.8963  215.527   16.391  251.887   24.971  188.001   21.727  110.269   5.4906   95.261   5.5298 15.00773 7.792657 
1 1 1   11    2   28 o  121.305   4.7558  316.436   20.818  329.122   24.442  282.906   39.735  126.112   4.6990  116.498   8.2698 9.613220 9.511569 
1 1 1   11    2   29 o   90.643   4.6656  165.974   17.181  199.559   27.323  144.011   22.096   98.003   6.7597   83.283   6.4326 14.72034 9.331232 
1 1 1   11    2   30 o   62.151   6.0281   80.616   15.439   82.762   22.400   78.675   21.310   62.928   8.6305   61.375   8.4182 1.553520 12.05620 
1 1 1   11    2   31 f   31.662   8.3900   15.654   14.894   10.655   20.468   21.279   21.713   29.252   11.529   34.072   12.193 -4.820240 16.78007 
1 1 1   11    2   32 o  154.458   4.0242  494.327   25.598  522.018   37.460  470.068   35.061  158.496   5.7303  150.419   5.6515 8.077515 8.048328 
1 1 1   11    2   33 o   70.961   6.3162  106.948   18.302   98.993   27.221  113.510   24.724   68.406   9.6482   73.515   8.1542 -5.109085 12.63247 
1 1 1   11    2   34 o   80.126   5.4449  134.918   17.984  132.130   25.687  137.599   25.187   79.284   7.8553   80.968   7.5421 -1.683914 10.88988 
1 1 1   11    2   35 o   21.698   7.4630 -47.7568   19.336 -25.7009   32.485 -59.8594   24.063   26.286   12.251   17.110   8.5262 9.175884 14.92594 
1 1 1   11    2   36 o  102.466   5.5204  224.292   22.804  228.818   29.504  217.578   35.938  104.101   6.8716  100.831   8.6417 3.270195 11.04075 
1 1 1   11    2   37 o   35.648   8.7358   26.242   16.031   35.382   22.737   17.207   22.607   39.510   12.475   31.786   12.233 7.724380 17.47159 
1 1 1   11    2   38 f   63.069   6.3777   86.345   16.559   79.532   22.819   93.924   24.068   60.396   9.1604   65.742   8.8761 -5.346466 12.75532 
1 1 1   11    2   39 o   33.347   8.7284   22.661   15.916   22.849   22.889   22.486   22.147   33.513   12.437   33.182   12.250 0.3310738 17.45673 
1 1 1   11    2   40 o   46.445   8.6335   53.199   17.793   72.593   24.228   30.496   26.214   55.830   10.913   37.060   13.381 18.76956 17.26707 
1 1 1   11    2   41 o   47.775   8.9776   57.806   18.444   42.970   27.629   69.731   24.771   41.606   13.801   53.945   11.486 -12.33871 17.95530 
1 1 1   11    2   42 o   27.296   8.5775  -0.5642   19.209  -6.6852   30.422   3.4945   24.772   27.334   12.411   27.258   11.843 0.7580757E-01 17.15492 
1 1 1   11    2   43 o   31.329   8.8765   16.252   18.115   2.9253   25.742   29.326   25.496   27.246   11.949   35.412   13.129 -8.166145 17.75304 
1 1 1   11    2   44 o   44.316   7.6618   48.777   17.029   85.297   23.765   10.240   24.412   60.430   9.5349   28.203   11.996 32.22639 15.32359 
1 1 1   11    2   45 o   40.212   8.7733   43.277   16.110   48.411   22.693   38.061   22.874   42.635   12.254   37.790   12.559 4.844872 17.54659 
1 1 1   11    2   46 o   25.251   8.1592  -3.3871   18.649 -11.4810   24.266   8.2912   29.148   22.359   10.475   28.144   12.512 -5.784878 16.31830 
1 1 1   11    2   47 o   33.410   9.3637   28.459   19.225   17.957   25.300   42.809   29.574   29.365   12.336   37.456   14.090 -8.091036 18.72736 
1 1 1   11    2   48 o   36.460   9.4769   40.626   22.686   68.080   29.182  -1.3074   36.066   45.905   14.076   27.015   12.693 18.89022 18.95388 
1 1 1   11    2   49 o   25.332   12.085  -6.8184   35.156   0.0000   0.0000  -6.8184   35.156  ?   ?    25.332   12.085      ?      ? 
1 1 1   11    3    0 o   52.134   2.6292   56.911   7.9016   56.911   7.9016   56.911   7.9016   52.134   3.7182   52.134   3.7182 0.000000 0.000000 
1 1 1   11    3    1 o  179.872   2.0657  667.359   15.325  669.381   21.725  665.356   21.621  180.143   2.9240  179.600   2.9187 0.5423584 4.131468 
1 1 1   11    3    2 o  442.459   3.3166  4039.28   60.519  4017.51   84.956  4061.72   86.232  441.250   4.6682  443.668   4.7124 -2.418640 6.633157 
1 1 1   11    3    3 o  254.023   2.3413  1331.08   24.530  1333.13   34.734  1329.04   34.647  254.218   3.3127  253.828   3.3094 0.3899841 4.682566 
1 1 1   11    3    4 o  167.721   2.0479  580.136   14.165  589.112   20.176  571.412   19.891  169.000   2.8946  166.441   2.8976 2.558151 4.095736 
1 1 1   11    3    5 o  275.344   2.4416  1563.89   27.727  1558.00   39.037  1569.88   39.389  274.822   3.4440  275.867   3.4618 -1.044891 4.883175 
1 1 1   11    3    6 o  354.002   2.8379  2585.12   41.431  2605.90   59.128  2565.09   58.070  355.398   4.0338  352.605   3.9930 2.792267 5.675837 
1 1 1   11    3    7 o  150.730   2.2358  466.686   13.716  480.598   21.334  456.884   17.907  152.634   3.3888  148.827   2.9173 3.806946 4.471593 
1 1 1   11    3    8 o  352.957   3.0962  2552.98   44.175  2485.75   56.719  2656.64   70.430  347.108   3.9619  358.806   4.7592 -11.69806 6.192422 
1 1 1   11    3    9 o  158.865   2.5363  522.580   15.784  526.896   19.523  514.434   26.822  159.825   2.9616  157.906   4.1184 1.918640 5.072679 
1 1 1   11    3   10 o  168.606   2.5975  588.477   16.189  581.950   30.604  591.014   19.077  167.941   4.4183  169.272   2.7325 -1.331528 5.194968 
1 1 1   11    3   11 o  271.191   3.8123  1533.36   32.224  1494.64   77.059  1541.57   35.475  269.015   6.9451  273.367   3.1464 -4.352295 7.624600 
1 1 1   11    3   12 o  263.866   3.2311  1415.93   33.592  1506.27   57.424  1368.94   41.418  270.148   5.1538  257.584   3.8985 12.56357 6.462210 
1 1 1   11    3   13 o  342.421   3.2769  2402.65   45.936  2554.17   70.145  2288.89   60.782  351.795   4.8344  333.046   4.4249 18.74875 6.553713 
1 1 1   11    3   14 o  314.753   2.7197  2042.63   35.283  2083.83   51.025  2004.88   48.843  317.790   3.8929  311.716   3.7991 6.073730 5.439476 
1 1 1   11    3   15 o  100.169   3.3043  203.971   13.535  172.790   17.999  244.552   20.534   91.490   4.7700  108.847   4.5739 -17.35711 6.608577 
1 1 1   11    3   16 o  476.733   3.8543  4686.99   74.831  4735.68  115.635  4651.92   98.154  478.807   5.8555  474.660   5.0137 4.147522 7.708697 
1 1 1   11    3   17 o  385.887   3.3538  3059.82   52.377  3000.22   67.516  3149.89   83.004  381.233   4.2939  390.541   5.1531 -9.307495 6.707592 
1 1 1   11    3   18 o  147.477   3.4236  444.658   20.117  432.315   25.200  466.347   33.404  144.709   4.2222  150.245   5.3906 -5.536163 6.847255 
1 1 1   11    3   19 o  104.997   3.4727  228.229   15.002  212.661   21.397  243.282   21.040  101.461   5.1132  108.534   4.7003 -7.073586 6.945301 
1 1 1   11    3   20 o  336.453   3.0158  2335.54   40.423  2329.20   50.920  2346.34   66.475  335.898   3.6755  337.009   4.7825 -1.110809 6.031672 
1 1 1   11    3   21 f   85.654   3.5405  153.847   11.704  158.158   14.338  145.241   20.259   87.513   3.9725   83.795   5.8618 3.718521 7.081065 
1 1 1   11    3   22 o  289.218   3.6074  1714.29   41.560  1671.57   52.078  1789.21   68.968  284.400   4.4398  294.036   5.6870 -9.636536 7.214783 
1 1 1   11    3   23 o  160.221   3.0642  530.481   20.248  533.643   28.637  527.319   28.634  160.700   4.3206  159.743   4.3461 0.9569092 6.128323 
1 1 1   11    3   24 o   52.425   7.6525   59.356   15.917   58.263   21.324   60.732   23.920   51.950   10.316   52.901   11.306 -0.9516220 15.30502 
1 1 1   11    3   25 o  232.101   3.1481  1111.29   30.052  1146.25   44.466  1081.90   40.773  235.436   4.5792  228.766   4.3213 6.669693 6.296273 
1 1 1   11    3   26 f  177.564   4.1038  663.479   29.526  583.481   44.411  726.846   39.526  167.728   6.4198  187.399   5.1139 -19.67017 8.207658 
1 1 1   11    3   27 o  135.207   4.1229  396.232   20.982  334.442   36.768  426.069   25.550  126.877   7.0262  143.537   4.3158 -16.66022 8.245861 
1 1 1   11    3   28 o  100.059   4.5920  206.844   18.714  201.683   24.464  214.124   29.056   98.609   6.0151  101.509   6.9401 -2.899414 9.183984 
1 1 1   11    3   29 o   94.543   4.3412  185.154   16.911  174.863   23.399  196.408   24.470   91.793   6.1804   97.292   6.0981 -5.498749 8.682370 
1 1 1   11    3   30 o  108.397   4.0603  243.834   18.104  244.736   24.742  242.794   26.560  108.637   5.5220  108.157   5.9540 0.4806061 8.120520 
1 1 1   11    3   31 o  135.419   3.6332  379.997   20.235  378.077   27.570  382.238   29.793  135.074   4.9487  135.764   5.3207 -0.6901093 7.266339 
1 1 1   11    3   32 f  102.240   4.2861  217.923   18.007  239.665   25.497  196.286   25.435  107.382   5.7569   97.097   6.3513 10.28500 8.572119 
1 1 1   11    3   33 o  149.699   3.6426  462.657   22.377  438.010   29.898  494.050   33.742  145.229   4.9915  154.169   5.3065 -8.940826 7.285166 
1 1 1   11    3   34 o   92.055   4.8064  177.311   18.237  168.946   25.582  185.955   26.006   89.826   6.9052   94.283   6.6877 -4.457481 9.612831 
1 1 1   11    3   35 o   66.026   7.2508   91.434   19.060  103.559   32.122   84.846   23.679   69.015   11.285   63.037   9.1076 5.977390 14.50158 
1 1 1   11    3   36 o   51.891   8.1642   61.310   16.961   61.998   25.253   60.744   22.894   51.988   12.018   51.793   11.054 0.1952553 16.32841 
1 1 1   11    3   37 o   20.478   6.7452 -27.7099   14.981 -54.6173   21.180  -0.7698   21.193   15.787   7.8877   25.168   10.944 -9.380490 13.49034 
1 1 1   11    3   38 o   73.494   5.6080  117.327   16.772  137.778   23.643   96.611   23.795   80.295   7.1391   66.694   8.6504 13.60136 11.21592 
1 1 1   11    3   39 o   35.435   8.4262   24.809   16.337   3.1236   23.156   46.301   23.052   26.905   11.569   43.965   12.254 -17.06042 16.85234 
1 1 1   11    3   40 o   28.622   8.2283   8.8625   15.686  -1.7557   21.689   20.506   22.712   24.773   10.914   32.472   12.317 -7.698984 16.45654 
1 1 1   11    3   41 o   35.148   8.1818   21.006   16.873 -10.5028   23.588   54.028   24.147   23.461   10.757   46.836   12.331 -23.37457 16.36363 
1 1 1   11    3   42 o   45.384   9.7909   53.139   19.774   51.766   31.979   53.990   25.162   44.443   14.852   46.324   12.762 -1.881184 19.58178 
1 1 1   11    3   43 o   36.294   8.4173   28.294   16.671   53.873   23.844   3.8335   23.317   46.140   12.304   26.447   11.490 19.69302 16.83467 
1 1 1   11    3   44 o   27.149   8.3397   4.1780   18.282   17.101   22.873 -18.6797   30.420   29.855   12.045   24.442   11.537 5.413303 16.67944 
1 1 1   11    3   45 o   31.781   7.9431   16.488   16.108 -15.0555   22.840   47.704   22.721   21.354   10.054   42.207   12.299 -20.85369 15.88611 
1 1 1   11    3   46 o   26.784   8.5607   3.1903   19.714   1.6035   32.349   4.1279   24.865   27.682   12.657   25.887   11.530 1.794474 17.12149 
1 1 1   11    3   47 o   29.844   8.3275   14.910   17.136 -10.0636   23.974   40.999   24.503   22.262   10.424   37.427   12.989 -15.16520 16.65500 
1 1 1   11    3   48 o   27.331   9.2203 -17.9470   27.243   32.976   45.143 -47.1150   34.165   33.564   15.192   21.097   10.453 12.46739 18.44052 
1 1 1   11    3   49 o   44.785   11.666   90.248   30.417   68.947   47.463  105.095   39.624   38.229   16.500   51.342   16.496 -13.11271 23.33184 
1 1 1   11    4    0 o   41.115   3.2353   36.146   7.5130   36.146   7.5130   36.146   7.5130   41.115   4.5754   41.115   4.5754 0.000000 0.000000 
1 1 1   11    4    1 o  304.958   2.5755  1918.49   32.394  1922.04   45.873  1914.96   45.752  305.240   3.6438  304.677   3.6408 0.5629578 5.151001 
1 1 1   11    4    2 o  421.156   3.1982  3659.40   55.550  3638.29   77.965  3681.15   79.168  419.924   4.5015  422.388   4.5443 -2.464081 6.396484 
1 1 1   11    4    3 f  531.346   3.8384  5826.04   84.111  5859.20  119.918  5793.94  118.005  532.832   5.4567  529.861   5.3998 2.971436 7.676780 
1 1 1   11    4    4 o   99.346   2.0664  203.577   8.4670  202.788   11.955  204.371   11.994   99.153   2.9232   99.539   2.9215 -0.3861618 4.132803 
1 1 1   11    4    5 o  406.022   3.1180  3401.45   52.215  3402.93   73.865  3399.98   73.821  406.110   4.4099  405.934   4.4092 0.1760254 6.236051 
1 1 1   11    4    6 o  498.941   3.6552  5137.67   75.219  5145.15  106.630  5130.26  106.122  499.302   5.1779  498.581   5.1607 0.7217712 7.310456 
1 1 1   11    4    7 o  899.915   6.1411 16736.96  227.935 16711.72  321.545 16762.46  323.159  899.237   8.6697  900.594   8.7000 -1.357300 12.28225 
1 1 1   11    4    8 o   84.501   2.7831  152.334   9.1862  165.377   11.590  130.292   15.066   89.539   3.1383   79.463   4.5970 10.07543 5.566099 
1 1 1   11    4    9 o  679.733   5.8275  9541.26  153.909  9532.19  188.325  9559.52  267.074  679.457   6.7202  680.010   9.5225 -0.5527344 11.65499 
1 1 1   11    4   10 o  196.224   2.8308  761.230   21.544  891.114   38.788  703.286   25.908  207.810   4.5255  184.639   3.4020 23.17088 5.661632 
1 1 1   11    4   11 o  227.397   3.5508  1076.29   25.089  1053.44   60.298  1081.07   27.590  225.866   6.4727  228.929   2.9221 -3.062607 7.101674 
1 1 1   11    4   12 o   80.079   2.9342  134.204   9.4258  123.571   14.863  141.357   12.191   77.382   4.6569   82.776   3.5708 -5.393303 5.868319 
1 1 1   11    4   13 o  307.246   3.1270  1948.06   39.625  1947.61   55.921  1948.51   56.157  307.211   4.4134  307.281   4.4310 -0.7006836E-01 6.253943 
1 1 1   11    4   14 o  402.509   3.6401  3344.61   60.426  3340.13   85.932  3349.00   84.986  402.239   5.1797  402.778   5.1158 -0.5387878 7.280170 
1 1 1   11    4   15 o  223.091   2.3859  1026.84   21.952  1032.91   31.211  1020.90   30.882  223.743   3.3821  222.439   3.3661 1.304565 4.771704 
1 1 1   11    4   16 o  220.330   2.5472  997.114   22.906  1033.05   35.296  970.967   30.106  223.735   3.8250  216.926   3.3650 6.809235 5.094443 
1 1 1   11    4   17 o  198.324   3.1136  794.330   23.985  761.629   29.071  864.046   42.448  192.104   3.6691  204.543   5.0316 -12.43954 6.227275 
1 1 1   11    4   18 o  146.231   2.3854  441.135   14.384  454.282   20.542  428.491   20.147  148.368   3.3569  144.094   3.3899 4.274216 4.770820 
1 1 1   11    4   19 o  270.582   2.7583  1499.29   29.431  1470.87   36.440  1552.61   49.915  266.964   3.3094  274.200   4.4136 -7.236511 5.516585 
1 1 1   11    4   20 o  230.356   3.0974  1118.00   26.682  1150.05   31.889  1043.18   48.721  236.050   3.2755  224.663   5.2579 11.38710 6.194730 
1 1 1   11    4   21 o  103.779   3.1966  223.647   13.027  226.249   16.173  218.839   21.984  104.674   3.7461  102.884   5.1807 1.790131 6.393183 
1 1 1   11    4   22 o  281.684   3.8825  1641.05   45.094  1614.78   62.872  1668.88   64.711  279.369   5.4565  283.999   5.5246 -4.629517 7.764946 
1 1 1   11    4   23 f  232.324   2.7078  1123.34   25.191  1151.96   32.220  1078.35   40.406  236.206   3.3073  228.442   4.2885 7.764435 5.415641 
1 1 1   11    4   24 o  185.773   4.3450  713.317   33.292   0.0000   0.0000  713.317   33.292  ?   ?   185.773   4.3450      ?      ? 
1 1 1   11    4   25 o  190.025   3.4570  746.085   27.057  730.640   37.139  763.553   39.497  187.943   4.7912  192.106   4.9849 -4.162537 6.914072 
1 1 1   11    4   26 f  108.934   3.5872  246.895   16.033  265.939   22.190  226.097   23.190  113.377   4.7454  104.492   5.3809 8.885086 7.174456 
1 1 1   11    4   27 o  211.043   3.2443  923.169   28.159  894.818   41.027  948.421   38.720  207.945   4.7836  214.142   4.3839 -6.197006 6.488557 
1 1 1   11    4   28 o  133.811   3.9510  379.276   21.325  437.290   28.933  310.276   31.554  145.346   4.8265  122.275   6.2568 23.07032 7.902039 
1 1 1   11    4   29 o   51.369   6.8835   58.283   14.023   83.652   19.910   33.307   19.755   63.382   7.6161   39.356   11.469 24.02536 13.76709 
1 1 1   11    4   30 o   98.261   4.1138  200.491   16.660  205.871   23.340  194.903   23.787   99.620   5.6806   96.902   5.9518 2.717926 8.227587 
1 1 1   11    4   31 o  141.712   3.7554  415.589   21.858  406.682   29.453  426.508   32.610  140.057   5.0988  143.366   5.5149 -3.308807 7.510744 
1 1 1   11    4   32 o  126.567   3.6688  332.518   19.149  324.646   27.008  340.474   27.153  125.053   5.2365  128.080   5.1400 -3.027603 7.337609 
1 1 1   11    4   33 o   32.173   8.3984   14.876   15.535   1.4643   21.322   30.051   22.681   26.399   11.219   37.946   12.500 -11.54653 16.79687 
1 1 1   11    4   34 o   40.234   10.703   27.130   21.403   35.036   43.737   24.641   24.543   44.497   17.041   35.970   12.953 8.526756 21.40513 
1 1 1   11    4   35 o   34.863   8.2723   21.729   15.674   42.045   22.161   1.3932   22.172   43.125   12.013   26.601   11.376 16.52417 16.54459 
1 1 1   11    4   36 o   88.741   5.0525  166.751   18.460  168.279   26.961  165.402   25.328   89.058   7.3401   88.423   6.9450 0.6345749 10.10500 
1 1 1   11    4   37 f   37.625   9.5054   29.606   17.881   31.014   21.450   26.399   32.372   37.362   12.149   37.887   14.622 -0.5246239 19.01076 
1 1 1   11    4   38 f   29.709   8.4668   12.021   15.994   16.554   23.286   7.9725   22.006   31.431   12.325   27.988   11.611 3.442558 16.93351 
1 1 1   11    4   39 o   25.143   7.8118  -8.8596   16.720 -29.2057   23.309   12.707   23.998   20.113   9.6609   30.172   12.279 -10.05904 15.62365 
1 1 1   11    4   40 o   24.749   7.6998  -1.7701   15.277  -5.3515   21.785   1.6956   21.430   23.898   10.707   25.600   11.068 -1.701584 15.39963 
1 1 1   11    4   41 o   68.906   6.1925  105.797   17.566  111.083   24.624  100.318   25.067   70.848   8.4269   66.963   9.0762 3.884659 12.38507 
1 1 1   11    4   42 o   53.413   9.6264   71.976   20.784   80.271   33.922   66.990   26.298   55.024   14.677   51.803   12.460 3.220421 19.25286 
1 1 1   11    4   43 o   39.277   8.8048   38.886   16.036   42.019   22.826   35.832   22.535   40.690   12.444   37.865   12.460 2.825481 17.60966 
1 1 1   11    4   44 o   23.497   7.7687 -13.7887   18.671  -8.6880   24.515 -20.8342   28.812   23.598   10.874   23.395   11.098 0.2030144 15.53742 
1 1 1   11    4   45 o   33.532   8.5902   28.177   15.830   37.031   21.625   17.955   23.236   37.297   12.202   29.766   12.094 7.531010 17.18039 
1 1 1   11    4   46 o   48.741   8.9003   66.025   18.148   57.398   25.614   74.721   25.717   44.848   13.056   52.634   12.100 -7.785217 17.80057 
1 1 1   11    4   47 o   28.903   8.5581   16.355   17.437   26.693   25.101   6.7127   24.240   31.893   12.704   25.913   11.471 5.979713 17.11628 
1 1 1   11    4   48 o   37.647   11.226   53.886   29.664   53.414   48.788   54.162   37.363   36.940   16.316   38.354   15.423 -1.414719 22.45200 
1 1 1   11    4   49 o   26.117   8.9621 -11.9831   28.233   8.6874   47.506 -23.2712   35.106   29.044   13.908   23.189   11.306 5.855556 17.92412 
1 1 1   11    5    0 o  741.379   5.1301 11345.60  221.795 11345.60  221.795 11345.60  221.795  741.379   7.2550  741.379   7.2550 0.000000 0.000000 
1 1 1   11    5    1 o   94.491   2.0806  184.166   8.1087  184.499   11.460  183.832   11.474   94.576   2.9380   94.405   2.9469 0.1711655 4.161283 
1 1 1   11    5    2 o  565.898   4.0472  6609.59   94.463  6616.30  133.780  6602.92  133.403  566.184   5.7289  565.613   5.7185 0.5717163 8.094484 
1 1 1   11    5    3 o   75.413   2.2496  117.413   6.9912  121.604   9.8169  113.100   9.9587   76.781   3.1000   74.046   3.2609 2.734596 4.499239 
1 1 1   11    5    4 o  213.820   2.1931  943.086   19.341  943.997   27.359  942.176   27.344  213.924   3.1009  213.717   3.1021 0.2065125 4.386162 
1 1 1   11    5    5 o   92.268   2.1338  175.476   8.1150  166.805   11.319  184.644   11.640   89.925   3.0519   94.612   2.9829 -4.686928 4.267576 
1 1 1   11    5    6 o  263.062   2.4003  1427.51   26.042  1421.09   36.640  1434.06   37.021  262.465   3.3847  263.660   3.4044 -1.194855 4.800607 
1 1 1   11    5    7 o  266.679   2.4271  1467.05   26.695  1463.78   37.606  1470.37   37.902  266.380   3.4228  266.978   3.4421 -0.5982361 4.854253 
1 1 1   11    5    8 o  352.787   3.4712  2567.15   47.633  2564.88   58.344  2571.68   82.485  352.591   4.0120  352.982   5.6657 -0.3909607 6.942371 
1 1 1   11    5    9 o  206.954   2.3824  874.811   19.927  841.972   25.520  926.117   31.898  202.033   3.0626  211.876   3.6503 -9.842758 4.764880 
1 1 1   11    5   10 o  352.289   3.5259  2538.95   47.436  2620.50   85.692  2502.93   56.959  356.282   5.8315  348.297   3.9651 7.984863 7.051819 
1 1 1   11    5   11 o  182.166   2.5901  683.589   17.544  687.031   32.982  682.231   20.718  182.469   4.3825  181.863   2.7621 0.6053619 5.180285 
1 1 1   11    5   12 f  575.453   5.1074  6780.15  112.025  6998.78  203.059  6684.50  134.314  581.878   8.4610  569.027   5.7230 12.85156 10.21479 
1 1 1   11    5   13 o  318.702   3.1774  2096.12   41.765  2105.11   59.312  2087.27   58.819  319.379   4.5026  318.025   4.4843 1.354736 6.354739 
1 1 1   11    5   14 o  188.358   3.1359  731.659   24.350  713.515   33.787  751.267   35.124  185.931   4.4059  190.785   4.4637 -4.853302 6.271882 
1 1 1   11    5   15 o  320.836   2.7500  2123.70   36.382  2150.66   52.140  2098.12   50.790  322.819   3.9160  318.854   3.8621 3.964874 5.500099 
1 1 1   11    5   16 o  270.294   2.7832  1505.41   30.627  1492.77   40.132  1523.05   47.396  268.954   3.6178  271.634   4.2305 -2.679688 5.566496 
1 1 1   11    5   17 o  457.078   3.7520  4315.01   70.083  4320.70  106.605  4310.68   93.007  457.291   5.6522  456.864   4.9358 0.4264526 7.504019 
1 1 1   11    5   18 o  122.974   2.9605  312.230   15.015  313.888   21.147  310.543   21.322  123.304   4.1582  122.644   4.2151 0.6606827 5.920993 
1 1 1   11    5   19 o   70.509   3.9055  104.134   10.707  107.063   13.213   98.531   18.275   72.001   4.4493   69.018   6.4200 2.983047 7.811054 
1 1 1   11    5   20 o  118.979   3.0498  298.598   14.534  323.823   18.946  262.523   22.657  125.240   3.6678  112.717   4.8736 12.52355 6.099537 
1 1 1   11    5   21 o  108.901   3.9299  246.515   17.355  252.160   22.714  238.598   26.902  110.439   4.9867  107.363   6.0753 3.076317 7.859801 
1 1 1   11    5   22 o  188.896   2.8177  737.478   21.827  740.567   29.376  733.670   32.614  189.355   3.7614  188.436   4.1964 0.9195404 5.635417 
1 1 1   11    5   23 o   85.410   3.9362  150.729   13.837  147.754   18.883  154.178   20.333   84.509   5.4176   86.311   5.7118 -1.801918 7.872458 
1 1 1   11    5   24 f  147.193   3.0482  447.873   18.442  448.208   25.074  447.479   27.220  147.267   4.1282  147.118   4.4860 0.1484680 6.096407 
1 1 1   11    5   25 o  117.049   4.6572  289.604   20.436  270.863   37.156  297.733   24.470  114.136   7.8930  119.962   4.9457 -5.826027 9.314489 
1 1 1   11    5   26 o  318.745   3.4224  2102.25   44.986  2052.01   63.324  2153.44   63.918  314.892   4.8758  322.597   4.8040 -7.704865 6.844780 
1 1 1   11    5   27 o  221.099   2.9606  1009.27   26.818  1024.06   40.460  997.670   35.816  222.510   4.4087  219.688   3.9528 2.822098 5.921272 
1 1 1   11    5   28 o  167.633   3.1804  583.210   21.881  560.809   32.224  602.374   29.805  164.605   4.7465  170.660   4.2344 -6.054718 6.360768 
1 1 1   11    5   29 o   90.232   4.3365  169.436   16.079  185.725   22.700  153.034   22.778   94.625   5.8163   85.839   6.4337 8.786240 8.673081 
1 1 1   11    5   30 o   42.632   7.7168   38.884   14.702   17.395   20.556   61.390   21.036   32.008   11.804   53.257   9.9426 -21.24942 15.43365 
1 1 1   11    5   31 o   92.068   4.8621  177.887   18.320  192.781   25.151  161.056   26.737   96.273   6.3342   87.862   7.3781 8.410904 9.724107 
1 1 1   11    5   32 o  133.610   3.7301  369.478   20.440  359.533   27.330  382.102   30.791  131.618   5.0345  135.602   5.5054 -3.983749 7.460206 
1 1 1   11    5   33 o   51.702   7.5591   58.658   15.925   80.166   22.871   38.417   22.188   61.621   8.9990   41.782   12.148 19.83944 15.11813 
1 1 1   11    5   34 o   48.262   10.307   55.515   21.938   30.962   43.474   63.904   25.411   43.166   16.865   53.359   11.855 -10.19263 20.61440 
1 1 1   11    5   35 o   49.689   8.0605   55.912   16.261   66.406   23.160   45.710   22.835   54.536   10.679   44.841   12.077 9.695507 16.12105 
1 1 1   11    5   36 o   36.623   8.8464   28.344   16.195   22.273   22.579   34.778   23.242   33.858   12.389   39.389   12.631 -5.531128 17.69290 
1 1 1   11    5   37 o   34.615   9.1921   12.198   17.911  -3.4237   21.682   45.768   31.784   24.719   10.900   44.511   14.805 -19.79225 18.38423 
1 1 1   11    5   38 o  105.105   4.3238  234.434   18.726  221.092   26.265  248.226   26.705  102.001   6.2433  108.209   5.9835 -6.208282 8.647579 
1 1 1   11    5   39 o   68.730   6.5489  104.334   18.539   97.080   25.788  112.093   26.669   66.166   9.4497   71.295   9.0696 -5.129074 13.09789 
1 1 1   11    5   40 o   47.359   8.3491   53.609   16.252   53.866   22.984   53.352   22.984   47.482   11.790   47.236   11.825 0.2461853 16.69819 
1 1 1   11    5   41 o   32.104   8.5838   21.142   15.566   21.786   22.236   20.523   21.798   32.403   12.212   31.804   12.066 0.5996895 17.16765 
1 1 1   11    5   42 o   73.445   6.6441  124.024   19.800  106.259   28.960  139.618   27.132   67.702   10.371   79.188   8.3073 -11.48628 13.28819 
1 1 1   11    5   43 o   31.135   8.6109   19.686   16.042   19.906   22.511   19.458   22.866   31.175   12.148   31.095   12.207 0.8079338E-01 17.22180 
1 1 1   11    5   44 o   22.406   7.2743 -11.5635   16.009 -29.1567   23.588   3.4602   21.797   19.600   9.4892   25.211   11.028 -5.611065 14.54856 
1 1 1   11    5   45 o   38.826   8.5999   40.341   15.461   48.016   22.364   33.314   21.397   42.179   12.177   35.473   12.147 6.705952 17.19975 
1 1 1   11    5   46 o   29.791   8.5919   19.017   16.837   13.067   24.305   24.507   23.346   28.046   11.950   31.536   12.348 -3.489912 17.18384 
1 1 1   11    5   47 o   29.243   8.5268   18.375   17.242   6.3577   25.204   28.945   23.639   26.009   11.594   32.477   12.506 -6.468256 17.05362 
1 1 1   11    5   48 o   36.211   10.615   43.923   29.306   2.9159   46.106   71.722   37.962   29.292   13.937   43.131   16.015 -13.83826 21.23012 
1 1 1   11    5   49 o   25.052   8.6628 -19.2085   28.678  -9.3613   46.156 -25.4001   36.600   26.833   13.057   23.271   11.389 3.561619 17.32557 
1 1 1   11    6    0 o  355.669   2.8431  2610.32   58.965  2610.32   58.965  2610.32   58.965  355.669   4.0207  355.669   4.0207 0.000000 0.000000 
1 1 1   11    6    1 o  201.668   2.1445  838.829   17.836  847.177   25.403  830.712   25.048  202.657   3.0392  200.678   3.0263 1.978821 4.288936 
1 1 1   11    6    2 o  513.528   3.7364  5442.66   79.137  5442.23  111.890  5443.10  111.943  513.507   5.2830  513.548   5.2851 -0.4077148E-01 7.472730 
1 1 1   11    6    3 o  357.058   2.8560  2630.37   42.060  2627.19   59.378  2633.56   59.584  356.842   4.0345  357.274   4.0436 -0.4320374 5.712049 
1 1 1   11    6    4 o  280.890   2.4754  1627.57   28.677  1619.93   40.321  1635.40   40.794  280.223   3.4887  281.557   3.5129 -1.334442 4.950898 
1 1 1   11    6    5 o  244.653   2.3276  1234.66   23.486  1229.47   33.031  1239.97   33.401  244.133   3.2804  245.173   3.3031 -1.040329 4.655291 
1 1 1   11    6    6 o  353.751   2.8445  2581.55   41.498  2565.41   58.234  2598.20   59.152  352.628   4.0040  354.873   4.0414 -2.244812 5.688985 
1 1 1   11    6    7 o  563.521   4.3694  6548.61  100.282  6512.29  131.626  6598.86  154.819  561.706   5.6816  565.337   6.6397 -3.631104 8.738782 
1 1 1   11    6    8 o  565.935   4.9866  6596.19  109.046  6562.44  132.585  6666.77  191.707  563.845   5.7012  568.026   8.1828 -4.180481 9.973111 
1 1 1   11    6    9 o  433.803   3.5460  3887.21   62.893  3857.83   95.256  3909.93   83.740  432.326   5.3421  435.281   4.6644 -2.955231 7.091918 
1 1 1   11    6   10 o  332.762   2.8654  2277.26   37.881  2312.21   62.876  2257.35   47.461  334.737   4.5542  330.787   3.4787 3.950043 5.730838 
1 1 1   11    6   11 o  536.235   5.0405  5925.29  108.548  6002.28  175.227  5877.35  138.274  538.957   7.8828  533.514   6.2839 5.443054 10.08099 
1 1 1   11    6   12 o  549.476   4.8364  6253.67  104.243  6181.59  176.797  6292.08  129.064  546.899   7.8379  552.053   5.6684 -5.153992 9.672828 
1 1 1   11    6   13 o  256.272   3.0379  1349.93   30.089  1370.95   52.943  1339.90   36.569  257.707   4.9810  254.837   3.4793 2.870041 6.075798 
1 1 1   11    6   14 o  640.643   5.9187  8423.41  150.452  8737.72  251.657  8248.58  187.688  649.600   9.3928  631.685   7.2039 17.91510 11.83731 
1 1 1   11    6   15 o  357.354   2.9275  2634.79   43.131  2668.51   62.030  2603.22   60.012  359.564   4.1827  355.145   4.0970 4.419434 5.854956 
1 1 1   11    6   16 o  175.223   3.0396  633.385   21.763  637.074   33.156  630.592   28.848  175.658   4.5764  174.787   4.0017 0.8715668 6.079191 
1 1 1   11    6   17 o  368.880   3.6787  2806.10   52.619  2824.74   91.786  2796.98   64.219  369.686   6.0198  368.074   4.2302 1.611725 7.357472 
1 1 1   11    6   18 o  207.466   3.1940  876.869   25.365  857.408   30.460  920.886   45.810  203.813   3.6235  211.119   5.2610 -7.305817 6.388096 
1 1 1   11    6   19 o   76.928   3.6042  122.817   10.725  123.829   13.098  120.757   18.684   77.439   4.1010   76.417   5.9281 1.021652 7.208387 
1 1 1   11    6   20 o  156.846   2.8603  506.899   18.403  497.414   24.665  518.809   27.640  155.205   3.8531  158.486   4.2284 -3.281479 5.720679 
1 1 1   11    6   21 o  248.099   3.1794  1247.95   29.788  1213.56   35.350  1332.16   55.320  242.421   3.5355  253.778   5.2852 -11.35736 6.358747 
1 1 1   11    6   22 o  314.832   2.9330  2049.26   36.892  2053.44   46.725  2042.35   60.118  315.331   3.5927  314.332   4.6371 0.9992065 5.866002 
1 1 1   11    6   23 o  218.147   2.8499  982.426   25.475  976.642   34.091  989.739   38.335  217.443   3.8013  218.851   4.2470 -1.408661 5.699728 
1 1 1   11    6   24 f  193.296   2.8690  769.955   22.706  754.465   30.198  790.105   34.441  191.088   3.8315  195.504   4.2713 -4.415665 5.737976 
1 1 1   11    6   25 o   55.618   5.8640   69.095   12.165   78.482   15.384   53.432   19.872   61.537   6.0612   49.698   10.040 11.83901 11.72794 
1 1 1   11    6   26 f   95.858   3.9420  193.075   15.344  211.481   20.646  170.367   22.932  101.081   4.9523   90.636   6.1345 10.44497 7.883973 
1 1 1   11    6   27 o  124.838   3.2893  322.492   16.934  328.455   23.977  316.557   23.921  125.993   4.6140  123.684   4.6893 2.309738 6.578628 
1 1 1   11    6   28 o  155.888   4.0527  520.373   24.769  444.888   40.263  566.331   31.416  146.345   6.6706  165.430   4.6045 -19.08444 8.105411 
1 1 1   11    6   29 o  164.415   3.5743  560.887   24.028  566.980   32.040  553.057   36.321  165.488   4.6943  163.341   5.3914 2.146393 7.148628 
1 1 1   11    6   30 o  134.958   3.3749  377.205   18.777  392.821   26.709  361.944   26.404  137.728   4.7019  132.188   4.8429 5.540466 6.749892 
1 1 1   11    6   31 o  110.738   3.9658  254.402   18.098  240.152   25.182  269.624   26.027  107.524   5.6783  113.951   5.5378 -6.426865 7.931572 
1 1 1   11    6   32 o  141.585   3.5169  416.312   20.526  424.577   28.749  407.719   29.316  143.037   4.8732  140.132   5.0722 2.905106 7.033880 
1 1 1   11    6   33 o   67.016   6.0897   94.730   16.810   89.106   23.735  100.390   23.811   64.977   8.8567   69.054   8.3604 -4.077789 12.17940 
1 1 1   11    6   34 o  123.517   5.0721  325.712   25.435  281.699   37.639  362.705   34.507  115.461   7.9038  131.574   6.3587 -16.11311 10.14412 
1 1 1   11    6   35 o  136.332   3.6147  387.914   20.321  381.299   28.409  394.845   29.080  135.147   5.0967  137.516   5.1271 -2.369644 7.229313 
1 1 1   11    6   36 o   84.011   4.9111  149.564   16.959  166.250   24.341  133.825   23.641   88.656   6.6569   79.366   7.2223 9.289749 9.822160 
1 1 1   11    6   37 o   39.665   8.9424   35.214   16.618   42.958   24.230   28.336   22.835   43.004   12.749   36.326   12.543 6.677834 17.88481 
1 1 1   11    6   38 o   26.056   7.7704  -0.5584   15.405   17.173   21.718 -18.5149   21.855   30.996   11.972   21.116   9.9085 9.879570 15.54080 
1 1 1   11    6   39 o   60.826   7.0447   83.762   17.190   93.424   24.463   74.338   24.160   65.039   9.1196   56.613   10.740 8.425549 14.08935 
1 1 1   11    6   40 o   29.629   8.3267   13.574   15.401   7.3097   21.687   19.947   21.874   27.345   11.451   31.913   12.092 -4.567905 16.65337 
1 1 1   11    6   41 o   44.065   9.5677   50.433   19.577   36.377   31.826   58.989   24.831   39.226   14.644   48.904   12.317 -9.678139 19.13536 
1 1 1   11    6   42 o   27.606   8.3727   2.5686   17.541   18.971   26.164 -10.8209   23.640   32.030   12.897   23.182   10.681 8.848240 16.74536 
1 1 1   11    6   43 o   23.216   7.4918  -7.0375   15.957 -10.0380   22.922  -4.2159   22.228   22.742   10.492   23.691   10.697 -0.9485340 14.98360 
1 1 1   11    6   44 o   46.031   8.8088   56.411   17.079   53.736   26.332   58.354   22.439   44.304   13.326   47.759   11.524 -3.454525 17.61763 
1 1 1   11    6   45 o   29.236   8.7947   13.526   19.642   25.829   23.421 -15.6441   36.063   32.238   12.438   26.235   12.437 6.002590 17.58941 
1 1 1   11    6   46 o   23.486   7.6456  -5.4383   17.101  -8.2543   24.081  -2.5733   24.290   22.860   10.619   24.112   11.003 -1.252733 15.29127 
1 1 1   11    6   47 o   26.659   8.6062  -5.1174   21.723   27.460   32.756 -30.6966   29.025   32.255   13.811   21.063   10.272 11.19204 17.21233 
1 1 1   11    6   48 o   41.362   10.585   61.902   24.585   81.405   34.208   41.066   35.357   47.876   15.321   34.848   14.609 13.02782 21.16948 
1 1 1   11    6   49 o   32.900   10.405   35.193   29.139   68.610   44.530   10.169   38.535   37.946   16.172   27.855   13.098 10.09181 20.81091 
1 1 1   11    7    0 o  162.205   2.0519  543.167   19.400  543.167   19.400  543.167   19.400  162.205   2.9019  162.205   2.9019 0.000000 0.000000 
1 1 1   11    7    1 o  344.711   2.7886  2450.66   39.633  2420.30   55.198  2482.96   56.943  342.509   3.9074  346.912   3.9798 -4.402954 5.577266 
1 1 1   11    7    2 o  227.349   2.2489  1066.14   21.087  1073.71   29.996  1058.74   29.650  228.147   3.1877  226.551   3.1732 1.596283 4.497833 
1 1 1   11    7    3 o  511.093   3.7252  5390.44   78.517  5358.56  110.055  5423.48  112.053  509.557   5.2366  512.630   5.2997 -3.073090 7.450449 
1 1 1   11    7    4 o  262.098   2.3932  1416.97   25.868  1408.10   36.306  1426.11   36.867  261.266   3.3692  262.930   3.3996 -1.664246 4.786336 
1 1 1   11    7    5 o  287.789   2.5069  1708.22   29.750  1691.47   41.610  1725.75   42.553  286.346   3.5232  289.233   3.5671 -2.886322 5.013717 
1 1 1   11    7    6 o  427.991   3.2494  3778.56   57.340  3737.18   79.899  3822.51   82.339  425.578   4.5520  430.404   4.6383 -4.826630 6.498811 
1 1 1   11    7    7 o  194.378   2.5999  769.406   19.567  751.010   23.730  808.483   34.585  190.808   3.0153  197.948   4.2362 -7.140259 5.199747 
1 1 1   11    7    8 o  312.996   2.8663  2006.42   36.197  1952.29   46.295  2091.56   58.059  307.620   3.6489  318.372   4.4215 -10.75189 5.732689 
1 1 1   11    7    9 o  170.101   2.4836  600.694   16.012  587.318   28.929  606.602   19.226  168.714   4.1573  171.488   2.7183 -2.774170 4.967144 
1 1 1   11    7   10 o  744.227   6.1270 11428.44  169.342 11498.97  318.984 11400.76  199.826  745.432   10.375  743.021   6.5206 2.411072 12.25404 
1 1 1   11    7   11 o  519.519   4.9867  5464.80  100.729  5904.32  177.641  5256.51  122.290  534.471   8.0585  504.567   5.8763 29.90414 9.973476 
1 1 1   11    7   12 o  374.664   3.5326  2905.90   49.566  2877.86   91.723  2917.46   58.907  373.306   5.9573  376.021   3.7983 -2.714661 7.065163 
1 1 1   11    7   13 o  250.997   4.1727  1317.08   36.104  1272.35   75.342  1330.41   41.134  248.088   7.3632  253.907   3.9279 -5.818268 8.345345 
1 1 1   11    7   14 o  207.070   2.4562  884.312   20.832  880.961   27.842  888.575   31.399  206.632   3.2669  207.509   3.6687 -0.8769073 4.912414 
1 1 1   11    7   15 o  154.505   2.3045  492.407   14.683  482.741   20.542  502.504   20.996  152.956   3.2562  156.055   3.2621 -3.099411 4.609093 
1 1 1   11    7   16 o  195.429   2.8416  787.929   22.898  811.716   32.830  765.398   31.952  198.300   4.0141  192.559   4.0232 5.741180 5.683207 
1 1 1   11    7   17 o   86.985   3.9642  155.842   14.124  160.576   21.400  152.188   18.800   88.143   5.8866   85.828   5.3110 2.315033 7.928334 
1 1 1   11    7   18 o  234.836   3.0699  1134.06   26.212  1128.74   30.520  1149.01   51.173  233.867   3.1641  235.805   5.2617 -1.936951 6.139766 
1 1 1   11    7   19 o  206.125   2.5817  874.052   21.095  866.062   26.351  888.307   35.200  204.849   3.1189  207.401   4.1150 -2.552704 5.163401 
1 1 1   11    7   20 o  103.558   3.8195  217.863   15.789  207.018   19.744  237.098   26.294  100.079   4.7833  107.037   5.9561 -6.957687 7.639062 
1 1 1   11    7   21 o  223.652   2.7429  1032.58   24.766  1030.02   31.892  1036.46   39.307  223.342   3.4621  223.963   4.2553 -0.6212463 5.485786 
1 1 1   11    7   22 o  180.603   2.6456  669.868   18.878  660.632   23.457  686.846   31.804  178.884   3.1794  182.321   4.2294 -3.437119 5.291178 
1 1 1   11    7   23 o  170.548   2.6719  601.518   18.147  603.360   22.880  598.393   29.795  170.939   3.2452  170.156   4.2455 0.7827759 5.343724 
1 1 1   11    7   24 o  320.866   3.4232  2128.61   45.268  2156.77   65.487  2102.85   62.645  322.881   4.9175  318.851   4.7636 4.030426 6.846433 
1 1 1   11    7   25 o  137.850   3.0025  392.246   16.687  389.879   21.417  395.903   26.621  137.358   3.7804  138.341   4.6656 -0.9833832 6.004931 
1 1 1   11    7   26 o  246.182   2.8782  1257.41   28.879  1283.59   38.249  1222.69   44.044  249.224   3.7210  243.140   4.3920 6.083893 5.756387 
1 1 1   11    7   27 o  144.796   3.2037  432.175   19.057  416.796   25.650  451.121   28.471  141.947   4.3812  147.645   4.6753 -5.697922 6.407330 
1 1 1   11    7   28 o  116.150   3.7247  280.422   17.757  268.496   26.094  290.708   24.234  113.812   5.5590  118.488   4.9590 -4.675995 7.449405 
1 1 1   11    7   29 o   69.640   6.2224   99.862   16.909   96.723   20.645  106.258   29.472   68.150   7.3448   71.129   10.046 -2.978935 12.44473 
1 1 1   11    7   30 o  132.370   4.1106  363.848   22.044  364.212   28.624  363.318   34.559  132.535   5.2365  132.206   6.3378 0.3291626 8.221235 
1 1 1   11    7   31 o   58.778   6.3803   72.513   15.437   66.422   21.430   79.084   22.256   56.188   9.2473   61.368   8.7931 -5.180176 12.76054 
1 1 1   11    7   32 o   91.823   4.5083  176.054   17.051  180.815   23.717  170.961   24.530   93.142   6.1736   90.505   6.5715 2.637184 9.016585 
1 1 1   11    7   33 o   82.342   6.2674  146.048   20.680  129.456   32.201  157.697   26.980   78.010   10.008   86.673   7.5472 -8.662842 12.53486 
1 1 1   11    7   34 o   47.321   7.8029   47.557   16.377   20.762   22.079   80.328   24.418   33.424   12.248   61.218   9.6708 -27.79327 15.60570 
1 1 1   11    7   35 o   76.698   5.5574  124.710   17.491  128.708   26.248  121.517   23.458   77.701   8.1905   75.695   7.5137 2.005890 11.11490 
1 1 1   11    7   36 o   46.573   8.2749   50.092   16.075   39.270   22.544   61.285   22.927   41.330   12.308   51.816   11.064 -10.48630 16.54986 
1 1 1   11    7   37 o   50.367   8.0108   60.421   16.879   37.285   25.160   79.356   22.761   40.343   13.160   60.391   9.1383 -20.04798 16.02164 
1 1 1   11    7   38 o   59.577   9.8902   78.757   21.406   68.986   24.653  108.695   43.154   54.248   11.382   64.905   16.178 -10.65680 19.78030 
1 1 1   11    7   39 o   23.236   7.4610  -8.9983   15.622 -13.7125   22.186  -4.3629   22.000   22.215   10.274   24.257   10.821 -2.042444 14.92200 
1 1 1   11    7   40 o   43.384   8.6176   45.807   16.181   38.981   22.749   52.797   23.020   40.113   12.449   46.656   11.919 -6.543213 17.23528 
1 1 1   11    7   41 o   30.887   9.1119   13.078   18.925   12.303   30.751   13.550   24.010   31.816   13.495   29.957   12.247 1.859505 18.22372 
1 1 1   11    7   42 o   57.154   7.6735   80.726   17.663   37.164   24.513  127.765   25.472   38.551   13.003   75.756   8.1524 -37.20452 15.34695 
1 1 1   11    7   43 o   26.268   7.9753   3.9851   16.159  -9.3753   23.419   16.125   22.324   23.041   10.621   29.495   11.900 -6.453630 15.95058 
1 1 1   11    7   44 o   22.209   7.1557  -7.8827   14.935 -21.1129   21.961   3.5023   20.372   19.907   9.5121   24.510   10.693 -4.603594 14.31146 
1 1 1   11    7   45 o   27.119   8.6755   3.7769   20.099   7.8730   24.273  -5.1593   35.852   26.667   11.652   27.571   12.857 -0.9036064 17.35103 
1 1 1   11    7   46 o   27.125   8.2783   9.5646   17.257   18.575   23.843  -0.3503   25.011   29.454   12.141   24.796   11.257 4.657673 16.55664 
1 1 1   11    7   47 o   36.549   9.8381   41.116   22.654   14.461   33.065   64.699   31.102   29.238   13.139   43.861   14.647 -14.62321 19.67627 
1 1 1   11    7   48 o   40.959   10.585   57.560   24.906   28.669   33.029   95.639   37.920   31.620   13.706   50.299   16.135 -18.67897 21.17026 
1 1 1   11    7   49 o   25.714   8.8783 -22.2746   29.790   24.343   45.836 -56.3647   39.197   30.269   14.250   21.159   10.595 9.110342 17.75663 
1 1 1   11    8    0 o  165.566   2.0467  565.880   19.752  565.880   19.752  565.880   19.752  165.566   2.8945  165.566   2.8945 0.000000 0.000000 
1 1 1   11    8    1 o  335.976   2.7424  2328.78   38.002  2327.67   53.681  2329.89   53.804  335.896   3.8748  336.056   3.8819 -0.1602173 5.484785 
1 1 1   11    8    2 o   25.013   4.8462   13.583   5.2187   16.159   6.8540   10.029   8.0503   27.435   6.2029   22.592   7.4477 4.843008 9.692427 
1 1 1   11    8    3 o  256.783   2.5512  1360.17   26.728  1359.61   35.300  1360.91   40.918  256.728   3.3337  256.837   3.8627 -0.1087646 5.102378 
1 1 1   11    8    4 o  307.868   2.6029  1954.64   33.039  1981.86   47.480  1929.07   46.003  309.945   3.7142  305.791   3.6475 4.153564 5.205712 
1 1 1   11    8    5 o  131.072   2.1582  352.587   11.544  366.397   17.807  342.576   15.161  133.272   3.2396  128.872   2.8524 4.400452 4.316436 
1 1 1   11    8    6 o  382.478   3.2415  3001.22   50.137  2932.57   64.475  3106.25   79.743  377.000   4.1465  387.957   4.9836 -10.95721 6.483038 
1 1 1   11    8    7 o  132.079   2.5744  353.955   13.776  330.386   17.652  390.679   22.034  126.551   3.3819  137.607   3.8824 -11.05584 5.148811 
1 1 1   11    8    8 o  180.946   2.6331  682.296   18.860  650.698   31.057  700.758   23.739  177.582   4.2402  184.310   3.1229 -6.728363 5.266113 
1 1 1   11    8    9 o  362.430   3.1295  2708.14   46.217  2726.18   71.209  2695.01   60.751  363.454   4.7503  361.406   4.0756 2.048218 6.259027 
1 1 1   11    8   10 o  652.891   4.9473  8820.18  132.633  8643.90  195.956  8969.22  180.178  646.803   7.3455  658.979   6.6293 -12.17596 9.894605 
1 1 1   11    8   11 f  269.682   2.9674  1471.17   29.035  1563.32   57.532  1439.68   33.632  275.194   5.0688  264.170   3.0868 11.02356 5.934735 
1 1 1   11    8   12 o  394.100   3.8122  3087.90   52.181  3429.92  111.456  2991.89   59.053  407.425   6.6327  380.775   3.7602 26.65079 7.624369 
1 1 1   11    8   13 o  356.421   3.7681  2604.47   53.477  2695.04   88.670  2552.70   67.042  361.196   5.9521  351.647   4.6225 9.548401 7.536201 
1 1 1   11    8   14 o  197.337   2.4875  798.910   19.958  830.715   31.220  776.928   25.955  200.630   3.7729  194.045   3.2430 6.584808 4.975095 
1 1 1   11    8   15 o  140.884   2.8156  409.717   16.359  410.982   22.980  408.418   23.293  141.105   3.9486  140.662   4.0149 0.4429626 5.631248 
1 1 1   11    8   16 o  155.100   2.3478  496.272   15.016  506.150   21.466  486.807   21.013  156.610   3.3233  153.589   3.3171 3.021500 4.695526 
1 1 1   11    8   17 o  432.031   3.6114  3844.65   63.446  3924.43   98.796  3788.64   82.768  435.772   5.4969  428.291   4.6855 7.481140 7.222856 
1 1 1   11    8   18 o  321.065   3.0620  2134.85   40.260  2182.04   54.157  2076.55   60.192  325.074   4.0393  317.057   4.6030 8.016998 6.124013 
1 1 1   11    8   19 o   80.710   4.7310  141.492   12.282  145.787   13.736  124.368   27.428   84.020   3.9637   77.400   8.5918 6.620003 9.461992 
1 1 1   11    8   20 o  244.495   3.1504  1227.70   29.319  1215.57   35.151  1255.45   53.151  242.622   3.5127  246.369   5.2307 -3.747162 6.300765 
1 1 1   11    8   21 o  194.631   2.6171  774.953   20.035  758.361   24.716  806.745   34.212  191.663   3.1266  197.598   4.1979 -5.935043 5.234298 
1 1 1   11    8   22 o  181.229   2.6563  682.279   19.118  693.166   24.094  663.773   31.414  183.232   3.1881  179.225   4.2497 4.006851 5.312633 
1 1 1   11    8   23 f  185.553   2.6518  703.833   19.457  685.760   24.137  737.370   32.879  182.233   3.2114  188.874   4.2207 -6.640930 5.303561 
1 1 1   11    8   24 f   78.089   4.1891  124.661   12.834  121.052   15.763  131.759   22.104   76.488   4.9968   79.691   6.7250 -3.203201 8.378201 
1 1 1   11    8   25 o  140.221   2.8710  411.378   15.979  425.609   20.229  387.767   26.057  143.535   3.4171  136.908   4.6146 6.627670 5.742021 
1 1 1   11    8   26 o   43.395   6.4729   44.783   10.630   52.573   12.837   27.790   18.960   50.343   6.1825   36.448   11.374 13.89507 12.94578 
1 1 1   11    8   27 o   26.704   6.3407   13.497   9.6130   22.913   11.112 -14.5112   19.165   32.531   8.2652   20.876   9.6179 11.65493 12.68134 
1 1 1   11    8   28 o  191.872   3.0616  761.191   24.116  756.716   32.532  766.649   35.932  191.276   4.1237  192.469   4.5264 -1.193436 6.123123 
1 1 1   11    8   29 o   46.353   9.0647   46.716   17.477   46.281   21.920   47.474   28.956   45.928   11.576   46.778   13.953 -0.8499870 18.12933 
1 1 1   11    8   30 o  137.615   3.8128  392.938   21.591  392.521   29.536  393.417   31.639  137.566   5.2057  137.665   5.5724 -0.9916687E-01 7.625649 
1 1 1   11    8   31 o  100.445   4.1746  209.941   17.276  222.100   24.540  197.993   24.327  103.350   5.7569   97.539   6.0470 5.811394 8.349175 
1 1 1   11    8   32 f  168.206   3.8105  590.869   26.239  565.807   39.087  611.427   35.401  164.848   5.7489  171.564   5.0029 -6.715775 7.620956 
1 1 1   11    8   33 o   44.203   9.3820   38.737   18.714   64.886   30.628   23.160   23.639   53.339   13.813   35.067   12.700 18.27254 18.76399 
1 1 1   11    8   34 o   35.001   8.3308   23.864   15.593   39.330   21.023   4.9468   23.250   41.777   11.723   28.225   11.840 13.55267 16.66154 
1 1 1   11    8   35 o   97.338   4.6505  198.515   18.579  214.298   28.009  186.114   24.827  100.711   6.7430   93.965   6.4062 6.746315 9.300994 
1 1 1   11    8   36 o   36.325   8.5452   27.147   15.851   12.648   22.276   42.018   22.560   29.999   11.962   42.650   12.206 -12.65050 17.09036 
1 1 1   11    8   37 o   92.481   4.9553  181.315   18.822  203.803   28.072  162.947   25.370   97.666   6.9690   87.295   7.0464 10.37062 9.910544 
1 1 1   11    8   38 o   29.994   9.2240   4.6109   20.625   13.859   23.879 -22.5625   40.931   30.516   12.309   29.471   13.741 1.045149 18.44794 
1 1 1   11    8   39 o   45.510   8.4935   49.617   16.154   49.916   23.590   49.352   22.168   45.530   12.280   45.490   11.737 0.3953552E-01 16.98708 
1 1 1   11    8   40 o   47.813   8.3788   55.715   16.454   52.790   23.256   58.646   23.282   46.423   12.043   49.202   11.653 -2.778721 16.75761 
1 1 1   11    8   41 o   23.190   7.4710  -7.9941   15.720  -7.6257   23.021  -8.3160   21.519   23.671   10.767   22.710   10.361 0.9607506 14.94198 
1 1 1   11    8   42 o   29.957   8.5044   15.951   16.046   17.466   22.735   14.448   22.649   30.492   12.108   29.421   11.946 1.071550 17.00883 
1 1 1   11    8   43 o   23.565   7.6479 -11.8833   16.762   6.0714   26.364 -24.0657   21.717   27.740   12.131   19.389   9.3164 8.350142 15.29586 
1 1 1   11    8   44 o   40.215   8.3168   42.170   15.379   57.267   21.919   27.533   21.583   47.188   11.392   33.241   12.120 13.94728 16.63353 
1 1 1   11    8   45 o   27.179   8.6758   4.6013   19.717   6.3258   23.840   0.8679   35.077   26.077   11.467   28.281   13.023 -2.203634 17.35161 
1 1 1   11    8   46 o   41.861   9.1231   51.141   17.806   62.935   25.072   39.139   25.292   47.075   12.645   36.647   13.154 10.42801 18.24621 
1 1 1   11    8   47 o   29.634   9.1876   17.982   21.283   26.742   32.614   11.485   28.088   31.719   13.684   27.549   12.263 4.170422 18.37525 
1 1 1   11    8   48 o   25.520   8.3668  -6.8292   21.309   27.379   32.662 -32.1798   28.118   30.975   13.526   20.064   9.8526 10.91059 16.73370 
1 1 1   11    8   49 o   30.234   9.9053   26.340   28.975   29.261   46.089   24.431   37.259   30.769   14.422   29.698   13.581 1.071304 19.81052 
1 1 1   11    9    0 o  280.487   2.8465  1623.81   46.548  1623.81   46.548  1623.81   46.548  280.487   4.0256  280.487   4.0256 0.000000 0.000000 
1 1 1   11    9    1 o  441.483   3.3184  4021.63   60.415  4047.62   86.266  3996.60   84.637  442.881   4.7227  440.085   4.6629 2.796143 6.636755 
1 1 1   11    9    2 o  144.530   2.1598  429.156   12.713  441.676   19.724  420.257   16.629  146.323   3.2682  142.737   2.8247 3.586227 4.319682 
1 1 1   11    9    3 o  215.680   2.3668  958.781   20.816  965.253   31.983  954.025   27.417  216.305   3.5850  215.054   3.0910 1.250809 4.733587 
1 1 1   11    9    4 o  115.550   2.4584  272.369   10.965  284.139   19.464  266.897   13.272  117.351   4.0214  113.749   2.8289 3.601822 4.916793 
1 1 1   11    9    5 o  500.733   3.9666  5167.19   80.766  5125.02  105.518  5226.85  125.507  498.310   5.1340  503.155   6.0478 -4.844940 7.933136 
1 1 1   11    9    6 o  323.649   3.2724  2162.62   41.293  2164.72   50.724  2158.50   71.101  323.918   3.7968  323.380   5.3309 0.5370178 6.544752 
1 1 1   11    9    7 o  325.820   2.9213  2181.33   38.577  2142.74   49.902  2238.66   60.816  322.269   3.7544  329.372   4.4768 -7.102722 5.842661 
1 1 1   11    9    8 o  183.908   2.4521  697.674   18.599  706.036   26.499  689.555   26.110  184.994   3.4731  182.822   3.4626 2.171677 4.904292 
1 1 1   11    9    9 o  320.116   3.0876  2099.14   40.473  2239.70   61.759  1993.32   53.583  329.430   4.5454  310.801   4.1800 18.62943 6.175231 
1 1 1   11    9   10 f  203.505   2.6403  852.423   22.122  927.533   32.106  784.531   30.524  212.021   3.6715  194.989   3.7955 17.03160 5.280675 
1 1 1   11    9   11 o  246.810   2.8091  1272.53   26.379  1216.78   47.057  1298.07   31.856  242.785   4.6993  250.835   3.0792 -8.050201 5.618241 
1 1 1   11    9   12 o   71.678   4.4859  100.074   12.373  123.095   22.815   90.482   14.727   77.163   7.1688   66.192   5.3944 10.97108 8.971704 
1 1 1   11    9   13 o  168.998   2.5303  589.523   17.632  575.555   24.998  603.352   24.873  167.003   3.6293  170.992   3.5268 -3.988525 5.060671 
1 1 1   11    9   14 o  118.543   3.1849  308.918   14.262  238.630   24.132  346.642   17.679  107.477   5.4439  129.609   3.3072 -22.13120 6.369809 
1 1 1   11    9   15 o  348.620   2.8956  2508.95   41.634  2505.56   58.612  2512.40   59.150  348.384   4.0791  348.857   4.1109 -0.4725037 5.791252 
1 1 1   11    9   16 o   93.831   2.6451  181.751   10.232  189.390   14.532  174.242   14.408   95.788   3.6784   91.875   3.8022 3.913345 5.290287 
1 1 1   11    9   17 o  281.954   2.6149  1641.04   30.406  1652.46   43.286  1629.92   42.721  282.921   3.7095  280.986   3.6863 1.934875 5.229701 
1 1 1   11    9   18 o  318.455   3.0318  2098.97   39.486  2129.22   52.746  2060.41   59.555  321.104   3.9827  315.805   4.5723 5.299805 6.063648 
1 1 1   11    9   19 o   91.813   4.0855  161.948   12.311  154.513   13.603  195.627   28.952   86.494   3.8131   97.133   7.2267 -10.63875 8.170978 
1 1 1   11    9   20 o  135.591   3.1530  384.213   16.350  391.603   19.823  368.491   28.913  137.710   3.4902  133.472   5.2522 4.237915 6.306084 
1 1 1   11    9   21 o  141.034   2.9315  409.992   16.953  402.278   22.688  419.744   25.511  139.548   3.9420  142.520   4.3399 -2.971634 5.862925 
1 1 1   11    9   22 o   96.373   3.5492  192.358   14.067  195.315   19.260  188.976   20.594   97.181   4.8051   95.566   5.2247 1.614815 7.098351 
1 1 1   11    9   23 o  104.930   3.1051  227.879   12.659  228.368   15.502  226.901   21.933  105.144   3.5747  104.716   5.0783 0.4279861 6.210289 
1 1 1   11    9   24 o  307.467   3.4044  1963.92   41.344  1983.96   51.664  1928.23   68.945  309.807   4.0432  305.127   5.4784 4.679688 6.808881 
1 1 1   11    9   25 o   79.080   4.4024  131.175   14.196  146.821   19.532  113.659   20.667   84.176   5.6260   73.983   6.7729 10.19286 8.804788 
1 1 1   11    9   26 o  189.445   2.9818  743.273   23.249  760.891   32.084  723.793   33.737  191.833   4.0551  187.058   4.3728 4.774918 5.963635 
1 1 1   11    9   27 o   87.357   4.3660  157.823   15.694  150.845   21.320  166.075   23.185   85.267   6.0624   89.447   6.2846 -4.180588 8.732069 
1 1 1   11    9   28 o   37.117   7.1225   30.494   10.392   32.248   12.048   25.396   20.538   38.651   7.8263   35.583   11.902 3.068138 14.24494 
1 1 1   11    9   29 o  132.463   3.6671  359.037   17.871  353.483   20.902  374.134   34.459  130.734   3.8764  134.192   6.2260 -3.458221 7.334135 
1 1 1   11    9   30 o   39.961   9.5240   33.914   18.381   41.565   21.107   9.8935   37.397   43.465   11.569   36.457   15.132 7.008175 19.04801 
1 1 1   11    9   31 o  171.436   3.3620  607.800   23.627  592.505   31.541  627.356   35.666  169.036   4.5241  173.837   4.9745 -4.800446 6.724075 
1 1 1   11    9   32 o   88.872   5.9443  176.199   19.886  195.359   24.521  139.388   33.988   96.783   6.1430   80.962   10.178 15.82106 11.88853 
1 1 1   11    9   33 o   61.283   7.4073   84.704   17.550   52.078   24.711  117.913   24.930   47.919   12.406   74.647   8.0974 -26.72842 14.81467 
1 1 1   11    9   34 o   97.454   4.4185  199.271   17.750  208.077   25.566  191.077   24.663   99.537   6.2275   95.372   6.2699 4.164314 8.837033 
1 1 1   11    9   35 o  103.709   4.6048  224.347   19.569  255.869   29.751  200.310   25.980  110.032   6.5558   97.387   6.4682 12.64502 9.209513 
1 1 1   11    9   36 f   50.824   7.8659   59.125   16.031   59.839   22.693   58.413   22.649   51.156   11.076   50.493   11.172 0.6627121 15.73180 
1 1 1   11    9   37 o   37.330   8.8269   31.748   16.057   36.280   22.819   27.303   22.599   39.333   12.506   35.328   12.461 4.005455 17.65379 
1 1 1   11    9   38 o   27.466   8.5912  -4.3208   17.971 -11.6379   21.786   11.256   31.787   22.434   10.305   32.498   13.749 -10.06402 17.18242 
1 1 1   11    9   39 o   20.975   6.8889 -18.8040   14.974 -36.6036   21.782  -2.8537   20.619   18.085   8.8369   23.864   10.571 -5.778807 13.77780 
1 1 1   11    9   40 o   27.709   8.5773   2.0948   18.738  -9.9205   30.578   9.3201   23.712   26.864   12.292   28.554   11.966 -1.690170 17.15464 
1 1 1   11    9   41 o   30.307   8.4197   15.817   15.774   6.3206   21.829   26.195   22.820   26.638   11.337   33.977   12.452 -7.338821 16.83947 
1 1 1   11    9   42 o   20.853   6.8979 -17.6062   15.122  -3.9758   21.480 -31.0020   21.294   23.460   10.561   18.246   8.8760 5.213770 13.79580 
1 1 1   11    9   43 o   34.741   8.8557   30.340   16.290   27.027   24.362   33.019   21.908   33.578   12.752   35.904   12.292 -2.325546 17.71144 
1 1 1   11    9   44 o   26.973   8.1650   8.4513   16.513   17.070   22.996  -0.7253   23.728   29.327   11.987   24.618   11.090 4.709093 16.33003 
1 1 1   11    9   45 o   22.496   7.4616 -14.1076   17.971 -31.4170   27.562  -1.3055   23.703   20.798   10.113   24.195   10.974 -3.396795 14.92322 
1 1 1   11    9   46 o   36.139   8.9006   37.209   18.975   58.686   24.907   7.5067   29.291   44.831   12.824   27.447   12.347 17.38496 17.80128 
1 1 1   11    9   47 o   26.958   8.7052   6.1163   21.401   11.041   32.118   2.1835   28.701   28.202   12.785   25.713   11.818 2.489389 17.41033 
1 1 1   11    9   48 o   28.443   8.9409   13.742   21.521   37.813   32.243  -5.5997   28.902   33.145   13.925   23.740   11.218 9.405184 17.88190 
1 1 1   11    9   49 o   25.738   8.7748  -4.9993   27.754 -15.1079   44.137   1.6121   35.695   25.537   12.499   25.940   12.319 -0.4029903 17.54966 
1 1 1   11   10    0 o  360.856   3.3118  2687.65   69.680  2687.65   69.680  2687.65   69.680  360.856   4.6836  360.856   4.6836 0.000000 0.000000 
1 1 1   11   10    1 o  605.786   5.2750  7562.45  123.534  7527.74  150.287  7634.77  216.915  603.831   6.0345  607.741   8.6538 -3.909790 10.55000 
1 1 1   11   10    2 o  601.082   4.6030  7460.86  112.955  7461.56  149.483  7459.94  172.453  601.172   6.0287  600.992   6.9572 0.1794434 9.205899 
1 1 1   11   10    3 o  702.885   4.8925 10203.05  141.822 10254.73  202.139 10152.94  199.030  704.632   6.9554  701.138   6.8826 3.494873 9.785064 
1 1 1   11   10    4 f  452.449   3.3843  4220.45   63.079  4143.60   86.789  4306.51   91.841  448.093   4.6960  456.805   4.8746 -8.711304 6.768632 
1 1 1   11   10    5 o  358.639   3.5089  2642.17   48.567  2619.69   58.933  2689.75   85.738  356.322   4.0101  360.956   5.7591 -4.633484 7.017705 
1 1 1   11   10    6 o  113.487   2.1274  265.884   9.9001  267.608   13.327  263.762   14.789  113.900   2.8368  113.074   3.1711 0.8253784 4.254826 
1 1 1   11   10    7 o  372.022   3.3910  2856.46   52.030  2849.62   73.372  2863.38   73.794  371.574   4.7876  372.469   4.8036 -0.8946838 6.781997 
1 1 1   11   10    8 o  210.066   2.2815  908.028   19.189  920.131   31.229  900.686   24.323  211.178   3.5855  208.954   2.8223 2.223511 4.562994 
1 1 1   11   10    9 o   66.492   2.5818   90.074   6.8536   95.735   11.356   86.831   8.5954   68.110   4.0426   64.874   3.2124 3.236237 5.163512 
1 1 1   11   10   10 o  421.766   3.3317  3669.82   56.110  3681.85   91.723  3662.62   70.930  422.264   5.2666  421.269   4.0823 0.9953613 6.663492 
1 1 1   11   10   11 o  320.144   3.1411  2154.12   39.016  1999.34   66.530  2235.25   48.169  311.163   5.1840  329.125   3.5485 -17.96164 6.282166 
1 1 1   11   10   12 o  147.936   3.4045  455.814   16.181  445.603   37.247  458.189   17.965  146.848   6.1498  149.024   2.9229 -2.175949 6.809043 
1 1 1   11   10   13 o  316.336   3.0975  2065.54   40.405  2044.78   56.489  2087.29   57.817  314.711   4.3520  317.961   4.4087 -3.249268 6.194899 
1 1 1   11   10   14 o  179.358   2.4633  665.481   18.075  650.949   27.192  676.986   24.195  177.590   3.7124  181.126   3.2387 -3.535599 4.926615 
1 1 1   11   10   15 o  124.887   2.3958  321.884   12.339  328.556   17.506  315.296   17.395  126.174   3.3640  123.601   3.4123 2.573647 4.791658 
1 1 1   11   10   16 o  249.278   2.4970  1282.69   25.672  1283.20   36.239  1282.17   36.374  249.329   3.5240  249.228   3.5386 0.1007385 4.994015 
1 1 1   11   10   17 o  163.090   2.5744  545.459   16.549  536.896   20.493  561.509   28.057  161.289   3.0807  164.892   4.1255 -3.603561 5.148855 
1 1 1   11   10   18 o   48.296   5.2615   51.873   9.2135   56.423   11.209   42.397   16.178   52.236   5.2027   44.356   9.1468 7.880337 10.52294 
1 1 1   11   10   19 o   47.567   9.1940   38.146   10.380   36.977   10.687   57.642   43.638   42.257   6.1319   52.877   17.335 -10.61974 18.38800 
1 1 1   11   10   20 o  180.751   2.6681  674.481   19.418  673.345   24.885  676.250   31.047  180.587   3.3411  180.915   4.1609 -0.3284302 5.336267 
1 1 1   11   10   21 o  141.098   2.7328  413.615   15.216  419.486   19.012  403.153   25.380  142.536   3.2340  139.660   4.4062 2.875702 5.465601 
1 1 1   11   10   22 o  163.504   2.8585  549.134   19.134  526.633   25.341  578.975   29.183  159.648   3.8485  167.360   4.2278 -7.712021 5.717086 
1 1 1   11   10   23 o   97.619   3.4179  197.654   13.414  199.465   17.196  194.839   21.439   98.227   4.2446   97.011   5.3582 1.216217 6.835713 
1 1 1   11   10   24 o   88.187   3.8428  161.056   13.952  160.544   19.149  161.635   20.369   88.049   5.2729   88.325   5.5914 -0.2759018 7.685578 
1 1 1   11   10   25 o   35.218   7.4268   24.884   12.612   9.4848   17.884   40.119   17.788   27.517   10.798   42.918   10.199 -15.40094 14.85366 
1 1 1   11   10   26 o  141.732   4.4204  440.027   23.631  355.267   40.658  483.268   29.040  130.646   7.5454  152.818   4.6074 -22.17140 8.840860 
1 1 1   11   10   27 o   73.291   4.4050  110.107   11.937  108.371   14.005  114.719   22.826   72.354   4.6931   74.228   7.4560 -1.873825 8.810083 
1 1 1   11   10   28 o  256.339   2.9917  1348.75   30.742  1315.04   38.892  1404.88   50.187  252.197   3.7390  260.481   4.6714 -8.283432 5.983499 
1 1 1   11   10   29 o   68.049   6.1456  109.852   13.883  123.047   16.373   76.096   26.189   77.029   5.1537   59.069   11.158 17.96009 12.29116 
1 1 1   11   10   30 o   43.262   8.8414   32.283   11.739   29.624   12.438   53.949   35.505   36.872   8.3702   49.653   15.576 -12.78101 17.68272 
1 1 1   11   10   31 o   46.105   8.1714   47.874   15.857   60.605   21.856   33.726   23.040   52.531   10.455   39.679   12.561 12.85272 16.34283 
1 1 1   11   10   32 o   58.393   8.4033   72.002   20.039  117.246   31.072   39.786   26.220   74.138   10.162   42.649   13.386 31.48899 16.80652 
1 1 1   11   10   33 o   59.823   7.0035   81.422   15.914  120.895   22.763   43.683   22.257   75.706   7.2901   43.941   11.961 31.76440 14.00710 
1 1 1   11   10   34 o  109.359   4.0139  250.797   18.098  258.586   25.620  243.039   25.570  111.081   5.5920  107.638   5.7596 3.443405 8.027725 
1 1 1   11   10   35 o   40.402   8.3406   36.783   16.033   55.006   22.135   16.672   23.254   48.982   11.201   31.822   12.362 17.16015 16.68113 
1 1 1   11   10   36 o   71.611   5.6646  110.319   16.715  117.035   23.916  103.905   23.370   73.798   7.8574   69.425   8.1616 4.373177 11.32918 
1 1 1   11   10   37 o   37.634   9.0177   32.477   16.663   33.478   22.666   31.299   24.580   38.006   12.495   37.263   13.005 0.7434578 18.03542 
1 1 1   11   10   38 o   21.921   7.2323 -16.9918   16.133 -24.8731   24.501 -10.9585   21.437   21.471   10.199   22.372   10.257 -0.9012375 14.46469 
1 1 1   11   10   39 o   31.629   8.5444   19.358   15.607   23.217   21.919   15.389   22.228   33.087   12.192   30.170   11.975 2.916584 17.08885 
1 1 1   11   10   40 o   45.465   9.0642   54.166   19.338   26.933   30.341   72.798   25.096   35.895   14.071   55.035   11.430 -19.13999 18.12841 
1 1 1   11   10   41 o   27.366   8.0677   5.7353   15.821   21.045   23.017  -7.9771   21.783   31.928   12.327   22.804   10.411 9.124266 16.13549 
1 1 1   11   10   42 o   43.557   7.9448   46.719   16.213   78.085   23.469   18.087   22.423   56.859   10.391   30.255   12.021 26.60349 15.88959 
1 1 1   11   10   43 o   23.971   7.5929  -1.4661   15.580  -7.1947   23.187   3.2490   21.037   23.189   10.645   24.753   10.830 -1.563129 15.18579 
1 1 1   11   10   44 o   31.047   8.4905   21.277   16.388   35.650   23.013   6.4882   23.344   36.051   12.584   26.043   11.402 10.00725 16.98096 
1 1 1   11   10   45 o   31.404   9.1224   22.368   18.567   28.836   29.680   18.209   23.799   33.410   13.632   29.398   12.126 4.011217 18.24477 
1 1 1   11   10   46 o   29.985   9.8745   6.9100   27.016  -4.4201   32.332   33.123   49.178   25.806   12.091   34.163   15.615 -8.356689 19.74910 
1 1 1   11   10   47 o   32.132   9.6092   29.602   22.403   18.492   32.791   39.327   30.680   29.582   13.203   34.682   13.965 -5.100231 19.21842 
1 1 1   11   10   48 o   31.128   9.3562   26.927   21.710   50.930   32.285   7.1158   29.331   36.412   14.438   25.844   11.904 10.56813 18.71250 
1 1 1   11   11    0 o  105.059   2.3544  228.345   14.395  228.345   14.395  228.345   14.395  105.059   3.3296  105.059   3.3296 0.000000 0.000000 
1 1 1   11   11    1 o  177.951   2.0531  653.189   15.069  657.696   21.398  648.754   21.224  178.560   2.9055  177.342   2.9017 1.217972 4.106285 
1 1 1   11   11    2 o  300.000   2.5543  1856.64   31.602  1844.18   44.336  1869.50   45.055  298.978   3.5955  301.022   3.6290 -2.044403 5.108499 
1 1 1   11   11    3 o  887.537   6.0608 16285.82  221.854 16329.93  315.051 16242.44  312.464  888.723   8.5951  886.352   8.5473 2.371582 12.12150 
1 1 1   11   11    4 o  170.206   2.1997  596.240   15.284  607.244   23.448  588.111   20.153  171.565   3.3137  168.848   2.8939 2.716537 4.399492 
1 1 1   11   11    5 o  251.119   2.7024  1281.92   27.666  1425.01   43.267  1182.96   35.984  262.791   3.9919  239.446   3.6436 23.34450 5.404742 
1 1 1   11   11    6 o  436.379   3.5454  3938.61   63.615  3820.05   92.866  4043.43   87.321  430.160   5.2343  442.598   4.7835 -12.43762 7.090795 
1 1 1   11   11    7 o  395.561   3.5563  3229.22   57.993  3198.39   80.620  3262.27   83.484  393.611   4.9661  397.511   5.0920 -3.900085 7.112657 
1 1 1   11   11    8 o  397.198   3.3308  3247.92   53.726  3307.02   83.996  3207.01   69.893  400.213   5.0886  394.182   4.2990 6.030914 6.661533 
1 1 1   11   11    9 o  307.210   2.8285  1936.23   35.154  2005.98   55.850  1890.47   45.241  311.743   4.3437  302.677   3.6240 9.067017 5.656939 
1 1 1   11   11   10 o  159.490   2.7335  524.046   17.534  520.851   22.401  529.101   28.172  158.876   3.4186  160.103   4.2663 -1.226700 5.467034 
1 1 1   11   11   11 o  132.061   3.5994  358.021   17.796  365.291   33.191  355.087   21.083  132.957   6.0526  131.165   3.8972 1.792343 7.198811 
1 1 1   11   11   12 o  254.664   2.9715  1322.09   28.736  1381.69   52.594  1296.73   34.311  258.653   4.9300  250.676   3.3186 7.977341 5.942916 
1 1 1   11   11   13 o   81.101   2.7920  135.597   9.3311  143.611   13.448  128.156   12.958   83.410   3.9091   78.792   3.9873 4.617363 5.583903 
1 1 1   11   11   14 o  199.841   2.4942  825.182   20.384  817.237   30.829  831.352   27.170  198.974   3.7566  200.708   3.2822 -1.734009 4.988480 
1 1 1   11   11   15 o  111.398   4.2517  257.770   19.435  283.988   27.254  230.641   27.723  117.206   5.6379  105.590   6.3658 11.61621 8.503442 
1 1 1   11   11   16 o  312.644   3.1913  2018.74   41.144  2042.29   58.844  1996.22   57.552  314.425   4.5375  310.864   4.4887 3.561371 6.382618 
1 1 1   11   11   17 o  245.250   2.6208  1242.71   25.638  1244.61   32.386  1239.52   41.959  245.544   3.1979  244.956   4.1531 0.5876465 5.241621 
1 1 1   11   11   18 o  141.499   3.0444  413.637   17.764  403.335   24.919  424.282   25.331  139.707   4.3247  143.292   4.2861 -3.584564 6.088807 
1 1 1   11   11   19 o   96.178   3.6212  200.074   12.821  212.337   15.314  171.343   23.441  101.398   3.6619   90.958   6.2484 10.43938 7.242420 
1 1 1   11   11   20 o  181.035   3.2152  685.957   21.513  696.986   25.428  658.187   40.349  183.724   3.3557  178.346   5.4853 5.377762 6.430381 
1 1 1   11   11   21 o  216.372   2.8038  964.593   24.787  947.254   32.745  987.858   37.931  214.130   3.7077  218.615   4.2068 -4.485077 5.607514 
1 1 1   11   11   22 o  144.611   3.0925  432.311   18.439  417.361   25.922  447.621   26.233  142.077   4.4237  147.146   4.3225 -5.069092 6.184950 
1 1 1   11   11   23 o  187.285   3.0454  716.178   22.301  697.414   27.303  753.792   38.655  183.722   3.6031  190.847   4.9108 -7.125092 6.090858 
1 1 1   11   11   24 o   98.739   3.7004  201.456   15.050  193.451   20.655  210.518   21.976   96.656   5.1811  100.822   5.2848 -4.165314 7.400868 
1 1 1   11   11   25 o   34.153   7.6702   22.844   12.693   34.351   18.311   12.199   17.611   39.792   10.856   28.515   10.839 11.27699 15.34031 
1 1 1   11   11   26 o  130.618   3.3906  350.387   18.164  328.214   24.184  379.082   27.512  125.929   4.6563  135.307   4.9299 -9.377663 6.781258 
1 1 1   11   11   27 o  279.071   3.3581  1612.84   38.649  1598.03   54.895  1627.41   54.423  277.790   4.7912  280.353   4.7067 -2.562805 6.716286 
1 1 1   11   11   28 o  228.613   3.5043  1079.66   32.629  1103.63   50.531  1062.53   42.732  230.701   5.3105  226.525   4.5738 4.176193 7.008654 
1 1 1   11   11   29 o   27.622   7.5174   11.689   10.637   13.306   11.936   5.4485   23.452   26.329   9.0698   28.916   11.991 -2.586985 15.03477 
1 1 1   11   11   30 o   31.593   9.2774   4.4201   17.761  -0.7656   20.633   19.253   34.896   25.345   10.910   37.840   15.009 -12.49484 18.55474 
1 1 1   11   11   31 o  135.277   3.7364  381.455   20.754  391.374   28.271  369.862   30.563  137.249   4.9941  133.305   5.5588 3.943558 7.472765 
1 1 1   11   11   32 o   28.126   7.7594   10.407   10.965   9.0649   12.300   15.603   24.202   23.959   9.0699   32.293   12.593 -8.333858 15.51885 
1 1 1   11   11   33 o   30.590   8.0471   9.8370   15.734   32.408   21.701 -15.1793   22.846   38.379   12.195   22.800   10.503 15.57929 16.09422 
1 1 1   11   11   34 o  114.575   4.6641  287.047   21.000  239.712   33.572  317.475   26.916  106.053   7.6751  123.096   5.3016 -17.04308 9.328134 
1 1 1   11   11   35 o   77.194   5.4263  127.968   17.111  147.030   24.128  108.684   24.269   83.224   7.0292   71.164   8.2685 12.05958 10.85252 
1 1 1   11   11   36 o   26.764   7.8280  -1.1304   16.304 -32.1401   25.014   21.771   21.497   20.712   9.9638   32.816   12.076 -12.10356 15.65601 
1 1 1   11   11   37 o   29.026   8.0451   4.4447   16.257 -21.6561   22.855   31.172   23.128   21.093   9.9699   36.959   12.629 -15.86628 16.09021 
1 1 1   11   11   38 o   25.528   7.8832   0.0887   15.595   1.1493   23.459  -0.7512   20.876   26.448   11.508   24.608   10.778 1.839781 15.76649 
1 1 1   11   11   39 o   23.694   7.8368 -15.8848   18.224 -12.0549   22.340 -23.5021   31.506   22.428   10.351   24.960   11.770 -2.532301 15.67364 
1 1 1   11   11   40 o   24.272   7.5948  -6.1540   15.797 -22.5836   22.275   10.471   22.407   20.296   9.6653   28.248   11.718 -7.951872 15.18965 
1 1 1   11   11   41 o   40.857   8.5009   41.300   16.018   57.323   22.982   26.163   22.338   48.004   11.712   33.710   12.325 14.29436 17.00175 
1 1 1   11   11   42 o   27.705   7.8612   6.2813   15.687 -18.3880   22.402   30.018   21.975   20.719   9.8162   34.691   12.282 -13.97194 15.72241 
1 1 1   11   11   43 o   54.198   7.6415   73.335   16.474   67.128   22.797   80.120   23.833   51.514   11.060   56.883   10.547 -5.368511 15.28308 
1 1 1   11   11   44 o   25.780   8.0365   5.1913   16.742   9.8809   23.606   0.4444   23.749   26.952   11.635   24.608   11.089 2.344374 16.07302 
1 1 1   11   11   45 o   33.009   9.1804   29.222   18.490   23.582   28.341   33.402   24.397   31.484   13.129   34.533   12.835 -3.048145 18.36083 
1 1 1   11   11   46 o   33.147   10.473   29.014   27.539   21.550   33.320   45.104   48.920   30.636   13.510   35.658   16.005 -5.022209 20.94515 
1 1 1   11   11   47 o   25.968   8.8547  -9.5104   27.262  -4.0090   32.818 -21.7589   48.969   25.287   11.951   26.649   13.069 -1.362167 17.70935 
1 1 1   11   11   48 o   25.031   8.5679  -8.5472   24.399   5.6673   44.896 -14.5048   29.065   27.854   13.387   22.207   10.697 5.646204 17.13578 
1 1 1   11   12    0 o  598.818   4.2476  7402.29  148.326  7402.29  148.326  7402.29  148.326  598.818   6.0070  598.818   6.0070 0.000000 0.000000 
1 1 1   11   12    1 o  227.771   2.2242  1070.30   20.895  1070.46   29.540  1070.14   29.559  227.788   3.1442  227.755   3.1467 0.3356934E-01 4.448351 
1 1 1   11   12    2 o  641.173   4.5082  8491.85  119.218  8502.74  168.932  8481.04  168.269  641.581   6.3840  640.765   6.3671 0.8162842 9.016397 
1 1 1   11   12    3 o  184.132   2.0714  699.267   15.729  689.659   22.008  709.298   22.487  182.840   2.9184  185.425   2.9404 -2.584534 4.142828 
1 1 1   11   12    4 o  198.444   2.2714  813.491   18.449  820.984   24.675  803.993   27.781  199.487   2.9990  197.400   3.4122 2.086533 4.542779 
1 1 1   11   12    5 o  694.436   5.2802  9880.24  147.027  9600.31  185.956 10347.05  240.138  681.622   6.6145  707.250   8.2323 -25.62781 10.56046 
1 1 1   11   12    6 o  544.723   4.2325  6139.20   94.646  6023.37  140.092  6236.46  128.372  539.941   6.2908  549.506   5.6641 -9.565002 8.464988 
1 1 1   11   12    7 o  360.901   3.1223  2691.72   46.204  2658.77   68.960  2718.56   62.241  358.875   4.6589  362.926   4.1581 -4.051239 6.244612 
1 1 1   11   12    8 o  249.065   2.4279  1282.42   24.283  1269.51   38.985  1290.60   31.039  248.021   3.8111  250.108   3.0090 -2.086838 4.855726 
1 1 1   11   12    9 o  275.093   2.9076  1572.43   30.439  1534.98   54.575  1589.33   36.673  272.650   4.8531  277.535   3.2037 -4.885406 5.815189 
1 1 1   11   12   10 o  233.142   2.7101  1124.38   23.888  1115.66   43.510  1128.14   28.581  232.452   4.5382  233.831   2.9635 -1.378616 5.420146 
1 1 1   11   12   11 o   76.893   4.2058  122.063   13.338   0.0000   0.0000  122.063   13.338  ?   ?    76.893   4.2058      ?      ? 
1 1 1   11   12   12 o  300.249   3.3568  1857.05   40.313  1881.19   65.767  1842.51   51.023  301.757   5.2843  298.742   4.1410 3.014252 6.713500 
1 1 1   11   12   13 o  137.920   2.3846  390.786   13.493  409.377   20.335  376.165   18.034  140.833   3.5009  135.008   3.2387 5.825043 4.769192 
1 1 1   11   12   14 o  141.380   3.0239  411.151   17.491  400.454   23.170  425.322   26.669  139.261   4.0339  143.497   4.5060 -4.236069 6.047864 
1 1 1   11   12   15 f  237.495   3.1192  1169.23   30.090  1189.86   39.470  1140.60   46.496  240.042   3.9867  234.949   4.7982 5.092712 6.238354 
1 1 1   11   12   16 o   98.483   3.0090  204.605   11.787  218.585   15.120  182.949   18.818  102.888   3.5630   94.077   4.8498 8.810974 6.017945 
1 1 1   11   12   17 o   67.831   3.7458   96.467   10.059  100.082   12.704   90.388   16.472   69.589   4.4261   66.072   6.0444 3.517677 7.491683 
1 1 1   11   12   18 o  153.512   2.9749  483.523   17.465  477.952   21.012  495.979   31.416  152.145   3.3484  154.879   4.9181 -2.733276 5.949724 
1 1 1   11   12   19 o  233.709   2.8633  1129.29   27.544  1142.38   37.899  1114.65   40.101  235.160   3.9075  232.258   4.1862 2.901245 5.726520 
1 1 1   11   12   20 o   75.343   5.5473  126.559   14.790  136.423   17.394  100.818   28.099   81.194   5.1942   69.492   9.8036 11.70198 11.09456 
1 1 1   11   12   21 o   62.183   4.1336   84.728   9.7152   93.705   11.986   67.536   16.587   67.325   4.3166   57.040   7.0507 10.28576 8.267154 
1 1 1   11   12   22 o   87.875   3.3803  159.081   11.950  156.699   15.244  162.878   19.246   87.056   4.2456   88.694   5.2613 -1.638016 6.760627 
1 1 1   11   12   23 o  201.468   3.1276  823.355   24.819  787.511   30.528  893.228   42.624  195.204   3.7918  207.731   4.9749 -12.52719 6.255236 
1 1 1   11   12   24 o  211.510   2.8948  920.848   25.011  896.149   32.958  954.382   38.404  208.216   3.8379  214.805   4.3347 -6.589264 5.789559 
1 1 1   11   12   25 o  121.837   3.3764  305.556   16.900  289.037   22.708  326.062   25.302  118.177   4.6589  125.496   4.8882 -7.318428 6.752794 
1 1 1   11   12   26 o  213.512   3.0362  933.681   26.403  886.672   34.355  1001.51   41.267  207.056   4.0229  219.968   4.5486 -12.91177 6.072354 
1 1 1   11   12   27 o  117.661   3.3483  290.020   15.795  302.059   20.338  271.724   25.071  120.837   4.0808  114.485   5.3096 6.351845 6.696599 
1 1 1   11   12   28 o   67.715   4.9606   91.994   12.395   87.840   14.432  103.669   24.196   65.059   5.3785   70.370   8.3368 -5.310287 9.921200 
1 1 1   11   12   29 o   91.784   4.8282  174.377   18.166  204.027   26.924  149.602   24.612   98.924   6.5989   84.643   7.0499 14.28072 9.656428 
1 1 1   11   12   30 o  112.585   3.5245  261.896   15.609  258.708   19.306  267.914   26.525  111.720   4.1898  113.451   5.6687 -1.730995 7.048977 
1 1 1   11   12   31 o   80.148   6.6715  131.471   19.940  125.057   23.380  148.583   38.191   77.163   7.3464   83.133   11.138 -5.970665 13.34299 
1 1 1   11   12   32 o   68.228   5.1942   93.583   12.682   89.150   14.519  107.856   26.053   65.341   5.3875   71.115   8.8823 -5.774818 10.38843 
1 1 1   11   12   33 o   21.890   6.8436  -4.3564   9.2904  -6.8057   10.222   7.2740   22.275   15.460   7.0859   28.320   11.710 -12.86078 13.68717 
1 1 1   11   12   34 o   34.169   7.3135   26.880   10.419   29.374   11.767   17.827   22.419   36.381   8.0545   31.958   12.210 4.422632 14.62698 
1 1 1   11   12   35 o   53.521   7.3216   64.548   15.712   45.467   21.660   85.736   22.824   44.172   11.702   62.871   8.8020 -18.69933 14.64314 
1 1 1   11   12   36 o   41.623   8.6752   39.825   16.020   53.001   24.511   30.000   21.165   46.955   12.453   36.291   12.082 10.66368 17.35049 
1 1 1   11   12   37 f   32.011   7.6791   11.172   15.206   45.719   22.290 -18.8995   20.797   43.682   12.002   20.339   9.5821 23.34267 15.35820 
1 1 1   11   12   38 o   52.982   7.7251   71.755   16.731   34.405   25.496  100.000   22.172   38.283   13.252   67.680   7.9429 -29.39701 15.45017 
1 1 1   11   12   39 o   68.504   9.4236  113.378   25.199   99.774   32.120  135.154   40.639   63.754   12.662   73.254   13.961 -9.499729 18.84715 
1 1 1   11   12   40 o   93.319   4.7051  188.412   17.944  224.194   26.155  156.596   24.663  101.959   6.2197   84.678   7.0618 17.28033 9.410296 
1 1 1   11   12   41 o   34.214   8.7960   27.889   16.016   29.480   23.652   26.541   21.766   34.908   12.694   33.521   12.179 1.386662 17.59192 
1 1 1   11   12   42 o   50.413   7.5631   62.608   16.003   96.228   23.600   33.993   21.773   64.531   8.8672   36.295   12.254 28.23552 15.12611 
1 1 1   11   12   43 o   28.612   8.5216   8.5266   17.980  -9.1616   24.139   30.569   26.947   22.924   10.643   34.299   13.312 -11.37493 17.04310 
1 1 1   11   12   44 o   46.909   9.2456   62.569   18.488   63.657   27.830   61.710   24.734   46.652   13.617   47.165   12.510 -0.5127106 18.49113 
1 1 1   11   12   45 o   26.093   8.7970 -18.5611   27.746   7.3800   33.821 -71.9571   48.523   28.421   12.975   23.764   11.883 4.657393 17.59410 
1 1 1   11   12   46 o   37.030   11.292   49.411   29.859   39.706   36.391   69.402   52.230   34.720   14.701   39.340   17.143 -4.620075 22.58352 
1 1 1   11   12   47 o   39.596   9.8238   63.558   25.887   0.3443   51.309   85.143   29.982   28.551   13.863   50.641   13.923 -22.08933 19.64765 
1 1 1   11   12   48 o   25.411   8.4998  -5.7789   24.494 -36.3928   35.013   23.565   34.279   21.506   10.642   29.315   13.256 -7.809023 16.99957 
1 1 1   11   13    0 f  282.289   2.4645  1644.56   40.565  1644.56   40.565  1644.56   40.565  282.289   3.4853  282.289   3.4853 0.000000 0.000000 
1 1 1   11   13    1 o  555.741   3.9874  6378.03   91.382  6336.46  127.974  6421.28  130.532  553.899   5.6017  557.583   5.6760 -3.683838 7.974736 
1 1 1   11   13    2 o  312.588   2.6127  2016.33   33.685  2013.22   47.548  2019.46   47.727  312.346   3.6909  312.829   3.6991 -0.4827881 5.225491 
1 1 1   11   13    3 o  239.182   2.4719  1169.49   23.879  1233.18   38.274  1128.90   30.554  244.452   3.7962  233.913   3.1670 10.53900 4.943799 
1 1 1   11   13    4 o  141.738   2.1166  414.395   12.292  413.754   16.460  415.204   18.481  141.618   2.8181  141.859   3.1588 -0.2408600 4.233136 
1 1 1   11   13    5 o  391.509   3.5018  3157.02   56.391  3266.52   83.425  3064.91   76.520  397.731   5.0856  385.288   4.8153 12.44345 7.003619 
1 1 1   11   13    6 o  142.193   2.4323  415.275   14.193  399.010   18.994  435.838   21.358  139.059   3.3117  145.328   3.5632 -6.269089 4.864532 
1 1 1   11   13    7 o  330.110   2.9499  2249.38   39.801  2249.96   60.489  2248.94   52.854  330.126   4.4425  330.094   3.8822 0.3189087E-01 5.899765 
1 1 1   11   13    8 o  122.040   2.2106  302.441   10.935  332.869   17.458  282.800   14.027  127.007   3.3328  117.075   2.9049 9.931870 4.421107 
1 1 1   11   13    9 o  412.205   3.2598  3522.48   54.259  3438.82   85.444  3579.01   70.238  408.030   5.0772  416.380   4.0900 -8.350098 6.519645 
1 1 1   11   13   10 o   83.351   2.7373  148.671   8.6361  129.678   15.147  157.819   10.512   79.244   4.6344   87.457   2.9143 -8.212540 5.474573 
1 1 1   11   13   11 o  369.268   3.4495  2833.53   48.280  2773.42   87.237  2860.06   57.967  366.308   5.7742  372.228   3.7758 -5.919861 6.899076 
1 1 1   11   13   12 o  125.879   3.1842  326.974   16.524  340.003   23.760  314.770   22.996  128.306   4.4899  123.452   4.5163 4.853951 6.368352 
1 1 1   11   13   13 o  102.812   2.9851  220.698   11.879  211.241   20.524  225.463   14.568  101.111   4.9215  104.513   3.3795 -3.402031 5.970152 
1 1 1   11   13   14 o  138.045   2.4563  392.446   13.840  399.972   21.245  386.897   18.242  139.182   3.7009  136.908   3.2306 2.274048 4.912523 
1 1 1   11   13   15 o  121.750   2.9019  304.478   13.787  311.587   23.840  300.905   16.899  122.778   4.7078  120.722   3.3940 2.056252 5.803704 
1 1 1   11   13   16 o   61.324   4.5436   79.110   11.163   83.608   14.426   72.397   17.622   63.568   5.5025   59.081   7.2319 4.486477 9.087196 
1 1 1   11   13   17 o  125.600   3.0978  333.092   14.867  345.838   18.108  306.735   26.039  129.418   3.3924  121.781   5.1842 7.637878 6.195553 
1 1 1   11   13   18 o  175.858   3.2803  631.051   23.485  591.368   30.467  689.153   36.866  169.158   4.3669  182.558   4.8961 -13.40010 6.560656 
1 1 1   11   13   19 o  230.333   2.8315  1095.03   26.807  1081.22   36.326  1111.55   39.723  228.758   3.8502  231.908   4.1529 -3.150772 5.663095 
1 1 1   11   13   20 o   96.267   5.1726  176.906   16.462  167.428   18.207  219.351   38.529   89.961   4.9071  102.574   9.1073 -12.61228 10.34520 
1 1 1   11   13   21 o  261.652   4.1311  1427.17   33.017  1431.35   36.148  1406.11   81.107  263.245   3.3293  260.058   7.5617 3.186859 8.262198 
1 1 1   11   13   22 o   60.617   4.5178   75.529   10.853   73.735   13.509   78.793   18.225   59.660   5.4900   61.574   7.1766 -1.913486 9.035682 
1 1 1   11   13   23 o  123.325   3.4267  314.783   17.429  312.458   24.492  317.168   24.808  122.865   4.8332  123.785   4.8591 -0.9201202 6.853481 
1 1 1   11   13   24 o   79.194   3.6432  125.280   11.283  116.275   13.697  144.296   19.905   74.969   4.4296   83.420   5.7852 -8.451859 7.286301 
1 1 1   11   13   25 o  147.985   2.9003  455.647   16.963  462.635   21.242  443.348   28.181  149.625   3.4421  146.346   4.6689 3.278625 5.800553 
1 1 1   11   13   26 o  190.117   3.0458  740.954   23.694  696.115   31.244  801.642   36.349  183.438   4.1296  196.797   4.4782 -13.35919 6.091626 
1 1 1   11   13   27 o   72.582   5.5761  111.998   16.385   94.906   24.302  126.243   22.186   67.306   8.7542   77.857   6.9089 -10.55075 11.15211 
1 1 1   11   13   28 o   27.307   7.7447  -5.2801   15.622 -32.6448   21.682   24.267   22.530   19.123   9.2185   35.492   12.448 -16.36940 15.48947 
1 1 1   11   13   29 o   80.256   4.1629  123.837   12.926  106.754   15.394  164.676   23.802   71.676   5.2073   88.836   6.4962 -17.15942 8.325717 
1 1 1   11   13   30 o   99.927   4.0275  223.044   15.279  259.832   19.326  161.711   24.953  111.944   4.1857   87.909   6.8821 24.03490 8.055050 
1 1 1   11   13   31 o   74.353   9.8518  124.016   26.737  122.784   31.670  127.074   49.887   75.581   10.159   73.125   16.882 2.456032 19.70359 
1 1 1   11   13   32 o   48.348   6.9045   57.848   11.505   64.105   13.245   38.619   23.222   55.309   5.8064   41.388   12.529 13.92078 13.80897 
1 1 1   11   13   33 o   48.819   6.6267   54.713   11.153   56.881   12.854   48.112   22.431   51.983   5.9952   45.654   11.820 6.328499 13.25345 
1 1 1   11   13   34 o   74.855   4.5746  112.259   12.757  104.684   14.888  133.176   24.741   70.699   5.1059   79.010   7.5921 -8.311317 9.149281 
1 1 1   11   13   35 o   30.623   8.4879   15.755   15.579   16.466   21.027   14.889   23.196   30.530   11.784   30.716   12.220 -0.1861839 16.97586 
1 1 1   11   13   36 o   89.291   4.7546  171.886   14.912  173.112   17.155  168.095   30.164   90.824   4.5796   87.758   8.3337 3.065773 9.509135 
1 1 1   11   13   37 o   23.631   6.7220   7.6525   9.8248   13.178   10.844 -17.6781   23.216   25.243   8.6474   22.019   10.294 3.224173 13.44398 
1 1 1   11   13   38 o   75.900   5.6017  126.684   17.496  118.842   24.945  134.276   24.545   73.395   8.2404   78.404   7.5902 -5.009186 11.20338 
1 1 1   11   13   39 o   29.652   8.8351   0.5546   18.801   31.622   31.091 -17.3560   23.607   37.315   14.349   21.990   10.312 15.32433 17.67024 
1 1 1   11   13   40 o   49.092   8.1441   59.474   16.359   72.628   23.541   47.190   22.750   54.947   10.773   43.238   12.217 11.70930 16.28824 
1 1 1   11   13   41 o   25.054   7.7705  -0.2139   15.782   12.650   22.985 -11.6886   21.709   28.466   11.843   21.642   10.063 6.824034 15.54095 
1 1 1   11   13   42 o   25.833   7.8686   6.5367   15.211   5.2681   21.407   7.8303   21.618   25.417   11.026   26.248   11.229 -0.8309631 15.73723 
1 1 1   11   13   43 o   26.149   8.3181   2.6805   18.780   3.4822   27.270   1.9573   25.900   26.545   11.930   25.753   11.595 0.7920227 16.63615 
1 1 1   11   13   44 o   32.494   9.1497   23.073   18.816   44.859   29.320   7.8165   24.535   38.450   14.110   26.538   11.652 11.91171 18.29940 
1 1 1   11   13   45 o   29.922   9.5806   16.213   24.444   2.4593   48.244   20.963   28.352   29.847   14.216   29.997   12.847 -0.1506939 19.16125 
1 1 1   11   13   46 o   25.148   8.3135  -4.6479   22.142 -25.7959   33.688   11.437   29.379   22.866   11.133   27.431   12.350 -4.564445 16.62708 
1 1 1   11   13   47 o   24.749   8.2048   0.8560   20.872  -3.7320   33.657   3.7228   26.605   24.969   11.888   24.529   11.312 0.4401951 16.40969 
1 1 1   11   14    0 o  590.299   4.1955  7194.91  144.423  7194.91  144.423  7194.91  144.423  590.299   5.9333  590.299   5.9333 0.000000 0.000000 
1 1 1   11   14    1 o  276.364   2.4373  1574.82   27.763  1543.29   38.433  1609.23   40.149  273.476   3.4074  279.253   3.4859 -5.777435 4.874611 
1 1 1   11   14    2 o  345.419   2.7820  2462.13   39.626  2438.83   55.400  2486.54   56.702  343.748   3.9075  347.091   3.9608 -3.342499 5.563907 
1 1 1   11   14    3 o  148.685   2.1315  455.724   12.968  452.904   17.259  459.381   19.651  148.162   2.8243  149.208   3.1932 -1.046371 4.262990 
1 1 1   11   14    4 o  207.847   2.3564  890.974   20.016  895.103   30.464  887.838   26.551  208.262   3.5466  207.433   3.1035 0.8291779 4.712766 
1 1 1   11   14    5 o  511.154   4.0565  5357.51   83.432  5583.27  134.840  5217.46  106.204  519.711   6.2906  502.598   5.1233 17.11325 8.112974 
1 1 1   11   14    6 o  217.262   2.4241  972.116   21.534  989.169   32.804  959.202   28.547  218.923   3.6330  215.600   3.2103 3.322495 4.848145 
1 1 1   11   14    7 o  422.610   3.3176  3696.95   56.378  3648.38   90.107  3728.20   72.272  420.257   5.1985  424.962   4.1234 -4.705627 6.635239 
1 1 1   11   14    8 f  211.665   2.2980  928.394   19.652  905.015   30.886  944.297   25.473  209.402   3.5761  213.929   2.8870 -4.527130 4.596024 
1 1 1   11   14    9 o   94.957   2.2618  183.569   8.6367  197.068   14.068  175.404   10.941   97.714   3.4907   92.199   2.8772 5.514992 4.523645 
1 1 1   11   14   10 o  236.386   2.7272  1146.98   24.094  1169.28   45.060  1138.06   28.512  237.932   4.5917  234.841   2.9437 3.090347 5.454307 
1 1 1   11   14   11 o  118.474   2.2673  289.129   10.903  292.829   17.052  286.571   14.181  119.105   3.4712  117.842   2.9177 1.263092 4.534527 
1 1 1   11   14   12 o  235.347   2.8248  1107.52   23.930  1218.32   48.379  1071.63   27.535  242.819   4.8307  227.875   2.9297 14.94420 5.649662 
1 1 1   11   14   13 o  118.947   2.8386  293.943   13.151  286.960   22.560  297.537   16.186  117.840   4.6417  120.055   3.2688 -2.214989 5.677194 
1 1 1   11   14   14 o  275.908   2.5514  1571.98   29.033  1584.11   41.301  1560.12   40.820  276.960   3.6156  274.857   3.6008 2.103058 5.102792 
1 1 1   11   14   15 o  307.990   2.7155  1958.70   34.485  1933.96   48.101  1984.87   49.467  305.993   3.8113  309.987   3.8690 -3.993866 5.431002 
1 1 1   11   14   16 o   63.092   3.3854   84.373   8.5770   70.239   12.991   95.293   11.419   58.268   5.4058   67.915   4.0767 -9.647774 6.770710 
1 1 1   11   14   17 o  215.923   2.5138  967.502   21.722  982.544   27.680  943.388   35.047  218.158   3.0763  213.689   3.9765 4.469467 5.027547 
1 1 1   11   14   18 o  158.141   2.9301  509.978   17.630  499.367   21.075  534.713   32.177  155.503   3.2860  160.779   4.8523 -5.276718 5.860231 
1 1 1   11   14   19 o  109.826   2.9727  251.631   13.079  259.631   16.772  239.214   20.894  112.107   3.6273  107.545   4.7106 4.562401 5.945351 
1 1 1   11   14   20 o   89.299   3.5412  168.810   12.746  194.754   17.268  137.758   18.892   97.050   4.3141   81.548   5.6169 15.50278 7.082430 
1 1 1   11   14   21 o   85.955   4.9407  161.881   13.797  167.671   15.505  139.858   30.238   90.052   4.1745   81.858   8.9563 8.193077 9.881385 
1 1 1   11   14   22 o  121.584   4.1556  305.245   20.520  299.482   26.667  313.610   32.131  120.236   5.3774  122.932   6.3372 -2.695480 8.311234 
1 1 1   11   14   23 o  208.049   3.0774  862.718   23.090  830.208   26.566  963.125   46.687  200.475   3.2129  215.624   5.2497 -15.14925 6.154891 
1 1 1   11   14   24 o  275.585   3.2147  1570.50   36.508  1543.23   50.429  1600.53   52.923  273.088   4.4772  278.082   4.6143 -4.993713 6.429408 
1 1 1   11   14   25 o  104.712   3.3529  223.438   13.555  217.072   16.381  237.262   24.141  102.455   3.8766  106.968   5.4718 -4.512688 6.705890 
1 1 1   11   14   26 f  109.963   3.9671  252.168   17.689  258.103   23.156  243.851   27.412  111.592   5.0312  108.334   6.1349 3.257446 7.934121 
1 1 1   11   14   27 o   27.598   6.6243   14.857   10.228   23.850   11.625 -15.9536   21.518   33.107   8.4771   22.088   10.182 11.01929 13.24859 
1 1 1   11   14   28 o  218.186   4.6923  987.569   42.226   0.0000   0.0000  987.569   42.226  ?   ?   218.186   4.6923      ?      ? 
1 1 1   11   14   29 o   63.834   5.0896   82.410   12.336   78.158   14.635   92.845   22.927   61.258   5.7924   66.410   8.3705 -5.151772 10.17928 
1 1 1   11   14   30 o  171.216   3.7751  613.637   26.432  589.079   39.595  633.376   35.500  167.980   5.7151  174.452   4.9338 -6.472229 7.550125 
1 1 1   11   14   31 o   41.407   8.7280   42.553   13.368   46.880   13.928  -8.0341   47.625   47.138   7.1640   35.676   15.918 11.46176 17.45597 
1 1 1   11   14   32 o   24.424   7.0333   7.3344   9.8060   9.5324   10.953  -1.5460   22.015   23.353   8.6158   25.494   11.119 -2.141787 14.06652 
1 1 1   11   14   33 o  113.427   4.0932  269.532   19.060  260.174   25.570  281.233   28.592  111.302   5.5700  115.551   5.9993 -4.249672 8.186363 
1 1 1   11   14   34 o   44.740   6.9038   51.072   11.384   58.351   13.259   30.659   22.204   52.499   6.1233   36.981   12.376 15.51809 13.80759 
1 1 1   11   14   35 o   82.112   5.2232  143.816   17.376  110.439   23.441  184.529   25.889   71.350   7.9655   92.874   6.7587 -21.52319 10.44644 
1 1 1   11   14   36 o   75.650   5.0237  120.604   13.417  118.264   15.371  128.092   27.496   74.939   4.9732   76.361   8.7303 -1.421555 10.04744 
1 1 1   11   14   37 o   24.905   7.0961   9.2042   10.002   11.186   11.219   1.5276   22.080   24.090   8.7452   25.720   11.178 -1.630598 14.19220 
1 1 1   11   14   38 o   19.775   6.4552  -6.9324   10.344  -6.5607   11.782  -8.1830   21.609   16.685   7.6328   22.866   10.412 -6.180616 12.91039 
1 1 1   11   14   39 o   32.519   6.8289   27.742   10.847   35.692   12.337   0.6493   22.774   39.616   7.8277   25.422   11.192 14.19483 13.65788 
1 1 1   11   14   40 o   27.728   8.2808   10.460   10.902   10.331   11.459   11.691   35.395   23.357   8.7737   32.100   14.047 -8.742483 16.56159 
1 1 1   11   14   41 o   42.639   9.0350   48.583   17.106   50.620   25.157   46.832   23.329   43.282   13.027   41.997   12.523 1.284859 18.07010 
1 1 1   11   14   42 o   37.595   8.7599   35.523   18.093   62.309   25.574   8.6775   25.602   47.636   12.760   27.555   12.005 20.08116 17.51979 
1 1 1   11   14   43 f   57.280   8.4672   86.662   19.220   80.025   25.408   95.539   29.384   55.143   11.542   59.417   12.392 -4.274593 16.93435 
1 1 1   11   14   44 o   29.376   8.8061   17.998   18.306   20.448   28.288   16.233   24.012   30.342   12.909   28.410   11.981 1.932037 17.61216 
1 1 1   11   14   45 o   33.136   9.0870   27.733   21.099  -9.8967   32.130   56.261   27.976   24.702   11.718   41.571   13.891 -16.86968 18.17395 
1 1 1   11   14   46 o   28.875   9.5255   9.7391   23.946   42.255   47.584  -1.2884   27.711   33.550   15.345   24.199   11.291 9.351068 19.05091 
1 1 1   11   14   47 o   26.641   8.6826   10.698   22.090   12.377   32.137   9.1942   30.415   27.063   12.463   26.218   12.092 0.8451557 17.36528 
1 1 1   11   15    0 f   78.063   2.1408  126.270   9.7146  126.270   9.7146  126.270   9.7146   78.063   3.0276   78.063   3.0276 0.000000 0.000000 
1 1 1   11   15    1 o  418.295   3.1792  3612.38   54.842  3587.03   76.810  3638.75   78.328  416.802   4.4681  419.789   4.5240 -2.987396 6.358464 
1 1 1   11   15    2 o  247.816   2.3095  1267.15   23.603  1256.24   33.098  1278.43   33.669  246.732   3.2524  248.900   3.2798 -2.168304 4.618986 
1 1 1   11   15    3 o  149.665   2.0192  461.838   12.455  454.106   17.231  470.298   18.024  148.355   2.8160  150.975   2.8946 -2.619553 4.038400 
1 1 1   11   15    4 o  221.158   2.5394  1002.82   23.052  1075.47   34.729  945.587   30.820  228.267   3.6887  214.049   3.4911 14.21780 5.078824 
1 1 1   11   15    5 o  152.390   2.1275  479.355   13.040  478.430   20.886  479.947   16.694  152.259   3.3259  152.520   2.6538 -0.2613831 4.254942 
1 1 1   11   15    6 o  291.757   2.7407  1760.05   32.807  1728.28   48.725  1786.40   44.371  289.328   4.0832  294.186   3.6569 -4.858093 5.481342 
1 1 1   11   15    7 o  396.058   3.1740  3243.63   50.405  3222.16   81.312  3257.03   64.237  394.923   4.9920  397.192   3.9212 -2.268799 6.347917 
1 1 1   11   15    8 o  234.257   2.4689  1136.66   23.762  1074.90   34.552  1192.08   32.730  228.187   3.6713  240.327   3.3020 -12.14066 4.937822 
1 1 1   11   15    9 o  354.835   3.3649  2609.63   45.012  2580.43   82.312  2622.09   53.763  353.282   5.6491  356.388   3.6576 -3.106018 6.729774 
1 1 1   11   15   10 f  269.554   2.8647  1514.57   29.454  1463.18   52.441  1538.25   35.600  266.109   4.7779  272.999   3.1617 -6.890106 5.729333 
1 1 1   11   15   11 o  316.542   2.8696  2074.90   37.318  2000.14   54.673  2140.11   51.063  311.164   4.2601  321.919   3.8459 -10.75436 5.739244 
1 1 1   11   15   12 o  237.061   2.7824  1176.43   25.156  1119.40   44.619  1203.00   30.458  232.716   4.6486  241.407   3.0591 -8.690735 5.564852 
1 1 1   11   15   13 o  191.786   2.7628  766.997   20.941  734.031   34.639  785.986   26.289  188.459   4.4563  195.113   3.2668 -6.653900 5.525506 
1 1 1   11   15   14 o  322.075   2.7513  2138.19   36.486  2217.04   53.509  2069.68   49.881  327.603   3.9602  316.547   3.8206 11.05603 5.502695 
1 1 1   11   15   15 o   77.862   2.7483  125.260   8.8207  124.317   12.662  126.149   12.295   77.575   3.9575   78.149   3.8144 -0.5742188 5.496519 
1 1 1   11   15   16 o  208.679   2.5183  898.324   21.437  906.676   32.908  892.168   28.254  209.497   3.8085  207.860   3.2957 1.637299 5.036507 
1 1 1   11   15   17 o  160.032   3.2334  524.841   21.128  498.196   27.691  561.959   32.683  155.238   4.3249  164.826   4.8077 -9.587585 6.466765 
1 1 1   11   15   18 o  176.719   2.5749  642.639   18.402  632.615   23.706  657.838   29.191  175.021   3.2840  178.417   3.9669 -3.396103 5.149813 
1 1 1   11   15   19 o  215.379   2.8068  960.006   24.886  981.321   34.390  936.572   36.059  217.909   3.8264  212.848   4.1075 5.060760 5.613631 
1 1 1   11   15   20 o  144.773   2.6207  428.741   15.096  417.019   18.876  449.543   25.147  142.092   3.2209  147.454   4.1349 -5.362320 5.241334 
1 1 1   11   15   21 o  185.747   3.6145  720.696   27.072  746.595   35.154  682.955   42.437  189.971   4.4867  181.524   5.6682 8.447708 7.229040 
1 1 1   11   15   22 o  162.260   3.1204  540.590   20.306  527.702   25.718  561.927   33.091  159.767   3.9028  164.752   4.8698 -4.985626 6.240712 
1 1 1   11   15   23 o   85.848   3.5531  155.713   11.856  162.460   14.691  143.109   20.078   88.636   4.0186   83.061   5.8607 5.574768 7.106130 
1 1 1   11   15   24 o  114.706   3.0848  269.071   13.986  261.395   17.331  283.404   23.683  112.441   3.7371  116.971   4.9089 -4.529625 6.169585 
1 1 1   11   15   25 o   73.907   4.0853  112.461   11.659  110.797   14.138  115.996   20.613   73.141   4.6865   74.672   6.6929 -1.530144 8.170544 
1 1 1   11   15   26 o  103.717   4.5828  229.809   18.950  197.008   29.608  252.570   24.664   97.136   7.3902  110.298   5.4217 -13.16241 9.165664 
1 1 1   11   15   27 o  100.677   3.9487  203.978   15.508  191.099   18.803  231.367   27.421   95.980   4.7499  105.373   6.3094 -9.393036 7.897487 
1 1 1   11   15   28 o  108.374   3.8491  233.109   15.854  217.052   18.757  273.275   29.668  102.296   4.4458  114.453   6.2848 -12.15729 7.698291 
1 1 1   11   15   29 o  117.276   4.2161  284.292   20.085  271.391   25.983  303.450   31.662  114.106   5.5209  120.445   6.3736 -6.338776 8.432269 
1 1 1   11   15   30 o   68.719   4.8946   92.511   13.273   77.113   16.147  124.594   23.308   60.604   6.4600   76.833   7.3550 -16.22885 9.789165 
1 1 1   11   15   31 o   48.946   7.9615   54.322   15.706   52.033   21.407   56.991   23.115   47.877   11.063   50.014   11.452 -2.137222 15.92309 
1 1 1   11   15   32 o   41.121   10.102   28.330   11.352   27.466   11.629   45.838   52.332   35.139   8.1774   47.103   18.476 -11.96439 20.20433 
1 1 1   11   15   33 o  154.590   4.2846  501.532   27.061  413.290   36.914  604.042   39.787  139.764   6.4037  169.417   5.6941 -29.65208 8.569153 
1 1 1   11   15   34 o   65.863   4.8440   78.437   11.907   61.031   13.720  131.572   23.971   53.575   6.2089   78.152   7.4369 -24.57692 9.688038 
1 1 1   11   15   35 o   55.706   7.2417   94.396   13.471  115.498   15.553   31.026   26.953   74.024   5.0942   37.388   13.558 36.63644 14.48334 
1 1 1   11   15   36 o   21.273   6.6762  -0.6500   10.125   1.5919   11.410  -8.9553   21.961   19.435   8.2307   23.112   10.514 -3.677841 13.35246 
1 1 1   11   15   37 o   53.776   8.5383   73.874   13.590   75.682   14.603   62.172   37.148   59.498   5.9507   48.055   16.006 11.44308 17.07657 
1 1 1   11   15   38 f   19.570   6.3896  -8.4279   11.555  -0.0877   13.052 -38.6654   24.852   19.772   8.5931   19.368   9.4585 0.4036961 12.77911 
1 1 1   11   15   39 o   30.383   7.7302   17.180   10.858   13.266   12.406   29.998   22.450   25.440   9.2023   35.326   12.423 -9.885532 15.46037 
1 1 1   11   15   40 o   35.439   8.8558   27.192   20.904   55.937   25.620 -30.0564   36.156   45.764   12.977   25.113   12.054 20.65101 17.71161 
1 1 1   11   15   41 o   54.078   5.8249   59.482   11.626   51.177   13.371   85.218   23.538   48.088   6.7415   60.068   9.5010 -11.97974 11.64975 
1 1 1   11   15   42 o   32.577   8.1854   21.147   11.180   16.349   12.317   43.581   26.633   26.467   9.2082   38.686   13.536 -12.21900 16.37079 
1 1 1   11   15   43 o   22.830   7.5525 -10.1279   17.425 -12.8228   22.812  -6.3531   26.999   21.351   10.052   24.308   11.275 -2.957106 15.10492 
1 1 1   11   15   44 o   38.352   8.5502   41.594   13.235   41.395   14.343   42.740   34.342   40.749   8.7924   35.956   14.667 4.792099 17.10035 
1 1 1   11   15   45 o   20.195   6.7825  -4.4774   11.354  -2.2172   12.210 -18.9253   30.870   17.547   7.9253   22.843   11.009 -5.296114 13.56505 
1 1 1   11   15   46 o   29.023   9.5424   18.087   27.383   5.8684   49.039   23.624   33.008   28.514   13.775   29.531   13.209 -1.017063 19.08473 
1 1 1   11   16    0 o  406.913   3.1158  3418.18   73.932  3418.18   73.932  3418.18   73.932  406.913   4.4064  406.913   4.4064 0.000000 0.000000 
1 1 1   11   16    1 o  327.949   2.6897  2220.23   36.380  2214.70   51.290  2225.83   51.610  327.539   3.7967  328.360   3.8108 -0.8209839 5.379319 
1 1 1   11   16    2 o  266.242   2.5753  1459.21   27.916  1438.71   36.539  1487.95   43.268  264.022   3.3554  268.462   3.9077 -4.440247 5.150620 
1 1 1   11   16    3 o   67.980   2.5876   93.332   7.1713  115.104   11.060   77.537   9.4200   74.674   3.5909   61.286   3.7267 13.38766 5.175215 
1 1 1   11   16    4 o  185.205   2.1874  704.863   16.219  720.308   26.455  695.562   20.529  186.808   3.4336  183.602   2.7110 3.205612 4.374830 
1 1 1   11   16    5 o  119.661   2.2440  295.009   11.028  300.941   16.437  290.152   14.873  120.750   3.3004  118.573   3.0413 2.176605 4.487969 
1 1 1   11   16    6 o  123.183   2.2342  313.998   11.302  303.254   16.612  323.257   15.421  121.211   3.3228  125.155   2.9875 -3.944427 4.468392 
1 1 1   11   16    7 o  336.350   2.8583  2338.11   38.640  2327.76   61.974  2344.69   49.423  335.688   4.4762  337.011   3.5557 -1.322815 5.716539 
1 1 1   11   16    8 o  135.877   2.1532  382.317   11.814  374.765   18.625  387.401   15.282  134.739   3.3515  137.016   2.7043 -2.276627 4.306489 
1 1 1   11   16    9 o  251.968   2.7815  1315.26   26.468  1301.30   48.263  1321.27   31.652  250.931   4.6633  253.006   3.0333 -2.074692 5.563000 
1 1 1   11   16   10 o  126.732   2.5866  312.081   13.095  253.479   16.256  420.410   22.101  110.792   3.5574  142.672   3.7559 -31.88058 5.173177 
1 1 1   11   16   11 o   76.187   2.4832  116.886   7.6408  134.266   12.412  106.281   9.6957   80.627   3.7324   71.747   3.2765 8.880219 4.966496 
1 1 1   11   16   12 o  197.265   2.6474  788.039   19.132  837.846   37.338  770.306   22.280  201.342   4.4963  193.187   2.7962 8.155182 5.294811 
1 1 1   11   16   13 o   58.784   3.8791   72.443   8.5848   69.149   15.588   73.877   10.285   57.771   6.5421   59.796   4.1703 -2.025173 7.758228 
1 1 1   11   16   14 o  105.237   2.3942  228.737   10.390  223.589   14.723  233.843   14.663  104.055   3.4307  106.418   3.3407 -2.362953 4.788490 
1 1 1   11   16   15 o   80.142   2.6608  132.665   8.7709  146.183   12.573  119.848   12.242   84.123   3.6236   76.160   3.8973 7.963516 5.321563 
1 1 1   11   16   16 o  241.309   2.4471  1202.73   24.356  1206.04   34.452  1199.43   34.436  241.641   3.4568  240.977   3.4647 0.6647644 4.894294 
1 1 1   11   16   17 o  198.371   2.5495  808.891   20.724  779.504   27.566  847.091   31.429  194.263   3.4405  202.478   3.7634 -8.214645 5.099057 
1 1 1   11   16   18 o  146.381   2.6080  439.808   15.376  429.453   19.618  456.299   24.758  144.192   3.2988  148.570   4.0404 -4.378677 5.215964 
1 1 1   11   16   19 o  155.907   2.9756  502.236   19.117  473.261   26.675  532.835   27.412  151.280   4.2752  160.533   4.1401 -9.253235 5.951286 
1 1 1   11   16   20 o   63.965   3.9709   84.991   10.146   85.582   12.864   84.017   16.503   64.301   4.8504   63.629   6.2886 0.6713371 7.941844 
1 1 1   11   16   21 o  197.387   3.0143  805.024   23.517  802.925   29.317  808.814   39.386  197.110   3.6062  197.664   4.8311 -0.5547638 6.028657 
1 1 1   11   16   22 o  103.115   4.3202  221.641   14.027  222.182   15.477  219.158   33.184  103.681   3.6194  102.549   7.8458 1.132431 8.640376 
1 1 1   11   16   23 o  185.279   2.9092  709.155   22.106  701.209   29.652  719.097   33.168  184.140   3.9043  186.417   4.3138 -2.276535 5.818320 
1 1 1   11   16   24 o  112.785   3.1347  254.929   13.702  240.088   16.517  287.672   24.535  107.754   3.7166  117.815   5.0491 -10.06155 6.269492 
1 1 1   11   16   25 o  111.636   3.2195  258.618   14.088  259.530   17.420  256.895   23.952  112.002   3.7709  111.269   5.2193 0.7334061 6.438976 
1 1 1   11   16   26 o   72.275   5.0613  109.428   15.000   95.365   21.088  123.830   21.340   67.506   7.5740   77.043   6.7158 -9.537636 10.12261 
1 1 1   11   16   27 f  131.271   3.4847  356.753   17.630  354.723   21.389  361.055   31.138  130.853   3.9631  131.688   5.7329 -0.8350220 6.969422 
1 1 1   11   16   28 o  118.977   3.2980  295.466   15.446  298.947   19.235  289.145   25.917  120.100   3.8832  117.854   5.3319 2.245605 6.596072 
1 1 1   11   16   29 o  107.224   3.5539  239.531   14.698  239.349   17.871  239.912   25.842  107.363   4.0357  107.086   5.8510 0.2772293 7.107860 
1 1 1   11   16   30 o  152.175   4.1986  481.926   26.074  392.350   35.325  589.149   38.648  136.614   6.2692  167.736   5.5864 -31.12125 8.397107 
1 1 1   11   16   31 o   73.000   6.3263  120.921   17.466   80.152   25.331  157.870   24.115   59.651   10.688   86.349   6.7711 -26.69763 12.65262 
1 1 1   11   16   32 o   49.309   8.7252   51.929   12.587   51.065   13.342   58.915   37.936   49.127   6.5849   49.491   16.160 -0.3644295 17.45033 
1 1 1   11   16   33 o   31.367   7.2048   22.695   11.000   28.327   12.921   7.8686   20.965   35.326   8.8787   27.409   11.349 7.916954 14.40962 
1 1 1   11   16   34 o   22.113   6.6625   3.3117   9.9757   9.1591   10.841 -29.0041   25.485   22.841   8.5428   21.385   10.226 1.456402 13.32500 
1 1 1   11   16   35 o   25.618   6.2415   11.172   10.625   24.474   11.685 -52.3818   25.540   32.841   8.5448   18.394   9.1002 14.44617 12.48302 
1 1 1   11   16   36 o   29.926   8.3903   13.740   15.936   24.371   22.449   2.9392   22.626   33.566   12.342   26.285   11.369 7.280455 16.78057 
1 1 1   11   16   37 o   49.942   6.4141   48.934   12.104   36.064   14.269   81.950   22.854   39.486   8.9663   60.398   9.1744 -20.91224 12.82826 
1 1 1   11   16   38 o   60.760   7.4559   85.508   18.092   69.972   24.002  105.952   27.533   53.661   11.206   67.858   9.8377 -14.19677 14.91175 
1 1 1   11   16   39 o   51.290   7.3424   64.807   12.714   66.230   14.426   59.857   26.902   55.153   6.3420   47.427   13.245 7.725945 14.68486 
1 1 1   11   16   40 o   38.832   8.2794   43.195   12.906   46.782   13.337  -9.6638   51.195   45.900   7.0448   31.763   14.985 14.13642 16.55874 
1 1 1   11   16   41 o   25.307   7.4091   10.666   10.803   11.709   11.923   5.8902   25.524   23.869   8.9529   26.744   11.808 -2.874582 14.81811 
1 1 1   11   16   42 o   27.048   7.4972   15.967   11.448   19.282   12.624   0.6221   27.159   28.222   9.3274   25.874   11.740 2.347229 14.99446 
1 1 1   11   16   43 o   21.927   7.1143  -5.6778   11.076 -10.3320   12.264   14.918   25.799   15.494   7.3174   28.359   12.203 -12.86453 14.22867 
1 1 1   11   16   44 o   43.779   9.0170   39.378   14.815   24.554   16.405  104.889   34.488   30.335   10.623   57.223   14.573 -26.88744 18.03398 
1 1 1   11   16   45 o   19.114   6.5882 -12.4754   12.142 -11.9333   13.309 -15.1666   29.651   15.609   7.4437   22.618   10.872 -7.008562 13.17638 
1 1 1   11   16   46 o   40.582   9.0028   49.954   14.902   45.978   16.665   65.820   33.291   40.867   9.9745   40.298   14.990 0.5696869 18.00563 
1 1 1   11   17    0 o   39.836   3.1047   33.927   6.9905   33.927   6.9905   33.927   6.9905   39.836   4.3908   39.836   4.3908 0.000000 0.000000 
1 1 1   11   17    1 o   93.782   2.0343  181.459   7.8675  179.048   11.017  183.969   11.239   93.146   2.8676   94.417   2.8862 -1.270790 4.068577 
1 1 1   11   17    2 o  129.080   2.1693  341.308   11.421  360.536   17.708  327.612   14.945  132.163   3.2485  125.996   2.8758 6.166603 4.338591 
1 1 1   11   17    3 o  133.306   2.2594  365.891   12.401  381.960   18.192  351.940   16.951  136.032   3.2424  130.580   3.1473 5.451584 4.518744 
1 1 1   11   17    4 o   86.763   2.2484  157.890   7.8211  143.743   12.307  167.475   10.130   83.440   3.5761   90.087   2.7263 -6.646927 4.496814 
1 1 1   11   17    5 o  199.371   2.4683  820.539   20.295  829.652   28.954  811.737   28.456  200.459   3.5020  198.284   3.4795 2.174683 4.936677 
1 1 1   11   17    6 o  215.899   2.4152  960.653   21.338  976.044   32.379  948.838   28.370  217.410   3.6109  214.388   3.2085 3.021561 4.830422 
1 1 1   11   17    7 o  124.054   2.1309  321.035   10.674  299.916   16.596  335.934   13.939  120.523   3.3386  127.584   2.6490 -7.060280 4.261861 
1 1 1   11   17    8 o   64.942   2.5519   86.293   6.6447   90.475   10.858   83.789   8.4018   66.179   3.9779   63.706   3.1976 2.472511 5.103751 
1 1 1   11   17    9 o  189.975   2.5936  752.216   19.365  722.359   32.458  768.716   24.130  186.977   4.2089  192.973   3.0317 -5.996185 5.187150 
1 1 1   11   17   10 o  130.355   2.2023  345.995   11.605  374.217   18.640  328.132   14.829  134.625   3.3569  126.085   2.8516 8.540276 4.404609 
1 1 1   11   17   11 o  303.010   2.6992  1893.33   32.666  1909.01   53.429  1883.97   41.280  303.951   4.2620  302.070   3.3133 1.880768 5.398386 
1 1 1   11   17   12 o   39.763   3.7985   33.362   5.7917   30.910   10.093   34.566   7.0717   38.627   6.3355   40.900   4.1922 -2.272884 7.596933 
1 1 1   11   17   13 o   31.672   5.5834   22.016   6.9967   19.565   12.238   23.206   8.5278   30.455   9.0678   32.888   6.5172 -2.432739 11.16689 
1 1 1   11   17   14 o  128.772   2.5312  339.763   13.126  355.147   21.180  330.169   16.726  131.098   3.9170  126.446   3.2071 4.652161 5.062482 
1 1 1   11   17   15 o  162.509   2.2659  545.219   15.186  534.292   21.284  556.547   21.672  160.851   3.2083  164.167   3.2007 -3.316406 4.531864 
1 1 1   11   17   16 o   65.163   3.8316   91.390   9.5288   98.105   11.721   78.302   16.364   68.889   4.1252   61.436   6.4581 7.452629 7.663158 
1 1 1   11   17   17 o   59.327   3.9764   73.071   9.6553   74.135   12.933   71.733   14.512   59.834   5.2408   58.820   5.9818 1.013985 7.952888 
1 1 1   11   17   18 o  152.353   2.5463  476.079   15.437  466.488   19.334  492.944   25.638  150.289   3.1191  154.416   4.0256 -4.126419 5.092566 
1 1 1   11   17   19 o  146.615   2.6179  445.686   15.271  449.718   19.258  438.856   25.064  147.555   3.1643  145.676   4.1715 1.879242 5.235888 
1 1 1   11   17   20 o   84.142   3.5004  145.896   12.025  141.910   15.819  151.351   18.507   82.808   4.6318   85.476   5.2497 -2.667404 7.000894 
1 1 1   11   17   21 o   79.823   3.7206  133.210   11.259  135.083   13.540  129.011   20.270   80.818   4.0620   78.827   6.2347 1.990768 7.441210 
1 1 1   11   17   22 o  123.876   4.0503  322.487   18.875  328.700   22.601  308.166   34.313  126.031   4.3480  121.720   6.8348 4.310661 8.100598 
1 1 1   11   17   23 o   67.158   5.1194   95.865   13.558   63.021   18.864  130.953   19.498   54.906   8.3302   79.410   5.9532 -24.50399 10.23878 
1 1 1   11   17   24 o   92.582   3.4430  173.767   12.533  165.275   15.368  190.628   21.655   89.347   4.1704   95.818   5.4794 -6.471397 6.885936 
1 1 1   11   17   25 o   60.354   4.7964   78.182   10.944   81.845   13.260   70.360   19.379   62.787   5.1207   57.922   8.1116 4.864166 9.592704 
1 1 1   11   17   26 o  190.706   3.3968  744.435   25.556  719.920   31.568  791.055   43.533  186.385   4.1065  195.026   5.4120 -8.640945 6.793634 
1 1 1   11   17   27 o  103.596   4.0964  223.378   17.487  232.625   25.400  215.045   24.111  105.624   5.8304  101.569   5.7556 4.055313 8.192736 
1 1 1   11   17   28 o   98.263   3.5538  193.777   13.531  180.705   16.286  222.917   24.315   93.260   4.2340  103.267   5.7089 -10.00749 7.107639 
1 1 1   11   17   29 o   52.290   6.1077   62.318   11.493   66.953   13.845   52.043   20.613   56.500   5.9412   48.079   10.673 8.421185 12.21549 
1 1 1   11   17   30 o   34.666   7.0703   28.835   10.332   32.968   11.774   14.996   21.544   38.721   7.6442   30.611   11.896 8.110035 14.14055 
1 1 1   11   17   31 f   56.324   5.7895   67.972   11.505   66.989   13.401   70.728   22.434   56.444   5.7565   56.203   10.047 0.2413788 11.57903 
1 1 1   11   17   32 o  108.558   4.8500  222.161   16.253  208.641   17.620  299.308   42.090   99.906   4.2760  117.209   8.7066 -17.30262 9.699993 
1 1 1   11   17   33 o   49.643   6.4427   53.234   11.368   51.115   13.183   59.378   22.448   48.934   6.5321   50.353   11.107 -1.418835 12.88543 
1 1 1   11   17   34 o   78.812   4.7220  135.691   13.901  139.866   16.654  126.099   25.242   81.504   4.9542   76.120   8.0401 5.383400 9.443914 
1 1 1   11   17   35 o   44.214   8.5840   48.014   16.295   40.250   24.225   54.429   22.020   40.698   12.879   47.729   11.352 -7.030613 17.16797 
1 1 1   11   17   36 o   25.003   7.6958  -0.5435   15.187   9.3954   21.669 -10.1388   21.292   27.758   11.520   22.248   10.208 5.509987 15.39168 
1 1 1   11   17   37 o   37.756   6.4738   39.402   11.776   54.820   13.972   1.5800   21.883   50.237   6.7432   25.276   11.053 24.96091 12.94762 
1 1 1   11   17   38 o   46.790   7.1019   52.937   11.893   54.198   13.736   49.160   23.773   49.850   6.6809   43.730   12.534 6.120049 14.20376 
1 1 1   11   17   39 o   27.651   7.5866   14.772   10.969   14.486   12.446   15.767   23.214   25.857   9.2333   29.446   12.040 -3.589119 15.17313 
1 1 1   11   17   40 o   34.035   6.3986   31.987   11.882   46.542   13.783 -10.1285   23.446   45.505   7.3441   22.564   10.480 22.94020 12.79729 
1 1 1   11   17   41 o   27.453   9.4160   17.956   12.857   17.956   12.857   0.0000   0.0000   27.453   9.4160  ?   ?       ?      ? 
1 1 1   11   17   42 o   22.991   6.6160   7.0740   11.125   16.827   12.425 -32.3418   24.978   26.618   9.2491   19.365   9.4625 7.252527 13.23196 
1 1 1   11   17   43 o   20.627   6.8252  -7.9026   10.818 -11.9244   11.998   9.5740   25.011   14.833   7.0720   26.421   11.676 -11.58786 13.65044 
1 1 1   11   17   44 o   29.626   7.9626   24.488   13.750   29.261   15.422   5.9756   30.371   32.736   10.265   26.515   12.175 6.221399 15.92516 
1 1 1   11   17   45 o   22.133   7.2293   1.2832   12.974   1.5092   14.512   0.3832   28.958   19.760   8.8040   24.506   11.469 -4.746004 14.45867 
1 1 1   11   18    0 o  244.196   2.2878  1231.08   32.573  1231.08   32.573  1231.08   32.573  244.196   3.2354  244.196   3.2354 0.000000 0.000000 
1 1 1   11   18    1 o  118.175   2.2579  287.468   10.984  301.644   16.159  275.293   14.976  120.873   3.2413  115.477   3.1443 5.396225 4.515799 
1 1 1   11   18    2 o  156.489   2.3068  503.746   14.856  460.513   20.377  552.789   21.704  149.346   3.3082  163.631   3.2159 -14.28535 4.613657 
1 1 1   11   18    3 o  304.739   2.6917  1909.91   32.634  1949.22   54.043  1887.34   40.941  307.134   4.2663  302.343   3.2832 4.791046 5.383321 
1 1 1   11   18    4 o  152.852   2.1063  482.831   12.929  479.848   20.774  484.718   16.518  152.449   3.3039  153.255   2.6133 -0.8059387 4.212506 
1 1 1   11   18    5 o  200.437   2.3538  828.784   19.331  835.721   29.103  823.306   25.861  201.173   3.5075  199.700   3.1398 1.473160 4.707516 
1 1 1   11   18    6 f  161.272   2.1440  539.697   13.958  522.857   21.955  551.120   18.082  159.132   3.3451  163.412   2.6828 -4.279846 4.288026 
1 1 1   11   18    7 o  171.407   2.1660  604.089   14.874  616.608   24.210  596.498   18.852  172.808   3.3968  170.007   2.6886 2.801361 4.332060 
1 1 1   11   18    8 o  274.385   2.9072  1554.06   29.997  1558.88   55.292  1552.06   35.708  274.582   4.8823  274.188   3.1576 0.3936768 5.814388 
1 1 1   11   18    9 o  151.169   2.2306  475.613   13.780  436.062   20.382  508.915   18.702  145.320   3.4005  157.019   2.8878 -11.69902 4.461288 
1 1 1   11   18   10 f   70.826   2.5231  102.382   7.2241  109.597   11.579   97.783   9.2438   72.836   3.8544   68.816   3.2568 4.020325 5.046101 
1 1 1   11   18   11 o   83.980   2.8239  141.924   9.4471   97.031   12.389  204.289   14.602   68.510   4.3845   99.450   3.5601 -30.93967 5.647851 
1 1 1   11   18   12 o  127.542   2.1781  334.294   11.114  342.339   18.168  329.483   14.049  128.743   3.4215  126.340   2.6962 2.403526 4.356175 
1 1 1   11   18   13 f  260.350   2.7195  1377.47   28.357  1494.97   46.793  1309.27   35.649  268.928   4.2187  251.771   3.4331 17.15669 5.439035 
1 1 1   11   18   14 o  129.807   2.6388  349.820   14.030  331.843   20.785  364.868   19.017  126.711   3.9771  132.902   3.4692 -6.191010 5.277566 
1 1 1   11   18   15 o   61.278   3.0394   77.837   7.6569   74.901   11.159   80.448   10.526   60.176   4.4960   62.380   4.0911 -2.204544 6.078753 
1 1 1   11   18   16 o  133.355   2.4409  367.545   13.360  368.884   18.047  365.921   19.873  133.636   3.2742  133.074   3.6209 0.5617981 4.881708 
1 1 1   11   18   17 o   45.693   4.4024   43.157   8.1668   42.422   10.608   44.226   12.796   45.240   5.6854   46.146   6.7231 -0.9056473 8.804797 
1 1 1   11   18   18 o   22.198   5.9090   6.2043   7.9793   13.218   10.449  -3.6063   12.358   25.746   8.4849   18.650   8.2262 7.096018 11.81797 
1 1 1   11   18   19 o  103.894   2.8686  220.681   11.889  213.638   14.907  232.991   19.709  101.675   3.5547  106.113   4.5032 -4.438179 5.737158 
1 1 1   11   18   20 o   67.301   3.9720   92.854   10.942   85.631   14.432  102.621   16.781   64.269   5.4444   70.332   5.7849 -6.063637 7.943995 
1 1 1   11   18   21 o  105.737   3.2401  235.322   13.099  242.183   15.925  220.966   23.035  108.241   3.5670  103.233   5.4102 5.007729 6.480264 
1 1 1   11   18   22 o  176.095   3.2513  643.105   23.480  633.643   34.986  650.858   31.671  174.872   4.8508  177.317   4.3306 -2.445129 6.502612 
1 1 1   11   18   23 o  262.340   3.3877  1403.33   31.523  1381.35   36.149  1473.11   64.405  258.468   3.3910  266.211   5.8658 -7.742889 6.775421 
1 1 1   11   18   24 o  115.550   3.4703  276.092   16.489  247.712   22.653  308.073   24.048  109.239   5.0279  121.861   4.7847 -12.62220 6.940693 
1 1 1   11   18   25 o   69.773   4.3957  108.109   11.577  121.593   14.370   83.174   19.541   76.556   4.5510   62.990   7.5217 13.56583 8.791353 
1 1 1   11   18   26 o  103.247   4.3577  221.353   18.475  194.329   25.211  252.702   27.154   96.440   6.3381  110.053   5.9822 -13.61267 8.715425 
1 1 1   11   18   27 o   55.429   6.4833   66.973   14.357   59.122   20.690   74.264   19.938   51.666   10.071   59.192   8.1669 -7.525684 12.96657 
1 1 1   11   18   28 o   37.715   6.6482   34.788   10.208   40.925   11.925   17.957   19.750   44.098   6.5564   31.331   11.568 12.76669 13.29639 
1 1 1   11   18   29 f  119.562   3.6300  297.674   17.688  289.713   23.158  308.823   27.404  117.773   4.7675  121.351   5.4753 -3.577217 7.260007 
1 1 1   11   18   30 o   34.569   7.1244   27.480   10.435   30.060   12.363   21.087   19.460   36.747   8.3470   32.391   11.548 4.356739 14.24880 
1 1 1   11   18   31 o  126.689   3.3360  333.353   16.714  326.173   20.769  346.551   28.158  125.040   4.0272  128.339   5.3196 -3.299179 6.672051 
1 1 1   11   18   32 o   25.319   7.6778   1.7201   14.447   7.7738   21.009  -3.7109   19.899   27.338   11.344   23.300   10.349 4.038202 15.35551 
1 1 1   11   18   33 o   71.774   6.9086  111.648   13.790  109.940   14.894  121.902   36.487   72.246   4.9985   71.301   12.881 0.9450378 13.81720 
1 1 1   11   18   34 o   23.885   6.8393   7.8666   9.9517   12.593   11.020 -13.0282   23.171   24.903   8.7072   22.867   10.549 2.036112 13.67851 
1 1 1   11   18   35 o   92.225   4.2268  192.805   14.655  214.744   18.111  151.204   24.939  101.062   4.3450   83.387   7.2514 17.67490 8.453506 
1 1 1   11   18   36 o   37.963   8.3801   33.586   15.444   18.034   21.185   51.225   22.563   30.454   11.808   45.471   11.895 -15.01704 16.76012 
1 1 1   11   18   37 o   40.204   7.8227   37.989   11.985   36.689   13.673   42.302   24.900   39.776   8.5861   40.633   13.079 -0.8569260 15.64532 
1 1 1   11   18   38 o   46.380   7.1081   49.042   12.087   44.761   14.166   60.502   23.179   44.008   8.1031   48.753   11.681 -4.745491 14.21616 
1 1 1   11   18   39 o   20.991   6.6571  -0.6728   10.192  -0.4631   11.569  -1.3996   21.543   18.272   8.0123   23.711   10.633 -5.438437 13.31413 
1 1 1   11   18   40 o   29.890   7.6085   20.023   10.578   18.139   12.031   26.443   22.210   27.542   9.1058   32.238   12.192 -4.695915 15.21691 
1 1 1   11   18   41 o   20.202   7.1864 -11.4479   10.696  -9.5613   11.004 -43.6940   45.494   14.783   6.9661   25.622   12.572 -10.83903 14.37275 
1 1 1   11   18   42 o   17.589   5.9153  -8.3709   10.021  -2.9550   10.966 -35.7867   24.672   16.579   7.4973   18.598   9.1516 -2.018505 11.83051 
1 1 1   11   18   43 o   23.684   7.4379   6.6462   12.355   9.0592   13.478  -6.0549   30.922   22.520   9.1875   24.848   11.700 -2.328342 14.87585 
1 1 1   11   18   44 o   40.958   10.598   65.154   23.467   61.637   34.106   68.316   32.338   39.473   15.065   42.442   14.911 -2.968357 21.19652 
1 1 1   11   18   45 o   27.528   8.2587   16.808   13.420   13.669   14.853   30.759   31.315   24.290   9.7394   30.765   13.341 -6.475861 16.51748 
1 1 1   11   19    0 o   67.299   2.5611   94.275   9.9870   94.275   9.9870   94.275   9.9870   67.299   3.6220   67.299   3.6220 0.000000 0.000000 
1 1 1   11   19    1 o  129.217   2.1515  345.599   11.379  336.802   17.062  352.645   15.272  127.724   3.2390  130.711   2.8328 -2.987091 4.302953 
1 1 1   11   19    2 o  118.933   2.1577  291.625   10.485  294.723   15.998  289.293   13.882  119.478   3.2465  118.388   2.8430 1.089882 4.315421 
1 1 1   11   19    3 o  148.369   2.1020  455.525   12.544  449.272   20.030  459.561   16.090  147.512   3.2921  149.225   2.6143 -1.712418 4.203915 
1 1 1   11   19    4 o  117.512   2.1091  286.294   9.9937  279.014   15.795  291.154   12.905  116.248   3.2943  118.775   2.6344 -2.527695 4.218112 
1 1 1   11   19    5 o  124.081   2.2224  317.580   11.317  320.563   16.907  315.159   15.231  124.602   3.2899  123.560   2.9888 1.041550 4.444846 
1 1 1   11   19    6 o  238.763   2.3789  1178.57   22.810  1170.97   36.645  1183.38   29.145  238.098   3.7316  239.428   2.9514 -1.330582 4.757703 
1 1 1   11   19    7 o  224.985   2.3357  1041.40   20.986  1060.55   34.417  1030.07   26.478  226.589   3.6827  223.382   2.8739 3.207565 4.671346 
1 1 1   11   19    8 o  273.443   2.8784  1558.71   29.956  1509.89   53.579  1580.92   36.130  270.186   4.8080  276.700   3.1659 -6.513275 5.756714 
1 1 1   11   19    9 o  269.911   2.5364  1498.03   27.267  1531.25   45.052  1478.83   34.253  272.204   4.0129  267.619   3.1032 4.585175 5.072797 
1 1 1   11   19   10 f  152.902   2.2213  485.904   13.871  457.124   20.770  509.073   18.635  148.772   3.3849  157.031   2.8773 -8.259033 4.442549 
1 1 1   11   19   11 o  131.525   2.2381  361.084   11.983  328.016   17.952  387.659   16.093  126.018   3.4539  137.031   2.8474 -11.01378 4.476294 
1 1 1   11   19   12 o   89.516   2.3849  167.786   8.4417  157.237   13.864  174.000   10.642   87.227   3.8538   91.804   2.8105 -4.577225 4.769746 
1 1 1   11   19   13 o  113.311   2.6080  265.642   11.922  263.727   18.905  266.908   15.362  112.947   4.0583  113.675   3.2767 -0.7277069 5.215933 
1 1 1   11   19   14 o  203.787   2.5388  859.631   21.145  846.377   32.011  869.891   28.164  202.363   3.8354  205.211   3.3275 -2.848160 5.077652 
1 1 1   11   19   15 o   61.971   3.2262   80.010   8.0932   61.468   11.274   99.728   11.626   54.489   5.0163   69.452   4.0585 -14.96290 6.452483 
1 1 1   11   19   16 o  322.334   2.7821  2147.87   36.986  2167.32   52.533  2128.76   52.082  323.780   3.9338  320.887   3.9352 2.893402 5.564245 
1 1 1   11   19   17 o   72.451   3.3362  107.959   9.7897  105.144   12.623  112.207   15.507   71.296   4.2927   73.606   5.1081 -2.309692 6.672350 
1 1 1   11   19   18 o  159.304   2.6944  523.080   17.484  514.900   22.906  534.499   27.063  157.845   3.5185  160.762   4.0816 -2.916901 5.388776 
1 1 1   11   19   19 o   57.306   4.2340   68.352   9.8940   69.452   13.106   66.893   15.086   57.874   5.4907   56.739   6.4467 1.135036 8.468045 
1 1 1   11   19   20 o   45.240   5.4335   43.921   9.3725   45.122   11.652   41.720   15.774   46.615   6.0607   43.866   9.0199 2.748676 10.86702 
1 1 1   11   19   21 o   63.370   4.2894   88.565   10.490  103.790   13.491   65.286   16.681   70.783   4.6210   55.956   7.2278 14.82673 8.578799 
1 1 1   11   19   22 o  182.156   3.6107  702.726   25.037  727.347   30.383  650.640   44.192  187.459   3.9297  176.853   6.0584 10.60553 7.221306 
1 1 1   11   19   23 o  226.068   3.5620  1049.61   30.510  1032.35   36.398  1090.39   55.946  223.272   3.9526  228.864   5.9269 -5.592239 7.123960 
1 1 1   11   19   24 o  194.207   2.7448  776.349   21.072  764.373   26.192  798.319   35.476  192.216   3.3039  196.199   4.3840 -3.983246 5.489510 
1 1 1   11   19   25 o  141.387   5.4850  391.573   19.078  384.738   20.028  458.523   62.681  136.297   3.5627  146.476   10.375 -10.17889 10.96995 
1 1 1   11   19   26 o  107.903   3.4430  240.734   15.033  233.702   19.337  251.476   23.901  106.019   4.4221  109.786   5.2784 -3.767494 6.885942 
1 1 1   11   19   27 o  105.896   3.9085  234.703   17.066  229.613   24.207  239.734   24.064  104.732   5.6040  107.059   5.4497 -2.326515 7.816929 
1 1 1   11   19   28 o   55.070   5.0638   58.685   10.921   47.080   13.157   84.384   19.579   47.175   6.7622   62.966   7.5393 -15.79046 10.12762 
1 1 1   11   19   29 o   71.295   5.8089  108.625   16.492   74.749   22.333  149.249   24.457   58.748   9.2169   83.841   7.0725 -25.09316 11.61771 
1 1 1   11   19   30 f   88.931   3.8511  160.197   13.370  148.102   16.198  186.061   23.687   84.104   4.6695   93.759   6.1253 -9.655640 7.702182 
1 1 1   11   19   31 f   62.741   4.8900   85.055   11.549   86.205   13.844   82.423   20.944   63.942   5.2494   61.540   8.2517 2.402248 9.779939 
1 1 1   11   19   32 o  129.782   3.6824  353.297   19.648  319.157   26.709  393.564   29.006  122.956   5.2667  136.609   5.1480 -13.65298 7.364809 
1 1 1   11   19   33 o   22.071   7.5504  -8.0926   9.6168  -7.7786   9.9625 -12.3834   36.826   14.769   6.8498   29.372   13.458 -14.60312 15.10074 
1 1 1   11   19   34 o   51.647   6.5983   63.898   11.720   67.308   13.637   54.266   22.919   56.131   5.8906   47.162   11.809 8.969170 13.19653 
1 1 1   11   19   35 o   58.949   5.9784   80.616   12.027   83.573   14.021   72.383   23.397   62.654   5.4258   55.244   10.655 7.409737 11.95680 
1 1 1   11   19   36 o   39.466   7.4286   33.948   11.231   28.968   13.090   47.834   21.859   35.152   8.9924   43.779   11.827 -8.626690 14.85714 
1 1 1   11   19   37 o   56.610   6.7389   85.935   12.941  100.902   15.529   51.917   23.412   68.499   5.4967   44.721   12.306 23.77808 13.47773 
1 1 1   11   19   38 o   58.718   6.5251   92.297   12.477  105.758   14.732   58.146   23.465   70.213   5.0873   47.223   12.018 22.99064 13.05019 
1 1 1   11   19   39 o   55.775   5.6296   63.330   11.772   53.041   13.647   93.244   23.270   48.727   6.7905   62.822   8.9809 -14.09515 11.25916 
1 1 1   11   19   40 o   29.248   6.8762   22.582   11.131   30.567   12.456  -9.0768   24.803   35.454   8.6053   23.041   10.727 12.41329 13.75239 
1 1 1   11   19   41 o   34.161   9.6770   16.864   11.566   12.511   11.975   77.199   44.589   23.995   8.9779   44.328   17.146 -20.33336 19.35404 
1 1 1   11   19   42 o   27.837   7.1878   20.181   11.380   25.755   12.948   1.2593   23.856   31.593   9.3071   24.081   10.956 7.512440 14.37552 
1 1 1   11   19   43 o   24.170   7.2859   10.558   12.364   15.294   13.723  -9.8488   28.488   25.222   9.5726   23.117   10.986 2.105042 14.57173 
1 1 1   11   19   44 o   24.431   8.1548  -2.6246   21.067   9.0045   32.628 -10.9382   27.588   26.614   12.362   22.248   10.639 4.365568 16.30965 
1 1 1   11   20    0 o   97.711   2.7886  198.041   15.835  198.041   15.835  198.041   15.835   97.711   3.9437   97.711   3.9437 0.000000 0.000000 
1 1 1   11   20    1 o  352.074   3.6543  2557.47   51.772  2531.45   66.148  2598.61   83.176  349.896   4.5836  354.252   5.6927 -4.355988 7.308699 
1 1 1   11   20    2 o  242.684   2.3840  1221.79   23.338  1189.43   36.832  1243.51   30.167  239.948   3.7217  245.420   2.9803 -5.472092 4.767962 
1 1 1   11   20    3 o  138.629   2.0935  396.015   11.651  400.029   18.814  393.518   14.838  139.180   3.2775  138.078   2.6055 1.102036 4.187006 
1 1 1   11   20    4 o   99.243   2.2177  205.072   8.9501  192.096   13.606  214.968   11.883   96.440   3.4207  102.045   2.8233 -5.604851 4.435331 
1 1 1   11   20    5 o   35.050   4.1069   26.662   5.6109   21.664   8.5385   30.461   7.4437   31.723   6.7342   38.377   4.7028 -6.654572 8.213765 
1 1 1   11   20    6 o  212.967   2.2814  940.612   19.592  917.115   30.965  956.299   25.301  210.708   3.5631  215.227   2.8502 -4.518982 4.562810 
1 1 1   11   20    7 o   82.932   2.5477  139.754   8.0186  147.992   14.736  136.289   9.5574   84.613   4.2226   81.251   2.8520 3.362419 5.095470 
1 1 1   11   20    8 o  353.256   3.3884  2569.16   44.486  2609.78   83.881  2553.27   52.474  354.954   5.7296  351.557   3.6190 3.396881 6.776802 
1 1 1   11   20    9 o  291.427   2.6287  1761.42   30.938  1721.85   48.716  1788.17   40.051  288.613   4.0925  294.241   3.3002 -5.628082 5.257367 
1 1 1   11   20   10 o  200.055   2.3484  830.797   19.275  773.055   28.099  882.114   26.489  193.437   3.5219  206.674   3.1076 -13.23654 4.696894 
1 1 1   11   20   11 o   99.139   2.2796  205.115   9.0879  192.972   14.329  213.286   11.754   96.640   3.5950  101.638   2.8040 -4.998009 4.559204 
1 1 1   11   20   12 o  176.249   2.2332  632.415   15.643  675.234   26.232  608.783   19.488  180.780   3.5182  171.717   2.7516 9.063171 4.466421 
1 1 1   11   20   13 o   39.694   4.2492   33.772   6.6486   28.348   9.8405   38.328   9.0183   36.365   6.8113   43.024   5.0821 -6.659122 8.498329 
1 1 1   11   20   14 o   77.326   3.1869  127.457   9.7152  109.507   15.628  138.764   12.403   72.711   5.2111   81.940   3.6700 -9.229141 6.373713 
1 1 1   11   20   15 o   63.207   3.6175   77.960   9.1126  102.562   15.536   65.057   11.251   70.357   5.3538   56.058   4.8663 14.29864 7.234944 
1 1 1   11   20   16 o  148.882   3.2664  457.528   20.021  421.100   27.592  498.038   29.096  142.632   4.6903  155.133   4.5475 -12.50090 6.532863 
1 1 1   11   20   17 o  139.697   2.3619  403.194   13.607  409.139   19.379  397.413   19.111  140.712   3.3392  138.681   3.3412 2.031342 4.723776 
1 1 1   11   20   18 o   42.226   4.2686   37.100   7.4055   35.994   10.868   38.058   10.118   41.623   6.3306   42.829   5.7279 -1.205750 8.537251 
1 1 1   11   20   19 o   61.870   4.4486   81.205   11.092   97.509   15.353   63.408   16.041   68.562   5.4293   55.178   7.0486 13.38374 8.897227 
1 1 1   11   20   20 o   23.638   6.4056   8.2286   8.4170   9.1790   10.259   6.2715   14.722   23.028   8.3625   24.248   9.7055 -1.219582 12.81124 
1 1 1   11   20   21 o  155.665   3.1731  502.499   20.341  468.376   28.647  537.202   28.889  150.308   4.6209  161.021   4.3499 -10.71347 6.346229 
1 1 1   11   20   22 o   65.184   7.4454  112.136   12.836  120.978   14.007   65.764   32.077   76.381   4.4461   53.986   14.211 22.39537 14.89071 
1 1 1   11   20   23 o   53.504   5.6941   69.673   10.739   90.353   13.742   37.232   17.211   65.941   5.0527   41.068   10.206 24.87311 11.38813 
1 1 1   11   20   24 o   73.416   6.7196  117.177   17.564  119.791   20.412  109.722   34.470   75.635   6.5435   71.197   11.739 4.438164 13.43921 
1 1 1   11   20   25 o  126.320   3.4659  337.388   16.852  346.851   20.607  318.288   29.279  129.277   3.8649  123.364   5.7543 5.912720 6.931783 
1 1 1   11   20   26 o  122.471   3.1887  311.246   15.703  307.294   20.032  317.546   25.292  121.596   3.9943  123.346   4.9716 -1.749435 6.377335 
1 1 1   11   20   27 o   33.399   6.8389   25.643   9.7241   28.464   11.587   18.922   17.883   35.832   8.0381   30.966   11.067 4.866766 13.67789 
1 1 1   11   20   28 o   45.490   8.2861   49.905   15.125   38.603   27.628   54.741   18.073   41.359   13.805   49.621   9.1686 -8.262012 16.57218 
1 1 1   11   20   29 o   61.289   4.9191   78.332   11.198   76.069   13.154   84.286   21.339   60.141   5.3032   62.436   8.2864 -2.295429 9.838110 
1 1 1   11   20   30 o   19.588   6.0587  -0.4610   8.8317   3.0132   10.333  -9.8806   17.014   19.307   7.9788   19.869   9.1197 -0.5619221 12.11732 
1 1 1   11   20   31 f   74.621   4.3157  119.382   12.170  120.844   14.619  116.082   21.968   75.846   4.6732   73.396   7.2569 2.450851 8.631392 
1 1 1   11   20   32 o   73.437   4.6923  125.388   12.767  146.472   15.933   87.570   21.339   83.509   4.6260   63.365   8.1651 20.14365 9.384538 
1 1 1   11   20   33 f   35.568   8.5047   29.646   14.847   31.245   20.437   27.859   21.605   36.297   11.862   34.840   12.191 1.456722 17.00949 
1 1 1   11   20   34 o   49.046   6.5278   57.295   11.187   59.970   13.047   49.869   21.742   52.916   5.9781   45.177   11.607 7.739208 13.05566 
1 1 1   11   20   35 o   43.556   6.8248   42.846   10.946   40.333   12.849   49.494   20.900   42.237   7.6578   44.875   11.299 -2.637409 13.64958 
1 1 1   11   20   36 o   29.882   7.5431   12.141   10.841   3.7385   12.404   39.320   22.309   20.647   8.6538   39.118   12.357 -18.47115 15.08620 
1 1 1   11   20   37 o   35.740   8.5352   32.600   15.087   27.138   21.506   37.893   21.170   33.305   12.106   38.175   12.036 -4.869984 17.07049 
1 1 1   11   20   38 o   50.112   6.8141   70.288   11.805   80.898   13.822   41.675   22.697   61.067   5.4877   39.158   12.475 21.90922 13.62822 
1 1 1   11   20   39 o   40.499   7.3024   35.866   10.990   28.533   12.634   58.678   22.283   34.085   8.8933   46.914   11.585 -12.82938 14.60478 
1 1 1   11   20   40 o   64.395   5.6237   87.419   13.442   76.396   15.550  120.014   26.738   58.409   6.4547   70.382   9.2111 -11.97250 11.24749 
1 1 1   11   20   41 o   49.723   7.1170   60.507   12.151   57.558   13.802   70.673   25.625   50.257   6.6584   49.189   12.581 1.067280 14.23397 
1 1 1   11   20   42 o   22.168   6.9956  -7.2590   11.327 -17.0643   12.971   24.245   23.250   14.407   6.9897   29.929   12.120 -15.52211 13.99119 
1 1 1   11   20   43 o   25.364   7.8105   10.360   12.866   6.8057   14.503   23.491   27.877   21.563   9.2103   29.165   12.617 -7.602488 15.62094 
1 1 1   11   21    0 o   50.342   3.3802   53.740   9.7199   53.740   9.7199   53.740   9.7199   50.342   4.7803   50.342   4.7803 0.000000 0.000000 
1 1 1   11   21    1 o  140.275   2.2857  405.650   13.080  401.653   17.228  411.088   20.096  139.474   2.9949  141.075   3.4538 -1.600342 4.571480 
1 1 1   11   21    2 o   86.251   2.2845  153.597   8.1257  150.722   11.397  156.570   11.589   85.430   3.2345   87.072   3.2269 -1.642059 4.568907 
1 1 1   11   21    3 o   70.228   2.3227   99.654   6.5580  111.482   10.764   92.673   8.2699   73.461   3.5527   66.995   2.9929 6.466286 4.645354 
1 1 1   11   21    4 o  213.990   2.2836  947.620   19.670  936.901   31.362  954.571   25.254  212.956   3.5707  215.025   2.8476 -2.068832 4.567162 
1 1 1   11   21    5 f  130.111   2.2387  350.485   11.975  336.652   17.440  362.824   16.471  127.667   3.3121  132.555   3.0128 -4.887650 4.477335 
1 1 1   11   21    6 o  219.276   2.3119  986.983   20.195  1016.60   33.410  969.932   25.351  221.810   3.6520  216.743   2.8358 5.066330 4.623769 
1 1 1   11   21    7 o  245.598   2.7584  1247.48   25.495  1244.93   46.868  1248.55   30.385  245.306   4.6323  245.891   2.9960 -0.5853882 5.516754 
1 1 1   11   21    8 o  133.085   2.1677  371.899   11.647  330.458   17.811  402.858   15.394  126.476   3.4143  139.693   2.6719 -13.21659 4.335489 
1 1 1   11   21    9 o  321.160   2.8897  2135.88   37.990  2103.68   57.113  2161.43   50.877  318.933   4.3418  323.387   3.8145 -4.453613 5.779385 
1 1 1   11   21   10 o   91.322   2.3872  177.792   8.6450  148.692   13.584  197.604   11.208   84.814   3.8831   97.829   2.7777 -13.01537 4.774340 
1 1 1   11   21   11 o  111.312   2.2970  260.126   10.340  230.206   15.700  283.044   13.740  105.546   3.6066  117.079   2.8455 -11.53325 4.593918 
1 1 1   11   21   12 o  136.769   2.3371  386.705   13.145  382.827   19.284  390.071   17.966  136.118   3.4350  137.419   3.1699 -1.301407 4.674132 
1 1 1   11   21   13 f   62.943   2.9290   81.777   7.5960   85.470   11.052   78.471   10.457   64.286   4.1683   61.600   4.1160 2.686348 5.857986 
1 1 1   11   21   14 o   59.961   3.6464   71.460   8.6345   84.857   14.975   64.788   10.568   63.972   5.6755   55.950   4.5797 8.021351 7.292813 
1 1 1   11   21   15 o  104.547   2.9286  228.016   12.453  213.184   18.904  239.388   16.552  101.488   4.5163  107.607   3.7295 -6.119125 5.857159 
1 1 1   11   21   16 o  153.560   2.9283  488.643   18.047  491.404   23.045  484.264   29.022  154.179   3.6240  152.942   4.6008 1.237457 5.856664 
1 1 1   11   21   17 o  169.122   2.3579  590.880   16.444  603.207   23.547  579.144   22.975  170.842   3.3417  167.402   3.3275 3.440689 4.715867 
1 1 1   11   21   18 o  118.557   2.8700  288.743   13.730  280.875   17.567  301.098   22.012  116.536   3.6548  120.578   4.4262 -4.041489 5.740081 
1 1 1   11   21   19 o   90.230   3.3896  167.555   12.554  156.508   16.784  181.585   18.916   86.890   4.6834   93.569   4.9014 -6.679329 6.779231 
1 1 1   11   21   20 o   70.273   3.9613   97.496   11.165   80.907   13.950  127.065   18.624   62.395   5.4208   78.152   5.7779 -15.75700 7.922692 
1 1 1   11   21   21 o   53.571   4.5198   58.993   9.7636   55.878   12.417   64.040   15.804   51.800   5.8118   55.342   6.9237 -3.541901 9.039594 
1 1 1   11   21   22 o   94.410   4.0246  188.319   15.442  162.452   22.758  210.390   21.022   88.218   6.2548  100.603   5.0663 -12.38498 8.049214 
1 1 1   11   21   23 o   85.170   3.4668  149.332   11.724  145.046   14.617  157.062   19.631   83.574   4.2406   86.765   5.4857 -3.190544 6.933695 
1 1 1   11   21   24 o   41.472   8.2896   35.641   10.836   35.668   11.445   35.409   33.646   41.178   6.7390   41.767   15.148 -0.5889664 16.57917 
1 1 1   11   21   25 o   89.004   3.5633  166.608   12.552  169.683   15.769  161.292   20.737   90.299   4.2341   87.710   5.7324 2.589767 7.126553 
1 1 1   11   21   26 o   58.818   4.3463   68.851   10.106   59.694   12.339   87.508   17.613   53.315   5.6111   64.321   6.6390 -11.00563 8.692619 
1 1 1   11   21   27 o   46.604   5.7832   50.035   9.8566   54.750   12.008   40.297   17.257   51.036   5.7046   42.172   10.062 8.864159 11.56637 
1 1 1   11   21   28 o   95.738   5.0467  207.655   18.562  154.188   29.682  241.995   23.788   84.268   8.5401  107.207   5.3798 -22.93885 10.09331 
1 1 1   11   21   29 o   41.595   6.2572   38.389   9.8440   38.045   11.792   39.180   17.881   42.170   6.7796   41.020   10.519 1.150013 12.51441 
1 1 1   11   21   30 o   29.351   7.0302   15.885   9.3660   11.687   11.018   26.818   17.783   24.389   8.6899   34.313   11.053 -9.924656 14.06034 
1 1 1   11   21   31 o   33.650   7.1231   24.412   9.9187   22.066   11.752   30.222   18.494   31.206   8.7678   36.094   11.229 -4.888865 14.24620 
1 1 1   11   21   32 o   26.338   7.0096   11.810   9.2079   10.047   10.600   17.229   18.585   23.086   8.4825   29.590   11.162 -6.503853 14.01913 
1 1 1   11   21   33 o   43.087   6.8021   49.704   10.828   56.820   12.442   27.486   21.985   51.554   5.8512   34.620   12.282 16.93390 13.60418 
1 1 1   11   21   34 o   41.405   6.7154   58.040   12.017   69.130   12.796 -24.8048   34.974   56.897   5.4527   25.914   12.274 30.98220 13.43073 
1 1 1   11   21   35 o   48.718   6.2142   51.825   11.273   47.304   13.394   62.803   20.872   46.386   7.0012   51.050   10.269 -4.663738 12.42834 
1 1 1   11   21   36 o   55.521   5.7704   56.201   11.617   42.622   13.142  104.740   24.847   43.739   7.2848   67.302   8.9511 -23.56321 11.54080 
1 1 1   11   21   37 o   46.582   7.6866   54.936   15.736   29.743   21.754   82.590   22.792   34.065   12.203   59.099   9.3504 -25.03315 15.37317 
1 1 1   11   21   38 f   69.601   4.9339  111.242   12.717  114.566   15.205  103.500   23.202   72.769   5.0660   66.432   8.4681 6.337410 9.867827 
1 1 1   11   21   39 o   62.277   5.1696   77.938   12.324   61.377   14.492  121.187   23.420   52.236   6.7267   72.318   7.8518 -20.08175 10.33923 
1 1 1   11   21   40 o   31.226   7.1696   27.585   11.378   33.499   13.099   9.4042   22.966   36.552   8.7955   25.901   11.325 10.65081 14.33928 
1 1 1   11   21   41 o   40.924   6.9255   52.299   12.333   63.118   14.340   21.548   24.175   52.531   6.6186   29.318   12.167 23.21299 13.85099 
1 1 1   11   21   42 o   65.171   6.5388   98.286   17.576   98.286   17.576   0.0000   0.0000   65.171   6.5388  ?   ?       ?      ? 
1 1 1   11   21   43 o   22.121   7.1673   2.4878   12.291   1.8773   13.752   4.9126   27.406   19.438   8.6203   24.803   11.453 -5.364439 14.33468 
1 1 1   11   22    0 o  167.058   2.8386  577.226   27.624  577.226   27.624  577.226   27.624  167.058   4.0144  167.058   4.0144 0.000000 0.000000 
1 1 1   11   22    1 o   68.851   2.6567   98.250   7.4969  100.721   10.126   95.252   11.153   69.821   3.5162   67.881   3.9835 1.940254 5.313412 
1 1 1   11   22    2 o  224.356   2.2844  1039.60   21.138  1032.92   29.721  1046.45   30.068  223.627   3.2224  225.086   3.2388 -1.458618 4.568779 
1 1 1   11   22    3 f  167.720   2.1445  580.860   14.834  577.172   20.821  584.661   21.139  167.180   3.0196  168.259   3.0460 -1.079025 4.289081 
1 1 1   11   22    4 o   77.590   2.4248  123.745   7.7218  130.464   11.618  118.430   10.334   79.462   3.5450   75.718   3.3092 3.744125 4.849524 
1 1 1   11   22    5 o  118.590   2.4829  285.092   11.994  257.674   15.543  325.452   18.858  111.683   3.3743  125.497   3.6433 -13.81370 4.965829 
1 1 1   11   22    6 o   45.058   3.3761   46.033   5.6524   31.028   9.3606   54.645   7.0913   38.685   5.8666   51.432   3.3429 -12.74624 6.752240 
1 1 1   11   22    7 o  173.927   2.4692  619.679   16.136  638.031   29.976  612.191   19.147  175.656   4.1376  172.197   2.6959 3.459503 4.938384 
1 1 1   11   22    8 o  193.168   2.2405  770.610   17.395  771.311   27.936  770.166   22.230  193.204   3.5057  193.131   2.7908 0.7351685E-01 4.480905 
1 1 1   11   22    9 o  126.698   2.1919  329.829   11.257  340.743   17.761  322.500   14.554  128.424   3.3532  124.973   2.8236 3.451714 4.383710 
1 1 1   11   22   10 o   66.246   2.5811   90.227   6.7415   92.299   11.404   89.114   8.3583   66.807   4.1388   65.685   3.0852 1.121750 5.162182 
1 1 1   11   22   11 o   78.999   2.5162  131.236   7.8463  120.799   12.870  137.410   9.8987   76.429   4.0827   81.569   2.9423 -5.140160 5.032475 
1 1 1   11   22   12 o   77.402   2.7368  123.488   8.6979  127.804   13.019  120.007   11.690   78.612   4.0152   76.192   3.7199 2.420341 5.473549 
1 1 1   11   22   13 o  254.206   3.0928  1307.19   31.219  1232.48   38.700  1446.40   52.827  244.140   3.8433  264.271   4.8467 -20.13055 6.185556 
1 1 1   11   22   14 o  123.110   2.9750  313.608   14.190  313.661   17.321  313.498   24.745  123.196   3.4089  123.025   4.8768 0.1706161 5.950055 
1 1 1   11   22   15 o  127.060   2.7381  338.779   13.961  311.001   21.968  357.600   18.083  122.578   4.3452  131.541   3.3330 -8.962410 5.476300 
1 1 1   11   22   16 o   94.609   3.1619  184.929   12.318  177.852   16.846  193.062   18.058   92.674   4.4073   96.543   4.5351 -3.869621 6.323854 
1 1 1   11   22   17 o   20.405   5.5347   5.9553   6.4884   4.7289   10.115   6.8129   8.4580   20.381   8.0815   20.429   7.5645 -0.4826355E-01 11.06941 
1 1 1   11   22   18 o   81.088   5.4707  138.428   14.939  136.338   32.258  138.999   16.856   80.338   9.7352   81.837   4.9939 -1.499199 10.94134 
1 1 1   11   22   19 o  123.845   3.0561  316.508   15.111  312.224   19.050  323.776   24.816  122.799   3.7614  124.890   4.8177 -2.091095 6.112135 
1 1 1   11   22   20 f   58.654   4.2116   71.757   10.056   72.073   13.219   71.324   15.492   58.858   5.4455   58.451   6.4263 0.4070549 8.423233 
1 1 1   11   22   21 o  123.633   3.2814  317.093   16.697  289.240   23.159  347.244   24.095  117.964   4.7599  129.303   4.5181 -11.33823 6.562783 
1 1 1   11   22   22 o   32.390   6.4388   22.722   8.7968   21.631   11.242   24.445   14.128   31.387   8.4823   33.392   9.6894 -2.004591 12.87767 
1 1 1   11   22   23 o   51.112   5.1345   58.714   9.8340   66.247   12.482   46.385   15.967   56.302   5.3753   45.923   8.7498 10.37892 10.26901 
1 1 1   11   22   24 o   57.658   4.5739   69.070   10.137   67.314   12.222   72.943   18.148   56.720   5.2243   58.596   7.5093 -1.876030 9.147842 
1 1 1   11   22   25 o  107.052   4.6175  244.981   15.846  246.663   17.614  237.845   36.288  108.871   3.9226  105.234   8.3606 3.636658 9.235061 
1 1 1   11   22   26 o   35.771   6.3473   29.471   9.1086   31.879   11.199   24.764   15.655   38.097   7.3943   33.445   10.319 4.651802 12.69455 
1 1 1   11   22   27 o   69.706   4.2007   99.280   11.816   86.328   14.936  120.938   19.315   63.927   5.6650   75.485   6.2040 -11.55824 8.401322 
1 1 1   11   22   28 o   67.662   5.3342   99.081   14.800   87.019   20.868  111.287   20.993   63.323   7.9902   72.000   7.0691 -8.677750 10.66848 
1 1 1   11   22   29 o   87.844   3.6840  158.786   12.742  149.869   15.638  176.399   21.978   84.524   4.4858   91.164   5.8451 -6.639755 7.368048 
1 1 1   11   22   30 o   90.078   4.3823  172.966   16.270  165.169   22.930  180.872   23.089   87.975   6.3195   92.181   6.0730 -4.205772 8.764569 
1 1 1   11   22   31 o   46.876   5.8452   46.246   10.289   41.439   12.269   57.637   18.888   43.799   6.7918   49.953   9.5152 -6.153942 11.69047 
1 1 1   11   22   32 o   79.581   4.4774  139.094   13.321  143.600   15.981  128.836   24.112   82.476   4.6979   76.686   7.6235 5.790009 8.954758 
1 1 1   11   22   33 o   30.098   6.9924   14.195   9.1374   7.4530   10.403   36.947   19.112   21.379   8.2784   38.816   11.271 -17.43711 13.98482 
1 1 1   11   22   34 f   37.758   8.6202   30.128   10.809   28.754   11.368   43.084   34.914   35.256   8.0010   40.261   15.271 -5.005165 17.24046 
1 1 1   11   22   35 o   24.553   7.0765   9.3399   10.028   9.7460   11.401   7.9520   21.077   22.871   8.7142   26.236   11.152 -3.364218 14.15308 
1 1 1   11   22   36 o   55.315   5.3676   61.019   11.401   47.938   13.447   94.455   21.499   46.356   7.0335   64.274   8.1101 -17.91771 10.73513 
1 1 1   11   22   37 o   82.890   4.2538  149.097   13.657  144.549   16.595  158.639   24.036   81.854   4.9157   83.927   6.9438 -2.072937 8.507673 
1 1 1   11   22   38 o   37.128   7.2094   28.091   10.598   18.140   12.252   57.657   21.120   27.456   9.1930   46.800   11.108 -19.34419 14.41884 
1 1 1   11   22   39 o   27.468   6.8576   19.428   10.518   25.509   12.037  -0.2139   21.633   31.839   8.8480   23.098   10.480 8.741089 13.71525 
1 1 1   11   22   40 o   55.783   6.4870   75.371   12.846   72.616   15.044   82.790   24.686   56.536   6.4516   55.029   11.256 1.506828 12.97398 
1 1 1   11   22   41 o   45.542   7.1640   67.488   14.526   87.362   17.661   25.923   25.541   61.029   7.0163   30.055   12.493 30.97369 14.32800 
1 1 1   11   22   42 o   26.929   9.8146   19.357   14.150   19.357   14.150   0.0000   0.0000   26.929   9.8146  ?   ?       ?      ? 
1 1 1   11   23    0 o   81.651   2.7096  138.555   12.840  138.555   12.840  138.555   12.840   81.651   3.8320   81.651   3.8320 0.000000 0.000000 
1 1 1   11   23    1 o  111.017   2.3764  255.549   10.796  246.668   16.157  262.715   14.512  109.254   3.5855  112.780   3.1199 -3.526131 4.752851 
1 1 1   11   23    2 o  337.268   2.7871  2351.68   38.769  2358.75   54.953  2344.67   54.703  337.772   3.9446  336.764   3.9384 1.008453 5.574109 
1 1 1   11   23    3 o  343.586   2.8275  2439.74   40.049  2407.95   55.634  2473.93   57.696  341.274   3.9525  345.897   4.0442 -4.623260 5.654921 
1 1 1   11   23    4 o  111.218   2.4340  253.117   10.921  244.275   13.944  267.145   17.564  108.750   3.1088  113.686   3.7459 -4.936356 4.867910 
1 1 1   11   23    5 o  292.834   2.6281  1776.50   30.966  1753.50   49.402  1791.38   39.742  291.195   4.1134  294.473   3.2722 -3.278137 5.256180 
1 1 1   11   23    6 o  132.940   2.4205  366.863   12.167  360.892   22.106  369.457   14.572  132.109   4.0571  133.772   2.6412 -1.662903 4.841069 
1 1 1   11   23    7 o  159.592   2.5205  542.155   15.868  466.120   25.500  590.207   20.271  150.130   4.1182  169.055   2.9073 -18.92532 5.041004 
1 1 1   11   23    8 f  109.717   2.2074  249.922   9.7362  242.905   15.508  254.487   12.509  108.418   3.4681  111.016   2.7318 -2.598038 4.414825 
1 1 1   11   23    9 o  102.661   2.2888  219.062   9.4909  211.004   14.876  224.594   12.325  101.038   3.5698  104.283   2.8656 -3.244949 4.577651 
1 1 1   11   23   10 o  170.392   2.4609  598.868   17.277  571.846   23.804  628.950   25.115  166.340   3.4697  174.445   3.4907 -8.105408 4.921768 
1 1 1   11   23   11 o   20.608   4.7894   8.6516   5.1011  -1.1657   9.6192   12.493   6.0168   17.149   7.4150   24.067   6.0641 -6.917908 9.578887 
1 1 1   11   23   12 o   55.799   5.4182   80.086   9.2129   43.567   18.218   92.634   10.679   44.671   10.122   66.927   3.8687 -22.25531 10.83649 
1 1 1   11   23   13 o  172.987   2.2930  618.068   16.355  603.066   22.796  633.983   23.478  170.826   3.2354  175.148   3.2501 -4.322449 4.585952 
1 1 1   11   23   14 o  235.958   3.3251  1131.54   32.030  996.582   41.844  1322.50   49.774  219.313   4.6260  252.603   4.7775 -33.28960 6.650128 
1 1 1   11   23   15 o   78.664   3.4281  135.726   10.259  107.084   17.241  151.427   12.765   71.771   5.8243   85.558   3.6174 -13.78642 6.856215 
1 1 1   11   23   16 f   52.351   5.2547   68.527   9.0718   37.923   16.193   82.525   10.952   41.586   9.6306   63.116   4.2071 -21.52957 10.50942 
1 1 1   11   23   17 o  116.294   2.4589  280.053   11.783  274.187   16.922  285.573   16.417  115.101   3.5646  117.487   3.3880 -2.385849 4.917860 
1 1 1   11   23   18 o  108.613   2.7282  243.615   11.985  248.064   18.979  240.664   15.456  109.391   4.2067  107.836   3.4751 1.554634 5.456438 
1 1 1   11   23   19 o   49.312   3.8796   50.738   7.7976   49.994   11.930   51.293   10.303   48.957   5.9082   49.666   5.0296 -0.7094841 7.759118 
1 1 1   11   23   20 o  165.142   2.6429  560.182   17.351  545.991   21.682  585.457   28.936  162.375   3.2375  167.909   4.1783 -5.533966 5.285769 
1 1 1   11   23   21 o  104.564   3.1537  229.103   13.372  237.364   17.573  217.740   20.611  106.911   3.9853  102.217   4.8888 4.694305 6.307413 
1 1 1   11   23   22 o   88.581   3.3326  160.641   11.964  148.713   15.329  179.234   19.139   84.512   4.3978   92.649   5.0084 -8.136353 6.665197 
1 1 1   11   23   23 o   92.095   3.3330  178.858   12.179  183.866   15.392  170.472   19.919   94.003   3.9700   90.187   5.3549 3.816742 6.665970 
1 1 1   11   23   24 o  103.074   3.9594  219.121   16.650  180.926   22.048  269.804   25.398   92.756   5.7632  113.393   5.4306 -20.63728 7.918737 
1 1 1   11   23   25 o   93.491   5.0605  184.136   14.189  183.206   15.458  189.108   35.746   93.775   3.9968   93.208   9.2985 0.5667343 10.12106 
1 1 1   11   23   26 o   35.655   6.3950   26.926   8.9468   22.805   10.812   35.875   15.934   31.824   8.1896   39.486   9.8242 -7.661646 12.78998 
1 1 1   11   23   27 o   34.564   6.4357   28.811   9.6796   36.410   12.301   16.453   15.687   40.465   7.6505   28.662   10.351 11.80281 12.87141 
1 1 1   11   23   28 o   90.091   3.5658  161.794   12.689  141.288   15.485  203.713   22.140   82.040   4.5763   98.141   5.4696 -16.10098 7.131589 
1 1 1   11   23   29 o   29.534   7.7454   17.190   12.495   15.499   19.265   18.418   16.417   29.322   11.290   29.746   10.607 -0.4236622 15.49075 
1 1 1   11   23   30 o   28.452   6.7192   12.712   9.1608   4.7911   10.920   31.529   16.831   20.427   8.2943   36.477   10.573 -16.05010 13.43838 
1 1 1   11   23   31 o   57.062   5.0979   73.733   10.900   78.716   13.255   63.321   19.159   60.868   5.2799   53.256   8.7222 7.611706 10.19579 
1 1 1   11   23   32 o   20.559   6.1153   2.8353   8.9857   9.0178   10.207 -18.4579   18.943   22.166   8.2896   18.952   8.9928 3.213865 12.23064 
1 1 1   11   23   33 o   34.880   6.7629   21.967   9.9769   10.570   11.745   51.504   18.908   23.602   8.8793   46.157   10.203 -22.55527 13.52585 
1 1 1   11   23   34 o   23.972   6.5361   10.776   9.2939   15.447   10.684  -3.7573   18.845   26.079   8.5788   21.865   9.8634 4.213531 13.07224 
1 1 1   11   23   35 o   38.882   9.7711   22.778   11.199   18.567   11.581   83.497   43.978   28.049   8.9082   49.716   17.394 -21.66660 19.54211 
1 1 1   11   23   36 o   45.513   6.4184   46.161   10.782   39.513   12.723   63.104   20.310   40.966   7.8154   50.060   10.183 -9.094048 12.83676 
1 1 1   11   23   37 o   31.169   7.2712   23.585   10.044   22.487   11.712   26.636   19.526   30.275   8.8327   32.062   11.553 -1.786819 14.54250 
1 1 1   11   23   38 o   24.181   7.4318   6.7362   13.820   5.0890   19.994   8.2433   19.125   23.869   10.498   24.492   10.522 -0.6231041 14.86362 
1 1 1   11   23   39 o   25.440   7.2397   12.855   10.369   11.345   11.901   17.614   21.128   23.101   8.8791   27.779   11.437 -4.677866 14.47932 
1 1 1   11   23   40 o   25.701   7.4376   14.714   11.694   15.006   13.593   13.885   22.939   25.011   9.5188   26.390   11.431 -1.379190 14.87512 
1 1 1   11   23   41 o   31.757   8.3296   25.594   12.775   18.621   14.627   48.025   26.234   26.580   9.9267   36.933   13.379 -10.35347 16.65911 
1 1 1   11   24    0 o   52.875   3.3536   59.143   10.151   59.143   10.151   59.143   10.151   52.875   4.7427   52.875   4.7427 0.000000 0.000000 
1 1 1   11   24    1 o  120.530   2.3353  301.973   11.506  284.628   17.171  316.105   15.500  117.353   3.5477  123.708   3.0378 -6.355309 4.670626 
1 1 1   11   24    2 o  267.838   2.8070  1483.49   31.009  1483.94   43.799  1483.04   43.907  267.880   3.9642  267.796   3.9753 0.8343506E-01 5.614081 
1 1 1   11   24    3 o  114.655   2.1915  271.498   10.361  280.328   14.762  262.926   14.545  116.493   3.0724  112.816   3.1259 3.677124 4.383014 
1 1 1   11   24    4 o  125.918   2.4174  330.258   12.307  341.868   16.060  313.743   19.155  128.648   3.0268  123.187   3.7700 5.461281 4.834702 
1 1 1   11   24    5 o  215.737   2.5773  960.558   22.906  931.121   31.489  993.640   33.382  212.239   3.5972  219.235   3.6917 -6.995880 5.154516 
1 1 1   11   24    6 o  234.734   2.9656  1144.66   28.368  1107.91   43.230  1172.45   37.594  231.349   4.5306  238.120   3.8279 -6.771362 5.931159 
1 1 1   11   24    7 o  341.050   3.4066  2432.67   46.425  2309.40   74.619  2510.52   59.299  333.738   5.4210  348.363   4.1272 -14.62515 6.813262 
1 1 1   11   24    8 o   90.782   2.5102  170.861   9.3520  164.698   13.789  176.109   12.726   89.249   3.7460   92.314   3.3424 -3.064713 5.020388 
1 1 1   11   24    9 o  145.651   2.4071  438.480   14.459  436.761   20.536  440.171   20.363  145.365   3.4252  145.936   3.3831 -0.5705109 4.814265 
1 1 1   11   24   10 o  142.439   2.9011  421.475   16.976  393.064   24.551  447.506   23.500  137.795   4.3198  147.083   3.8738 -9.288452 5.802286 
1 1 1   11   24   11 o  142.461   2.6452  421.701   15.421  436.975   20.785  402.994   23.002  145.375   3.4665  139.548   3.9964 5.827301 5.290390 
1 1 1   11   24   12 o   71.369   2.8438  106.340   8.2892   90.831   11.866  121.120   11.584   66.221   4.3446   76.517   3.6707 -10.29622 5.687652 
1 1 1   11   24   13 o  213.536   2.5275  945.999   22.121  969.756   29.882  917.196   32.903  216.552   3.3457  210.520   3.7894 6.032379 5.055007 
1 1 1   11   24   14 o  101.401   2.5146  212.770   10.501  197.730   14.725  228.336   14.980   97.745   3.6525  105.058   3.4572 -7.312256 5.029151 
1 1 1   11   24   15 o  103.125   2.8265  219.982   11.781  218.649   15.192  221.993   18.657  102.780   3.5838  103.470   4.3718 -0.6904678 5.653034 
1 1 1   11   24   16 o   93.156   3.1718  186.945   11.501  156.831   18.862  204.769   14.511   86.849   5.2657   99.462   3.5374 -12.61309 6.343593 
1 1 1   11   24   17 o  163.021   3.1041  533.200   18.593  592.118   36.451  512.479   21.616  168.688   5.2391  157.354   3.3307 11.33344 6.208197 
1 1 1   11   24   18 o   74.949   2.9391  116.764   9.0467  115.075   13.373  118.189   12.285   74.424   4.3565   75.474   3.9464 -1.050308 5.878163 
1 1 1   11   24   19 o   96.750   2.7014  194.249   10.779  195.680   15.301  192.839   15.189   97.103   3.8204   96.396   3.8203 0.7075119 5.402785 
1 1 1   11   24   20 o   63.403   7.5208  113.505   12.316  123.700   13.392   57.612   31.357   77.120   4.2104   49.687   14.440 27.43327 15.04169 
1 1 1   11   24   21 o   37.359   5.6310   29.860   8.3323   24.452   10.793   37.841   13.110   33.224   7.9768   41.494   7.9499 -8.269997 11.26193 
1 1 1   11   24   22 o   37.310   5.9569   31.510   8.9556   35.972   12.081   26.068   13.343   40.504   7.5081   34.115   9.2503 6.389034 11.91378 
1 1 1   11   24   23 o   95.773   3.4720  193.155   13.158  196.591   16.524  187.202   21.752   97.145   4.1242   94.401   5.5867 2.743568 6.944024 
1 1 1   11   24   24 o   51.724   4.6063   57.737   9.4926   60.706   12.165   53.114   15.180   53.673   5.4951   49.775   7.3942 3.897854 9.212531 
1 1 1   11   24   25 o   23.162   5.5677   7.8153   8.1624   20.331   10.213 -14.3205   13.582   30.087   8.0653   16.236   7.6777 13.85126 11.13534 
1 1 1   11   24   26 o   20.056   6.7878  -6.0185   9.2559  -3.5431   9.6606 -33.7247   32.320   15.932   7.1345   24.179   11.550 -8.247457 13.57565 
1 1 1   11   24   27 o   19.474   6.0245  -1.4345   8.5523  -2.9009   10.306   1.8096   15.328   16.750   7.4437   22.197   9.4747 -5.446875 12.04902 
1 1 1   11   24   28 o   28.139   6.8015   16.089   9.0532   13.913   11.054   20.522   15.777   25.689   8.7314   30.590   10.431 -4.900513 13.60296 
1 1 1   11   24   29 o  115.565   3.6512  282.817   17.379  262.909   24.251  303.833   24.917  111.315   5.2822  119.815   5.0422 -8.499741 7.302405 
1 1 1   11   24   30 o   77.142   3.8841  124.110   11.775  118.127   14.448  135.946   20.321   74.775   4.6846   79.508   6.1967 -4.732918 7.768198 
1 1 1   11   24   31 o   29.155   6.6563   20.450   9.6779   26.256   11.311   4.5891   18.695   33.719   8.2102   24.591   10.479 9.128027 13.31259 
1 1 1   11   24   32 o   66.795   4.6178   97.914   12.228   99.492   15.423   95.244   20.063   68.064   5.4941   65.527   7.4236 2.536186 9.235543 
1 1 1   11   24   33 o   69.637   4.6901  111.819   12.394  123.398   15.411   90.616   20.854   75.975   4.9181   63.299   7.9876 12.67598 9.380232 
1 1 1   11   24   34 f   26.679   7.0111   10.805   9.8863   3.6501   11.758   28.061   18.261   20.001   8.4065   33.356   11.223 -13.35544 14.02222 
1 1 1   11   24   35 o   61.103   8.0302  119.876   13.829  130.963   15.114   62.876   34.269   78.066   4.6940   44.140   15.359 33.92597 16.06036 
1 1 1   11   24   36 o   29.798   7.0323   22.748   10.177   25.943   11.966   14.396   19.346   32.519   8.7359   27.077   11.023 5.441845 14.06459 
1 1 1   11   24   37 o   33.011   7.3268   24.405   10.047   18.528   11.624   41.765   19.979   27.413   8.9452   38.609   11.606 -11.19644 14.65360 
1 1 1   11   24   38 o   26.539   7.9047   13.711   14.887   18.112   20.450   8.7484   21.715   27.857   11.335   25.221   11.020 2.636063 15.80937 
1 1 1   11   24   39 o   40.127   7.1443   46.491   11.593   50.250   13.479   35.804   22.727   46.337   7.0528   33.917   12.427 12.41918 14.28854 
1 1 1   11   24   40 o   19.512   6.4390  -3.9655   10.744  -5.5030   12.289   1.0224   22.133   16.384   7.6020   22.639   10.395 -6.254503 12.87806 
1 1 1   11   25    0 o   66.134   2.9861   91.444   11.411   91.444   11.411   91.444   11.411   66.134   4.2230   66.134   4.2230 0.000000 0.000000 
1 1 1   11   25    1 o   95.603   2.4794  190.916   9.6666  171.268   14.300  207.449   13.117   91.005   3.8099  100.200   3.1741 -9.194778 4.958811 
1 1 1   11   25    2 o  178.378   2.7589  662.719   19.938  631.975   30.866  684.734   26.119  174.749   4.2826  182.006   3.4794 -7.257172 5.517826 
1 1 1   11   25    3 o  154.674   2.2816  495.599   14.502  477.789   21.210  511.237   19.874  152.042   3.3823  157.306   3.0632 -5.263474 4.563258 
1 1 1   11   25    4 o  135.949   2.4451  380.963   13.424  376.784   17.262  387.357   21.351  135.040   3.0994  136.857   3.7826 -1.817444 4.890210 
1 1 1   11   25    5 o  260.293   2.6542  1400.26   28.217  1408.33   43.066  1394.19   37.352  260.898   4.0022  259.688   3.4873 1.210876 5.308368 
1 1 1   11   25    6 f   74.258   3.5659  109.803   9.5614  123.785   19.331  105.274   11.001   77.174   6.0733   71.343   3.7388 5.831116 7.131892 
1 1 1   11   25    7 o   59.838   3.4816   74.287   8.4335   74.507   10.936   73.965   13.246   59.978   4.4209   59.698   5.3799 0.2804909 6.963287 
1 1 1   11   25    8 o   79.567   2.6525  130.536   8.6892  141.296   12.697  121.057   11.917   82.643   3.7250   76.492   3.7773 6.150864 5.305053 
1 1 1   11   25    9 o  219.708   2.5004  999.599   22.598  981.563   33.022  1015.48   30.990  217.816   3.6758  221.601   3.3907 -3.785019 5.000813 
1 1 1   11   25   10 o  195.202   2.5565  784.981   20.527  743.879   27.811  834.166   30.424  189.624   3.5560  200.781   3.6739 -11.15671 5.112974 
1 1 1   11   25   11 o   94.344   4.5589  205.110   13.683  218.727   15.429  154.946   29.613  102.805   3.6387   85.882   8.3602 16.92360 9.117753 
1 1 1   11   25   12 o  199.357   2.6251  821.350   21.016  816.489   26.784  829.137   33.899  198.678   3.2686  200.036   4.1088 -1.357590 5.250283 
1 1 1   11   25   13 o  146.831   3.2335  445.967   19.582  445.967   19.582   0.0000   0.0000  146.831   3.2335  ?   ?       ?      ? 
1 1 1   11   25   14 o   89.027   2.6148  164.562   9.5755  155.889   13.809  172.595   13.290   86.745   3.8596   91.310   3.5289 -4.564209 5.229695 
1 1 1   11   25   15 o   96.660   2.8501  191.912   11.161  184.352   14.361  203.441   17.734   94.324   3.6914   98.997   4.3434 -4.672745 5.700181 
1 1 1   11   25   16 o   27.896   6.2079   13.991   7.1005   22.854   14.493   11.191   8.1450   32.507   9.9108   23.286   7.4786 9.221447 12.41585 
1 1 1   11   25   17 o   64.689   4.5624   83.694   9.7122   95.005   22.380   81.069   10.780   66.919   8.1086   62.460   4.1846 4.458431 9.124730 
1 1 1   11   25   18 o   50.295   4.2057   58.033   7.7146   34.272   11.552   77.161   10.365   39.670   7.3304   60.920   4.1250 -21.24982 8.411366 
1 1 1   11   25   19 o   79.411   2.8614  131.794   9.3013  125.607   13.839  136.890   12.562   77.655   4.3209   81.167   3.7523 -3.512032 5.722711 
1 1 1   11   25   20 o   75.551   2.9732  119.216   9.2079  116.193   13.704  121.704   12.432   74.629   4.4523   76.473   3.9417 -1.844467 5.946405 
1 1 1   11   25   21 o   59.637   3.8820   76.262   9.2828   83.438   12.178   66.311   14.341   63.202   4.6718   56.072   6.2010 7.130161 7.763923 
1 1 1   11   25   22 o   93.761   3.8035  187.382   14.488  157.747   21.101  213.811   19.926   86.462   5.9171  101.060   4.7807 -14.59780 7.607049 
1 1 1   11   25   23 o   78.964   3.8837  133.181   12.358  139.775   16.116  123.770   19.254   81.586   4.7894   76.342   6.1150 5.243477 7.767348 
1 1 1   11   25   24 o   27.970   6.4360   17.109   8.4984   18.947   10.872   14.223   13.626   29.107   8.5154   26.832   9.6528 2.275253 12.87200 
1 1 1   11   25   25 o   26.790   6.4160   15.260   8.3420   16.754   10.416   12.587   13.930   27.519   8.4047   26.061   9.6964 1.457809 12.83195 
1 1 1   11   25   26 o   23.666   6.4691   8.8762   8.7297   8.3992   10.979   9.6964   14.396   22.467   8.5535   24.865   9.7075 -2.397957 12.93822 
1 1 1   11   25   27 o   47.909   9.2121   49.020   11.428   47.921   11.829   64.396   44.250   47.341   6.0582   48.477   17.400 -1.136292 18.42420 
1 1 1   11   25   28 o   54.741   4.8541   65.860   10.403   68.534   13.016   61.132   17.308   56.743   5.5617   52.738   7.9573 4.004967 9.708280 
1 1 1   11   25   29 o   24.958   6.5249   12.244   8.8901   14.936   10.993   7.1555   15.114   26.127   8.7074   23.789   9.7199 2.338133 13.04971 
1 1 1   11   25   30 o  101.754   3.8490  221.293   16.116  202.680   22.592  240.579   22.997   97.271   5.6313  106.237   5.2485 -8.965324 7.697921 
1 1 1   11   25   31 o   42.541   6.4172   42.060   10.094   41.755   11.883   42.848   19.127   43.678   6.5962   41.405   11.010 2.272850 12.83442 
1 1 1   11   25   32 o   47.979   5.7045   50.272   10.472   45.104   12.724   61.125   18.438   45.181   6.8280   50.777   9.1403 -5.596634 11.40909 
1 1 1   11   25   33 o   38.953   6.7727   38.455   10.415   40.930   12.585   33.075   18.554   42.114   7.5212   35.791   11.265 6.323185 13.54536 
1 1 1   11   25   34 o   31.645   7.4009   25.278   10.601   26.070   12.224   22.874   21.293   32.585   8.8613   30.705   11.856 1.880400 14.80179 
1 1 1   11   25   35 o   22.240   6.0319   6.5848   9.6062   18.176   11.218 -25.2701   18.598   27.465   8.7723   17.015   8.2813 10.45008 12.06374 
1 1 1   11   25   36 o   37.075   8.5203   31.578   11.390   27.960   12.233   55.135   31.214   33.431   8.7647   40.719   14.614 -7.288242 17.04059 
1 1 1   11   25   37 o   26.446   7.1596   15.592   9.9966   14.028   11.672   19.897   19.366   24.522   8.9174   28.370   11.203 -3.848419 14.31914 
1 1 1   11   25   38 o   19.621   6.3378  -0.6785   10.300   1.6901   11.751  -8.5321   21.398   18.512   8.0973   20.730   9.7520 -2.218460 12.67550 
1 1 1   11   25   39 o   18.631   6.2141  -6.5322   10.435  -8.0891   11.976  -1.6258   21.261   15.488   7.2890   21.774   10.066 -6.286187 12.42813 
1 1 1   11   26    0 o  109.866   2.5873  250.145   16.538  250.145   16.538  250.145   16.538  109.866   3.6589  109.866   3.6589 0.000000 0.000000 
1 1 1   11   26    1 o   75.239   3.0338  115.923   9.3298  107.990   12.246  126.900   14.404   72.219   4.1112   78.259   4.4625 -6.040092 6.067659 
1 1 1   11   26    2 o   90.039   3.8839  178.369   11.472  185.621   12.951  151.937   24.725   94.749   3.3140   85.330   7.0254 9.418373 7.767819 
1 1 1   11   26    3 o  129.816   2.6385  345.347   13.374  338.495   16.375  359.079   23.180  127.968   3.1025  131.664   4.2686 -3.696037 5.276977 
1 1 1   11   26    4 o   75.168   2.8866  115.314   8.7373  109.647   11.088  124.598   14.192   72.794   3.6930   77.541   4.4375 -4.746361 5.773226 
1 1 1   11   26    5 o  110.569   2.9652  253.228   13.521  248.733   19.046  257.794   19.198  109.578   4.2142  111.561   4.1724 -1.982948 5.930310 
1 1 1   11   26    6 o   53.850   3.8267   64.899   7.8094   45.901   12.680   76.510   9.9126   46.915   6.5529   60.786   3.9539 -13.87084 7.653361 
1 1 1   11   26    7 o   34.498   4.4005   25.201   6.0602   25.354   9.2632   25.086   8.0130   34.265   6.7945   34.730   5.5941 -0.4645576 8.801094 
1 1 1   11   26    8 o   85.442   2.5840  149.359   9.0068  121.268   12.102  184.234   13.485   76.525   3.8344   94.358   3.4649 -17.83322 5.168019 
1 1 1   11   26    9 o  142.658   2.2707  424.729   13.240  377.120   19.286  467.166   18.209  134.994   3.4639  150.322   2.9369 -15.32809 4.541387 
1 1 1   11   26   10 o   96.696   2.3563  197.035   9.0377  179.530   14.610  207.887   11.503   93.104   3.8046  100.288   2.7809 -7.183319 4.712569 
1 1 1   11   26   11 o   27.308   5.2432   15.305   5.8352   19.501   9.9930   13.134   7.1880   29.932   7.9575   24.685   6.8295 5.247229 10.48637 
1 1 1   11   26   12 o  143.094   2.2856  423.772   13.484  439.816   19.165  408.046   18.974  145.783   3.1875  140.405   3.2766 5.377914 4.571190 
1 1 1   11   26   13 o   55.629   4.1470   65.490   8.9433   67.177   11.004   62.208   15.349   56.830   4.6948   54.428   6.8373 2.402332 8.293955 
1 1 1   11   26   14 o   68.324   3.3967   94.259   9.3756   83.498   11.886  111.979   15.253   63.354   4.5489   73.294   5.0457 -9.940136 6.793495 
1 1 1   11   26   15 o   76.624   5.4131  139.607   12.104  147.567   13.340  102.548   28.784   84.311   3.8363   68.937   10.124 15.37434 10.82617 
1 1 1   11   26   16 o   77.330   2.8098  125.674   8.8560  107.097   12.802  142.725   12.264   71.732   4.3270   82.928   3.5857 -11.19605 5.619606 
1 1 1   11   26   17 o   80.844   4.4172  154.532   11.928  107.689   23.496  170.797   13.845   71.022   8.0211   90.666   3.7024 -19.64466 8.834349 
1 1 1   11   26   18 o   93.955   3.3643  196.985   12.090  142.655   19.422  231.358   15.449   82.382   5.7162  105.528   3.5494 -23.14614 6.728543 
1 1 1   11   26   19 f   83.740   2.8343  146.906   9.7107  137.034   14.370  155.203   13.174   81.076   4.2972   86.405   3.6968 -5.328636 5.668509 
1 1 1   11   26   20 o   95.889   2.6512  191.403   10.451  190.497   15.391  192.178   14.237   95.643   3.9017   96.136   3.5906 -0.4926834 5.302414 
1 1 1   11   26   21 o   86.273   2.7371  156.219   9.6761  139.325   13.908  172.067   13.471   81.656   4.1296   90.889   3.5934 -9.233421 5.474164 
1 1 1   11   26   22 o   79.210   3.4694  128.101   10.912  118.633   13.494  145.992   18.549   75.268   4.3467   83.151   5.4086 -7.883759 6.938822 
1 1 1   11   26   23 o   77.144   3.4333  120.848   10.701  104.499   13.566  147.777   17.411   70.536   4.6632   83.753   5.0402 -13.21632 6.866525 
1 1 1   11   26   24 o   84.396   3.6568  150.634   12.682  156.176   17.417  144.381   18.501   86.148   4.9019   82.644   5.4278 3.503838 7.313682 
1 1 1   11   26   25 o   85.149   3.4190  152.365   11.720  150.963   15.001  154.562   18.778   84.840   4.2869   85.458   5.3275 -0.6170578 6.838097 
1 1 1   11   26   26 o   32.811   6.1281   22.563   8.5951   13.630   10.918   37.122   13.938   25.386   8.6772   40.237   8.6557 -14.85094 12.25626 
1 1 1   11   26   27 o   31.868   8.1380   20.661   10.157   21.096   10.693   16.635   32.505   30.360   8.3009   33.376   14.000 -3.015766 16.27596 
1 1 1   11   26   28 o   25.854   6.2672   14.519   8.5465   19.849   10.508   4.1056   14.689   29.384   8.3033   22.323   9.3898 7.061663 12.53444 
1 1 1   11   26   29 o   45.748   5.6010   48.754   9.6636   52.551   12.076   41.993   16.114   49.396   5.9275   42.100   9.5052 7.295090 11.20197 
1 1 1   11   26   30 o   35.105   7.7847   30.109   12.493   35.611   18.990   25.910   16.589   37.549   11.322   32.661   10.687 4.888802 15.56935 
1 1 1   11   26   31 o   29.105   7.0266   19.187   9.6851   17.706   11.820   22.212   16.895   27.607   9.0209   30.602   10.776 -2.994513 14.05328 
1 1 1   11   26   32 o   80.707   3.7990  139.128   12.198  133.787   15.238  148.654   20.350   79.052   4.6736   82.362   5.9907 -3.309723 7.598090 
1 1 1   11   26   33 o   30.457   6.5470   24.045   10.159   33.541   12.613   6.5060   17.141   37.311   8.3986   23.603   10.046 13.70837 13.09391 
1 1 1   11   26   34 o   41.367   6.8799   44.924   11.088   48.345   13.156   36.535   20.601   46.276   6.8927   36.457   11.909 9.819561 13.75989 
1 1 1   11   26   35 o   25.074   6.7307   4.5015   9.4281  -5.2184   10.937   32.623   18.603   15.827   7.2818   34.320   11.322 -18.49398 13.46132 
1 1 1   11   26   36 o   28.144   8.0819   15.632   10.806   13.839   11.542   28.374   30.766   24.381   8.8674   31.908   13.514 -7.527184 16.16383 
1 1 1   11   26   37 o   28.006   7.5288   18.004   10.508   14.692   11.969   29.140   21.946   24.644   9.0196   31.368   12.057 -6.723917 15.05757 
1 1 1   11   26   38 o   28.312   7.4232   21.899   10.972   22.388   12.714   20.472   21.719   28.846   9.3518   27.778   11.531 1.068489 14.84636 
1 1 1   11   27    0 o  123.492   2.5096  315.846   18.043  315.846   18.043  315.846   18.043  123.492   3.5490  123.492   3.5490 0.000000 0.000000 
1 1 1   11   27    1 o  164.586   2.3606  560.360   15.894  561.068   24.064  559.811   21.168  164.644   3.5437  164.527   3.1195 0.1169434 4.721137 
1 1 1   11   27    2 o  106.048   2.2685  232.263   9.9094  216.235   13.746  249.604   14.298  102.240   3.2599  109.857   3.1556 -7.616669 4.537005 
1 1 1   11   27    3 f  134.998   2.1829  376.823   12.149  392.397   17.303  361.681   17.061  137.754   3.0455  132.243   3.1280 5.511322 4.365751 
1 1 1   11   27    4 o   60.378   3.6179   75.262   8.9618   87.103   13.223   65.203   12.188   64.756   4.9509   56.000   5.2768 8.756470 7.235797 
1 1 1   11   27    5 o  228.722   2.9769  1088.28   27.831  1054.87   41.915  1114.62   37.220  225.484   4.5070  231.960   3.8905 -6.476852 5.953899 
1 1 1   11   27    6 o  121.815   2.3580  309.195   11.764  335.903   16.213  279.500   17.096  127.440   3.0846  116.191   3.5674 11.24823 4.716015 
1 1 1   11   27    7 o   69.608   2.6815  100.300   7.6922  102.341   11.146   98.445   10.629   70.279   3.8454   68.937   3.7382 1.341774 5.363004 
1 1 1   11   27    8 o   42.348   3.6076   36.862   6.2622   42.002   9.4989   32.912   8.3284   44.925   5.1265   39.771   5.0773 5.153965 7.215263 
1 1 1   11   27    9 o  217.673   2.6267  978.055   23.515  929.929   31.821  1035.95   34.901  211.821   3.6424  223.524   3.7857 -11.70369 5.253459 
1 1 1   11   27   10 o  144.521   2.2671  433.172   13.491  447.608   18.765  417.724   19.411  147.038   3.0943  142.004   3.3142 5.034119 4.534100 
1 1 1   11   27   11 o  147.858   3.4959  464.881   17.495  472.224   19.831  439.104   37.154  150.995   3.1843  144.721   6.2245 6.274017 6.991755 
1 1 1   11   27   12 o  153.714   2.7911  496.104   16.693  507.621   20.591  474.022   28.513  156.532   3.1894  150.895   4.5814 5.636703 5.582219 
1 1 1   11   27   13 o   63.373   2.9144   82.283   7.5452   92.409   11.695   75.064   9.8752   66.647   4.2547   60.100   3.9839 6.546917 5.828713 
1 1 1   11   27   14 o   93.952   2.8315  184.226   10.790  187.303   14.104  179.885   16.753   94.977   3.6005   92.927   4.3711 2.049927 5.663071 
1 1 1   11   27   15 o   68.211   3.4644   93.727   9.5170   81.823   11.981  114.077   15.666   62.604   4.6402   73.817   5.1454 -11.21316 6.928720 
1 1 1   11   27   16 o   42.592   5.1832   39.916   8.7272   47.238   12.063   31.875   12.642   47.325   6.1801   37.858   8.3229 9.467060 10.36647 
1 1 1   11   27   17 o   38.304   4.7963   36.869   6.8257   15.299   10.698   51.679   8.8644   26.822   8.5663   49.785   4.3170 -22.96284 9.592646 
1 1 1   11   27   18 o   17.744   5.5237  -0.3564   6.4673  -3.4893   14.661   0.4005   7.2063   20.128   8.9146   15.360   6.5250 4.767326 11.04745 
1 1 1   11   27   19 o   42.034   5.6203   53.597   8.5681   11.100   16.610   69.004   10.001   26.621   10.418   57.447   4.2211 -30.82600 11.24064 
1 1 1   11   27   20 o   65.342   3.1344   90.822   8.3020   79.663   12.441   99.781   11.147   61.553   4.9003   69.130   3.9096 -7.577023 6.268850 
1 1 1   11   27   21 o   63.520   3.1879   85.086   8.2813   80.609   12.344   88.751   11.167   61.912   4.8341   65.128   4.1574 -3.215931 6.375890 
1 1 1   11   27   22 o   41.854   4.9122   37.023   8.1665   29.476   10.639   47.848   12.742   36.394   7.3409   47.315   6.5293 -10.92068 9.824487 
1 1 1   11   27   23 o   54.369   4.1211   62.901   9.1310   63.553   12.066   62.028   13.968   54.827   5.3359   53.911   6.2819 0.9164619 8.242191 
1 1 1   11   27   24 o   15.432   5.0121  -6.8045   7.1419  -8.9933   9.2702  -3.6082   11.202   13.687   6.4323   17.178   7.6883 -3.490697 10.02419 
1 1 1   11   27   25 o   61.906   4.3369   81.916   11.054   75.580   15.248   88.933   16.047   59.353   6.2290   64.459   6.0361 -5.105904 8.673792 
1 1 1   11   27   26 o   30.001   6.4556   19.328   8.4634   15.248   10.520   26.813   14.250   26.248   8.5065   33.755   9.7128 -7.507109 12.91120 
1 1 1   11   27   27 o  106.044   3.1453  228.715   13.260  206.931   16.376  270.185   22.594   99.218   4.0018  112.870   4.8535 -13.65196 6.290544 
1 1 1   11   27   28 o   22.762   7.1233   4.3318   9.7111   7.2768   10.173 -25.8853   32.587   21.042   8.1756   24.481   11.667 -3.439325 14.24659 
1 1 1   11   27   29 o   54.111   4.5822   61.223   9.9170   52.754   12.322   76.794   16.708   49.242   6.0673   58.980   6.8683 -9.738590 9.164351 
1 1 1   11   27   30 o   60.914   4.5502   80.657   10.821   78.727   13.273   84.481   18.687   60.435   5.3251   61.394   7.3797 -0.9586868 9.100368 
1 1 1   11   27   31 o   28.334   7.6633   15.166   12.551   29.313   20.303   6.4152   15.968   33.518   11.812   23.149   9.7666 10.36871 15.32664 
1 1 1   11   27   32 o   47.589   5.6714   52.640   10.190   52.050   12.493   53.810   17.612   48.466   6.2495   46.712   9.4659 1.754429 11.34280 
1 1 1   11   27   33 o   27.673   6.9520   13.860   9.9724   5.0388   12.130   32.257   17.517   20.524   8.5765   34.822   10.944 -14.29827 13.90396 
1 1 1   11   27   34 o   62.189   4.7725   85.946   11.816   79.831   14.704   97.095   19.854   59.800   5.9616   64.578   7.4543 -4.777790 9.545051 
1 1 1   11   27   35 o   29.275   6.5786   23.263   9.7698   29.843   11.858   9.3540   17.240   34.592   8.3959   23.958   10.130 10.63357 13.15719 
1 1 1   11   27   36 o   39.217   6.8934   39.964   10.576   37.420   12.831   45.356   18.678   38.601   8.3056   39.832   11.004 -1.230560 13.78679 
1 1 1   11   27   37 o   26.495   8.6204   4.3161   11.227   0.3811   11.659   54.427   41.607   17.809   7.9156   35.181   15.316 -17.37212 17.24085 
1 1 1   11   28    0 o  107.450   2.5174  239.458   15.738  239.458   15.738  239.458   15.738  107.450   3.5601  107.450   3.5601 0.000000 0.000000 
1 1 1   11   28    1 o  153.206   2.3324  487.605   14.653  470.460   21.704  501.966   19.863  150.685   3.4922  155.728   3.0926 -5.042831 4.664742 
1 1 1   11   28    2 o   64.865   2.6931   87.282   7.2018   86.506   10.310   88.022   10.064   64.578   3.8709   65.153   3.7453 -0.5756912 5.386169 
1 1 1   11   28    3 o  175.970   2.2108  641.057   16.044  639.970   22.523  642.177   22.860  175.823   3.1058  176.117   3.1471 -0.2938080 4.421605 
1 1 1   11   28    4 o   47.855   3.7422   48.493   7.2634   53.406   9.7737   42.434   10.855   50.662   4.6775   45.047   5.8427 5.615139 7.484340 
1 1 1   11   28    5 o   22.670   5.4054   10.337   5.8413   7.7910   10.348   11.527   7.0766   22.104   8.3308   23.235   6.8901 -1.131609 10.81089 
1 1 1   11   28    6 o   46.807   3.2771   45.863   6.2866   42.389   9.1887   48.921   8.6197   45.102   4.9396   48.513   4.3080 -3.410904 6.554248 
1 1 1   11   28    7 o   77.151   2.4992  123.313   7.9486  128.400   11.431  118.550   11.060   78.692   3.5219   75.610   3.5467 3.081345 4.998321 
1 1 1   11   28    8 o  131.176   2.4302  355.097   13.109  320.033   17.916  395.498   19.232  124.227   3.4968  138.125   3.3758 -13.89832 4.860424 
1 1 1   11   28    9 o   54.187   3.0219   60.569   6.7004   65.077   10.269   57.226   8.8418   55.908   4.4535   52.467   4.0859 3.441250 6.043874 
1 1 1   11   28   10 o  118.942   3.6629  296.442   15.278  297.086   17.512  294.391   31.255  119.640   3.5490  118.243   6.4087 1.397079 7.325758 
1 1 1   11   28   11 o   44.425   4.5492   41.487   8.2961   40.331   11.139   42.927   12.432   43.771   6.1701   45.079   6.6867 -1.307167 9.098442 
1 1 1   11   28   12 o   32.175   5.0361   26.231   6.2233   12.538   11.719   31.609   7.3445   25.434   8.9728   38.916   4.5759 -13.48175 10.07218 
1 1 1   11   28   13 o   74.173   2.7591  113.976   8.4127  120.524   12.531  108.603   11.351   76.089   3.9931   72.258   3.8087 3.830345 5.518250 
1 1 1   11   28   14 o   89.917   2.8404  168.369   10.409  168.635   13.714  168.009   15.986   90.067   3.6917   89.768   4.3178 0.2990494 5.680832 
1 1 1   11   28   15 o  132.894   2.4506  365.362   13.377  350.599   17.983  383.653   20.017  129.932   3.3556  135.856   3.5724 -5.923676 4.901267 
1 1 1   11   28   16 o   76.442   2.9100  117.797   8.9012  139.141   14.910  105.979   11.095   81.563   4.4323   71.321   3.7718 10.24213 5.819974 
1 1 1   11   28   17 o   37.242   5.3367   28.572   8.1352   14.516   10.469   49.996   12.925   26.052   8.4886   48.431   6.4703 -22.37928 10.67339 
1 1 1   11   28   18 o   57.733   4.0022   70.985   9.2394   72.463   11.791   68.635   14.872   58.709   4.8695   56.758   6.3529 1.950676 8.004404 
1 1 1   11   28   19 o   37.280   5.8723   31.045   7.7364   30.174   16.208   31.302   8.8040   36.099   10.351   38.461   5.5500 -2.361816 11.74463 
1 1 1   11   28   20 o   65.700   4.3190   92.104   11.487   90.437   17.943   93.262   14.954   64.991   6.6939   66.409   5.4596 -1.418236 8.638019 
1 1 1   11   28   21 o   33.245   5.5246   24.391   7.6576   15.205   10.355   35.480   11.376   26.425   8.4265   40.064   7.1468 -13.63857 11.04911 
1 1 1   11   28   22 o   39.328   5.0813   34.230   8.0123   36.135   10.923   32.012   11.789   41.011   6.4578   37.644   7.8470 3.366421 10.16262 
1 1 1   11   28   23 o   64.253   3.6975   85.154   9.6606   70.179   12.563  106.818   15.111   57.507   5.2969   70.999   5.1603 -13.49193 7.394978 
1 1 1   11   28   24 f   56.707   4.0835   66.068   9.3616   54.234   11.934   85.002   15.095   50.373   5.7439   63.040   5.8057 -12.66639 8.166919 
1 1 1   11   28   25 o   59.692   4.2837   76.323   10.501   67.196   14.366   86.797   15.390   55.801   6.2421   63.584   5.8683 -7.782887 8.567407 
1 1 1   11   28   26 o   20.683   6.0003   4.8683   8.0579   5.2700   10.338   4.2466   12.862   20.135   8.1072   21.230   8.8480 -1.094378 12.00060 
1 1 1   11   28   27 o   37.955   5.8667   33.138   8.7680   31.046   11.231   36.403   14.032   36.711   7.6647   39.200   8.8841 -2.488182 11.73349 
1 1 1   11   28   28 o   51.372   4.8534   54.701   9.4961   35.620   11.938   87.583   15.671   39.305   7.6390   63.440   5.9891 -24.13466 9.706887 
1 1 1   11   28   29 f   27.429   7.7436   14.110   9.9869   14.453   10.603   11.413   29.721   25.268   8.5517   29.590   12.912 -4.322239 15.48711 
1 1 1   11   28   30 o   42.521   5.6640   41.717   9.3359   40.049   11.628   44.743   15.660   42.320   6.6621   42.723   9.1620 -0.4029922 11.32809 
1 1 1   11   28   31 o   50.975   6.4228   64.468   12.791   48.922   18.927   77.536   17.354   43.481   10.641   58.469   7.1961 -14.98771 12.84558 
1 1 1   11   28   32 o   23.284   6.3369   4.5034   9.2580  -6.6897   11.614   24.013   15.333   15.985   7.4074   30.584   10.284 -14.59911 12.67386 
1 1 1   11   28   33 o   17.965   5.7431  -2.8094   9.1842   3.2321   10.878 -17.8069   17.139   18.814   8.0050   17.116   8.2374 1.697565 11.48627 
1 1 1   11   28   34 o   23.872   6.4211   12.692   9.1493   17.385   11.116   2.8336   16.111   26.431   8.7533   21.312   9.3968 5.118551 12.84214 
1 1 1   11   28   35 o   49.144   7.7631   78.117   13.765   84.928   15.403   51.096   30.677   61.042   6.1180   37.246   14.270 23.79554 15.52615 
1 1 1   11   28   36 o   44.728   7.1724   78.840   14.097   87.870   14.907   2.5062   43.341   62.195   5.8113   27.262   13.115 34.93255 14.34473 
1 1 1   11   29    0 o   43.483   3.4575   40.665   8.4841   40.665   8.4841   40.665   8.4841   43.483   4.8897   43.483   4.8897 0.000000 0.000000 
1 1 1   11   29    1 o  158.235   2.6199  521.384   16.917  508.847   25.702  530.966   22.471  156.469   3.9827  160.001   3.4051 -3.532150 5.239868 
1 1 1   11   29    2 o   90.406   2.3448  169.433   8.7410  164.471   12.265  174.555   12.461   89.058   3.3391   91.754   3.2927 -2.696587 4.689506 
1 1 1   11   29    3 o   30.086   4.4477   18.979   5.5269   29.992   8.3405   10.357   7.3797   37.864   5.3407   22.308   7.1138 15.55615 8.895480 
1 1 1   11   29    4 o   55.429   3.2365   63.137   7.3169   58.329   9.5302   70.040   11.419   52.923   4.3661   57.936   4.7789 -5.013824 6.473070 
1 1 1   11   29    5 o   80.828   2.6722  136.252   8.7502  132.989   13.635  138.537   11.409   79.942   4.1355   81.714   3.3853 -1.771912 5.344394 
1 1 1   11   29    6 o  100.857   2.3870  209.635   9.8935  193.740   13.322  229.179   14.773   96.630   3.3428  105.084   3.4085 -8.454323 4.774075 
1 1 1   11   29    7 f   71.096   2.6187  105.063   7.6715  104.791   11.088  105.313   10.625   70.995   3.7867   71.197   3.6184 -0.2017899 5.237485 
1 1 1   11   29    8 o   74.096   2.6139  114.114   7.9650  102.847   11.120  125.985   11.414   70.318   3.8342   77.874   3.5537 -7.555809 5.227775 
1 1 1   11   29    9 o   49.250   3.3535   45.748   6.4551   68.625   11.597   35.478   7.7701   57.277   4.9089   41.222   4.5702 16.05540 6.707016 
1 1 1   11   29   10 o   43.966   4.6303   40.941   8.3571   41.626   11.346   40.128   12.355   44.426   6.1923   43.506   6.8857 0.9207840 9.260527 
1 1 1   11   29   11 o   70.119   3.3536  100.547   9.5283   91.746   12.184  114.407   15.289   66.308   4.4549   73.930   5.0141 -7.621933 6.707292 
1 1 1   11   29   12 o   32.908   5.3354   21.082   7.8878   7.1056   10.213   41.743   12.418   21.473   8.2319   44.343   6.7897 -22.87043 10.67074 
1 1 1   11   29   13 o   54.764   3.2978   65.218   7.0447   54.427   11.462   71.769   8.9307   50.825   5.4677   58.704   3.6885 -7.879051 6.595508 
1 1 1   11   29   14 o   82.864   3.1541  144.048   10.761  135.404   15.294  152.525   15.145   80.353   4.6147   85.375   4.3009 -5.022247 6.308177 
1 1 1   11   29   15 o   63.066   3.1559   87.449   7.7964   61.878   11.703  107.854   10.454   54.176   5.2374   71.956   3.5225 -17.78053 6.311793 
1 1 1   11   29   16 o   52.069   3.3234   57.364   6.9183   55.142   11.131   58.762   8.8316   51.118   5.2793   53.020   4.0386 -1.902199 6.646884 
1 1 1   11   29   17 o   86.772   2.6510  156.968   9.4727  160.068   13.841  154.238   12.992   87.553   3.8330   85.990   3.6632 1.562965 5.301921 
1 1 1   11   29   18 o   20.750   4.7873   8.6510   5.4609  -2.7119   9.4608   14.328   6.6873   16.063   7.1354   25.437   6.3842 -9.374229 9.574511 
1 1 1   11   29   19 o   33.528   5.3801   23.889   7.6820   13.226   10.196   37.886   11.683   25.039   8.3864   42.016   6.7416 -16.97692 10.76011 
1 1 1   11   29   20 o   49.981   6.2134   59.886   8.8346   50.932   22.072   61.594   9.6406   45.818   11.653   54.144   4.3170 -8.326305 12.42684 
1 1 1   11   29   21 o   67.763   4.8285  101.593   10.386   95.247   23.714  103.099   11.553   65.396   8.7922   70.130   3.9943 -4.734489 9.656984 
1 1 1   11   29   22 o   32.125   5.4141   23.563   6.8895   22.680   11.437   24.066   8.6313   31.382   8.5870   32.868   6.5963 -1.486214 10.82811 
1 1 1   11   29   23 o   58.663   3.4409   73.427   8.2435   68.933   12.314   77.076   11.097   56.895   5.2476   60.430   4.4523 -3.534458 6.881835 
1 1 1   11   29   24 o   22.082   5.9274   7.7158   7.6190   3.0220   10.329   13.317   11.283   19.050   7.9335   25.114   8.8089 -6.064207 11.85490 
1 1 1   11   29   25 o   44.540   5.2783   46.338   8.9387   51.504   11.408   38.125   14.386   48.895   5.6572   40.186   8.9127 8.708076 10.55651 
1 1 1   11   29   26 o   50.807   4.4981   55.841   9.3397   51.975   12.257   61.194   14.423   48.860   6.0821   52.755   6.6287 -3.895237 8.996162 
1 1 1   11   29   27 o   29.981   6.1800   21.870   8.2927   25.879   10.807   16.131   12.932   33.178   7.9926   26.783   9.4280 6.395166 12.35994 
1 1 1   11   29   28 o   24.937   6.0153   13.960   8.0017   20.042   10.352   4.9340   12.612   28.950   8.2625   20.924   8.7446 8.026217 12.03064 
1 1 1   11   29   29 o   55.284   4.5698   65.124   10.046   57.649   12.393   79.448   17.155   51.217   5.8667   59.350   7.0082 -8.132763 9.139619 
1 1 1   11   29   30 o   39.675   8.1129   24.833   10.649   16.564   11.401   81.394   29.816   26.418   8.8678   52.932   13.588 -26.51469 16.22582 
1 1 1   11   29   31 o   52.205   4.9534   58.166   10.290   46.261   12.698   80.935   17.561   45.077   6.8300   59.334   7.1760 -14.25668 9.906801 
1 1 1   11   29   32 o   25.491   7.3601   12.923   12.798  -2.0240   22.912   19.703   15.430   23.031   10.575   27.952   10.240 -4.920977 14.72028 
1 1 1   11   29   33 o   20.131   6.6388  -1.4554   10.915   2.9749   11.609 -35.2177   32.048   18.995   8.1796   21.268   10.459 -2.273252 13.27750 
1 1 1   11   29   34 o   24.265   6.2618   11.884   11.478   26.061   12.283 -85.6452   32.218   31.406   9.0122   17.125   8.6960 14.28057 12.52360 
1 1 1   11   29   35 o   23.238   7.7821 -13.5219   19.344 -35.2062   24.814   20.073   30.886   18.094   8.9548   28.382   12.730 -10.28759 15.56412 
1 1 1   11   30    0 o   10.104   4.6641  -0.6702   6.7306  -0.6702   6.7306  -0.6702   6.7306   10.104   6.5960   10.104   6.5960 0.000000 0.000000 
1 1 1   11   30    1 o  140.129   2.3128  408.402   13.302  397.838   19.665  417.311   18.060  138.407   3.4448  141.852   3.0869 -3.444885 4.625540 
1 1 1   11   30    2 o   42.695   3.4277   38.810   5.9006   30.098   8.4640   47.047   8.2303   37.874   5.4183   47.515   4.1997 -9.641117 6.855340 
1 1 1   11   30    3 o   34.685   4.3120   27.045   5.7890   19.248   8.7292   33.167   7.7346   29.528   7.2264   39.843   4.7067 -10.31558 8.624074 
1 1 1   11   30    4 o  138.530   2.4230  402.606   13.586  422.770   17.859  374.903   20.933  142.793   3.0324  134.266   3.7801 8.527161 4.846099 
1 1 1   11   30    5 o   48.118   3.8800   53.157   6.9447   35.431   11.374   63.695   8.7693   40.902   6.7419   55.334   3.8424 -14.43178 7.759989 
1 1 1   11   30    6 o   79.071   2.4775  129.893   8.0795  129.287   11.448  130.495   11.405   78.885   3.5185   79.257   3.4888 -0.3723602 4.954998 
1 1 1   11   30    7 o  118.239   2.7690  290.785   13.400  288.670   17.851  293.516   20.282  117.814   3.6737  118.663   4.1440 -0.8489304 5.537960 
1 1 1   11   30    8 o   38.005   4.6421   33.698   6.4070   24.733   11.087   38.192   7.8504   33.260   8.1469   42.750   4.4524 -9.489517 9.284168 
1 1 1   11   30    9 o   64.788   3.2072   83.730   8.2962   72.461   10.278  104.800   14.054   58.890   4.2316   70.686   4.8205 -11.79573 6.414365 
1 1 1   11   30   10 o  128.121   2.4877  337.446   12.306  329.657   14.893  354.203   21.845  126.028   2.8652  130.213   4.0675 -4.184929 4.975349 
1 1 1   11   30   11 o   20.540   5.5852   5.5453   6.4977   2.8215   8.1026   10.453   10.876   17.449   7.1216   23.632   8.6058 -6.182722 11.17038 
1 1 1   11   30   12 o   57.009   3.5647   65.473   7.9225   59.956   9.5700   77.487   14.123   53.509   4.3363   60.509   5.6590 -7.000175 7.129376 
1 1 1   11   30   13 o   35.759   5.1329   28.029   7.0904   26.990   8.8832   29.854   11.770   35.092   6.3723   36.427   8.0486 -1.335674 10.26579 
1 1 1   11   30   14 o   92.579   4.1454  160.956   11.159  153.115   11.959  213.771   31.037   85.749   3.3815   99.409   7.5698 -13.66000 8.290747 
1 1 1   11   30   15 o   55.023   3.2373   65.677   6.9514   56.197   11.393   71.300   8.7739   51.575   5.3558   58.471   3.6382 -6.895538 6.474643 
1 1 1   11   30   16 o   70.344   3.1147  106.487   8.5836   94.212   14.110  113.699   10.815   66.837   5.1184   73.851   3.5506 -7.013336 6.229366 
1 1 1   11   30   17 o   43.332   4.2113   42.190   6.6198   36.154   11.693   45.037   8.0308   40.321   7.2997   46.343   4.2016 -6.021740 8.422502 
1 1 1   11   30   18 o   41.758   3.8344   37.426   6.2868   35.747   10.509   38.361   7.8455   40.822   6.2419   42.695   4.4553 -1.873074 7.668867 
1 1 1   11   30   19 o   41.338   3.9619   36.834   6.4324   34.823   10.711   37.968   8.0446   40.230   6.4553   42.445   4.5953 -2.214531 7.923877 
1 1 1   11   30   20 o   94.204   2.6225  186.719   10.137  171.556   14.665  200.593   14.028   90.436   3.9316   97.972   3.4715 -7.536690 5.244947 
1 1 1   11   30   21 f   42.488   9.3528   42.356   15.946   42.356   15.946   0.0000   0.0000   42.488   9.3528  ?   ?       ?      ? 
1 1 1   11   30   22 o   29.652   6.7076   19.398   8.6584   22.268   16.169   18.244   10.252   31.096   10.560   28.208   8.2739 2.888100 13.41521 
1 1 1   11   30   23 o   20.389   5.2907   7.7501   6.0404   2.8595   9.5894   10.967   7.7773   18.354   7.6439   22.425   7.3168 -4.070734 10.58135 
1 1 1   11   30   24 o   90.085   3.2674  170.559   12.035  157.327   15.812  188.788   18.558   86.080   4.4535   94.089   4.7822 -8.008408 6.534770 
1 1 1   11   30   25 o   20.099   5.8071   5.0402   7.4902   4.7292   9.6198   5.5190   11.937   19.206   7.7896   20.993   8.6147 -1.787205 11.61424 
1 1 1   11   30   26 o   20.410   5.7682   5.9637   7.5503   9.7965   10.042   0.9783   11.452   22.162   8.2351   18.658   8.0791 3.504480 11.53642 
1 1 1   11   30   27 o   37.919   5.6562   32.630   8.7197   23.802   11.373   45.221   13.582   31.277   8.5648   44.560   7.3902 -13.28334 11.31242 
1 1 1   11   30   28 o   20.764   5.9929   5.8338   8.0862   3.5429   10.788   8.7718   12.217   19.167   8.0538   22.361   8.8767 -3.193323 11.98584 
1 1 1   11   30   29 o   60.956   4.1627   79.869   10.157   72.989   12.702   92.071   16.916   57.793   5.3290   64.119   6.3965 -6.325626 8.325456 
1 1 1   11   30   30 o   47.760   7.7746   56.126   11.433   53.723   12.360   70.356   30.082   48.938   6.1236   46.581   14.293 2.356850 15.54929 
1 1 1   11   30   31 f   29.994   7.3940   25.695   12.086   31.409   13.215  -3.5196   29.881   35.017   9.0756   24.972   11.676 10.04490 14.78806 
1 1 1   11   30   32 o   24.751   8.3797  -5.0066   20.999  -3.7359   23.736  -9.5830   45.046   22.549   10.497   26.954   13.065 -4.404844 16.75932 
1 1 1   11   30   33 o   24.178   7.9055   2.7133   18.373   5.6202   23.412  -1.9472   29.644   24.080   10.916   24.277   11.438 -0.1973343 15.81101 
1 1 1   11   31    0 o   15.059   5.7962   6.7971   7.2012   6.7971   7.2012   6.7971   7.2012   15.059   8.1971   15.059   8.1971 0.000000 0.000000 
1 1 1   11   31    1 o   84.317   2.5085  148.338   8.6633  145.325   12.964  150.770   11.646   83.491   3.7646   85.143   3.3163 -1.652954 5.016961 
1 1 1   11   31    2 o   71.701   2.5571  106.615   7.5372  112.940   11.225  101.422   10.171   73.612   3.6971   69.790   3.5336 3.822708 5.114209 
1 1 1   11   31    3 o   58.262   2.8061   70.689   6.7316   76.671   9.7799   65.303   9.2795   60.609   3.9123   55.916   4.0237 4.692787 5.612174 
1 1 1   11   31    4 o   75.618   2.7914  118.583   8.5314  115.457   10.955  123.400   13.600   74.446   3.5679   76.790   4.2939 -2.344345 5.582811 
1 1 1   11   31    5 o   68.449   2.9348   99.742   8.0383   89.718   12.645  106.538   10.413   65.381   4.6893   71.517   3.5302 -6.136337 5.869586 
1 1 1   11   31    6 o   79.803   2.7350  134.675   8.8155  123.113   13.583  143.089   11.587   76.693   4.2941   82.913   3.3884 -6.219337 5.469995 
1 1 1   11   31    7 o   74.628   2.5025  116.076   7.6915  124.035   10.936  108.286   10.819   77.182   3.4355   72.074   3.6396 5.108337 5.004971 
1 1 1   11   31    8 o   29.695   4.5299   19.663   5.2927   18.324   8.4019   20.544   6.8148   28.664   7.1349   30.725   5.5833 -2.061218 9.059777 
1 1 1   11   31    9 o   34.233   5.1414   25.887   6.8063   25.419   8.4936   26.728   11.378   34.056   6.2781   34.409   8.1438 -0.3531189 10.28281 
1 1 1   11   31   10 o   85.942   2.7751  148.515   9.0869  139.866   10.795  169.545   16.833   81.999   3.1918   89.885   4.5407 -7.885696 5.550288 
1 1 1   11   31   11 o   39.033   4.5790   29.849   6.8738   25.619   8.1400   40.365   12.833   34.770   5.6761   43.295   7.1868 -8.525314 9.157952 
1 1 1   11   31   12 o   78.222   2.9222  127.053   8.7472  125.449   10.533  130.617   15.702   77.638   3.2893   78.806   4.8309 -1.168060 5.844437 
1 1 1   11   31   13 o   37.270   4.8203   29.161   6.8701   26.855   8.3589   33.963   12.060   35.583   5.6955   38.957   7.7783 -3.373440 9.640610 
1 1 1   11   31   14 o   80.756   2.9618  125.075   9.0512  109.581   10.590  167.071   17.435   72.461   3.5435   89.052   4.7468 -16.59133 5.923567 
1 1 1   11   31   15 o   23.538   5.6836   11.215   7.0572   16.442   9.2609   3.9761   10.899   27.046   7.8439   20.031   8.2270 7.015217 11.36714 
1 1 1   11   31   16 o   65.729   3.3651   90.323   8.6069   88.616   10.513   93.793   14.988   65.038   3.9192   66.419   5.4713 -1.381607 6.730196 
1 1 1   11   31   17 o   89.679   2.6360  167.944   9.7307  153.792   13.450  183.489   14.096   85.696   3.8053   93.662   3.6488 -7.966637 5.272016 
1 1 1   11   31   18 o   93.110   2.5458  182.415   9.7210  164.336   13.969  199.391   13.536   88.524   3.8260   97.696   3.3594 -9.171753 5.091505 
1 1 1   11   31   19 o   34.952   4.8352   28.573   6.1168   23.506   11.360   30.641   7.2590   31.841   8.4933   38.063   4.6239 -6.222073 9.670441 
1 1 1   11   31   20 o   49.566   3.9314   55.499   7.4252   43.725   12.344   62.174   9.2947   44.808   6.6795   54.324   4.1484 -9.515804 7.862823 
1 1 1   11   31   21 o   18.475   4.9925   5.6509   5.4099   0.4691   9.3725   8.2399   6.6249   17.066   7.3493   19.885   6.7594 -2.819033 9.985043 
1 1 1   11   31   22 o   28.611   6.4403   16.565   7.8894   27.109   15.091   12.599   9.2549   33.321   10.103   23.901   7.9899 9.419947 12.88056 
1 1 1   11   31   23 o   36.024   6.2461   33.392   9.8683   16.988   16.236   43.003   12.427   27.970   10.456   44.077   6.8359 -16.10678 12.49226 
1 1 1   11   31   24 o   19.972   5.3441   7.3804   5.9387   5.4999   10.016   8.4000   7.3749   19.774   7.9734   20.170   7.1178 -0.3964462 10.68822 
1 1 1   11   31   25 o   40.323   4.5701   38.678   6.9415   27.721   10.783   46.432   9.0713   34.172   7.8197   46.475   4.7324 -12.30277 9.140233 
1 1 1   11   31   26 o   38.353   5.4551   34.197   8.2818   30.546   10.981   39.013   12.612   36.001   7.6323   40.706   7.7961 -4.705254 10.91018 
1 1 1   11   31   27 o   50.127   7.6025   65.365   11.276   65.658   12.196   63.641   29.596   54.828   5.3932   45.426   14.216 9.402264 15.20506 
1 1 1   11   31   28 o   30.434   8.1391   23.975   11.963   26.028   12.514   2.2141   40.738   32.055   9.0623   28.812   13.522 3.243382 16.27818 
1 1 1   11   31   29 o   37.323   9.6805   43.805   20.373   27.544   28.392   61.065   29.250   31.644   13.164   43.002   14.197 -11.35797 19.36101 
1 1 1   11   31   30 o   33.905   9.0177   35.315   18.712   49.668   24.540   15.379   28.922   39.623   13.000   28.187   12.501 11.43657 18.03546 
1 1 1   11   31   31 o   39.395   11.088   58.641   25.649   98.121   45.074   39.735   31.192   45.178   17.300   33.613   13.875 11.56417 22.17641 
1 1 1   11   31   32 o   38.181   10.726   48.034   21.913   31.633   24.994  102.511   45.552   31.337   12.610   45.024   17.354 -13.68698 21.45127 
1 1 1   11   32    0 o   37.912   3.9715   31.879   8.2157   31.879   8.2157   31.879   8.2157   37.912   5.6165   37.912   5.6165 0.000000 0.000000 
1 1 1   11   32    1 o   81.680   2.6086  139.490   8.6454  137.396   13.434  140.970   11.295   81.068   4.0179   82.291   3.3279 -1.223206 5.217148 
1 1 1   11   32    2 o   96.123   2.2890  192.252   9.0730  187.183   12.795  197.379   12.867   94.840   3.2711   97.407   3.2028 -2.567093 4.578030 
1 1 1   11   32    3 o   66.016   2.5883   90.890   7.0457   91.501   10.087   90.309   9.8452   66.226   3.6931   65.806   3.6274 0.4195328 5.176542 
1 1 1   11   32    4 o  114.194   2.2064  270.996   10.389  263.007   14.493  279.439   14.899  112.463   3.1245  115.925   3.1161 -3.462685 4.412760 
1 1 1   11   32    5 o   18.856   5.1638   4.8828   5.3143   7.1108   9.7879   3.9515   6.3282   21.068   8.0631   16.643   6.4532 4.425093 10.32753 
1 1 1   11   32    6 o   37.619   3.5922   29.211   5.4974   37.001   8.4162   23.414   7.2601   41.937   4.8658   33.302   5.2859 8.635750 7.184419 
1 1 1   11   32    7 o   72.562   2.4709  109.735   7.3847  117.244   10.513  102.420   10.376   75.033   3.3970   70.090   3.5892 4.943550 4.941878 
1 1 1   11   32    8 o   84.966   2.3660  150.168   8.2381  149.029   11.024  151.608   12.397   84.646   3.1577   85.286   3.5244 -0.6397095 4.732070 
1 1 1   11   32    9 o   89.973   3.1235  170.107   11.547  172.873   15.744  166.887   16.987   90.839   4.2023   89.107   4.6222 1.732468 6.246901 
1 1 1   11   32   10 o   33.642   5.8267   25.779   8.0950   20.705   11.363   31.007   11.535   30.185   8.6699   37.098   7.7868 -6.912848 11.65334 
1 1 1   11   32   11 o  112.168   3.9195  263.508   18.133  263.508   18.133   0.0000   0.0000  112.168   3.9195  ?   ?       ?      ? 
1 1 1   11   32   12 f   35.695   5.8623   29.181   8.4332   28.567   12.616   29.676   11.339   35.200   8.7319   36.190   7.8243 -0.9897919 11.72459 
1 1 1   11   32   13 o   62.092   3.8457   81.531   9.8168   73.202   13.399   91.182   14.424   58.652   5.5389   65.533   5.3365 -6.880764 7.691393 
1 1 1   11   32   14 o   77.857   3.4438  126.022   10.875   97.588   14.475  162.862   16.477   67.819   5.1750   87.894   4.5451 -20.07504 6.887571 
1 1 1   11   32   15 o   43.713   5.2539   43.173   8.9433   58.901   12.869   28.480   12.438   52.387   5.9558   35.039   8.6570 17.34845 10.50787 
1 1 1   11   32   16 o   95.870   3.3022  193.113   12.803  187.728   16.459  201.360   20.371   94.410   4.2270   97.331   5.0745 -2.920792 6.604402 
1 1 1   11   32   17 o   23.134   5.5370   6.3443   7.8174  -8.7542   10.887   22.418   11.233   15.189   7.0834   31.079   8.5124 -15.88967 11.07406 
1 1 1   11   32   18 o   69.656   3.0995   94.947   7.9991   86.187   9.2633  120.630   15.861   64.127   3.5024   75.186   5.1149 -11.05865 6.199082 
1 1 1   11   32   19 o   25.211   4.4268   16.411   5.0874   3.0679   9.3960   21.945   6.0511   18.281   7.5861   32.141   4.5647 -13.85977 8.853519 
1 1 1   11   32   20 o   57.223   3.3060   73.264   7.3860   53.210   11.285   88.290   9.7687   49.667   5.5092   64.779   3.6563 -15.11209 6.612071 
1 1 1   11   32   21 o   88.844   2.8571  169.432   10.159  155.690   16.067  178.585   13.112   85.494   4.5565   92.194   3.4484 -6.700073 5.714255 
1 1 1   11   32   22 o   34.913   5.0547   29.101   6.6305   24.185   11.767   31.388   8.0259   31.658   8.7297   38.168   5.0983 -6.510386 10.10948 
1 1 1   11   32   23 f   65.782   3.3092   95.507   8.6011   82.188   13.695  104.184   11.053   61.452   5.4032   70.113   3.8223 -8.661396 6.618456 
1 1 1   11   32   24 o   35.386   7.3678   28.471   10.810   45.335   19.927   21.439   12.868   41.238   11.355   29.534   9.3913 11.70356 14.73567 
1 1 1   11   32   25 o   17.887   5.4968   0.3165   7.6858  -3.8980   11.250   4.0051   10.525   16.609   7.5439   19.164   7.9970 -2.554863 10.99369 
1 1 1   11   32   26 f   62.315   6.8005   92.531   13.939  104.082   29.738   89.279   15.781   61.343   12.183   63.287   6.0456 -1.944187 13.60098 
1 1 1   11   32   27 o   30.656   8.2283   21.236   17.312   44.425   22.528 -12.2046   27.053   38.593   12.442   22.720   10.771 15.87295 16.45664 
1 1 1   11   32   28 o   25.886   8.3030   5.3327   19.488   15.903   22.461 -26.8536   39.195   27.340   11.562   24.432   11.920 2.907677 16.60593 
1 1 1   11   32   29 o   23.263   7.8073  -8.5399   20.138 -10.4258   27.476  -6.3510   29.601   22.622   10.762   23.904   11.313 -1.281713 15.61462 
1 1 1   11   32   30 o   26.438   8.1031   10.539   18.469   30.966   23.588 -21.8245   29.691   31.365   12.372   21.511   10.468 9.853880 16.20621 
1 1 1   11   33    0 o   60.371   2.8356   76.719   9.8838   76.719   9.8838   76.719   9.8838   60.371   4.0101   60.371   4.0101 0.000000 0.000000 
1 1 1   11   33    1 f   63.277   2.7449   83.928   7.1249   82.149   10.577   85.407   9.6398   62.611   4.0961   63.944   3.6551 -1.333267 5.489805 
1 1 1   11   33    2 o   53.562   2.8739   60.224   6.3366   56.796   9.0468   63.525   8.8782   52.031   4.2157   55.093   3.9071 -3.062256 5.747829 
1 1 1   11   33    3 o   95.914   2.2558  191.200   8.9127  179.137   12.302  204.526   12.930   92.729   3.2166   99.099   3.1635 -6.369843 4.511567 
1 1 1   11   33    4 o   35.140   3.9470   27.019   5.4840   23.460   8.1486   29.966   7.4144   32.589   6.2902   37.691   4.7695 -5.101456 7.894011 
1 1 1   11   33    5 o   23.078   5.2919   10.778   5.7555   15.121   9.0323   7.8092   7.4680   26.043   7.7982   20.114   7.1556 5.928976 10.58370 
1 1 1   11   33    6 o   53.370   2.8194   59.795   6.1941   55.861   8.7907   63.674   8.7293   51.592   4.1312   55.148   3.8379 -3.555443 5.638754 
1 1 1   11   33    7 o   84.341   2.9408  149.456   9.5285  148.932   16.843  149.703   11.555   83.960   4.8640   84.723   3.3068 -0.7636795 5.881612 
1 1 1   11   33    8 o  110.897   3.2659  258.577   14.903  250.334   20.270  268.275   21.986  109.036   4.5073  112.759   4.7275 -3.723259 6.531851 
1 1 1   11   33    9 o   26.034   5.8157   14.686   7.7925   3.3017   12.179   22.577   10.140   20.572   8.5950   31.497   7.8369 -10.92529 11.63147 
1 1 1   11   33   10 o   53.914   4.3009   61.611   9.5029   71.728   14.307   53.624   12.712   57.857   5.9954   49.971   6.1680 7.886292 8.601725 
1 1 1   11   33   11 o  113.048   3.1498  268.925   14.670  284.066   21.334  255.344   20.205  116.058   4.4569  110.037   4.4520 6.020988 6.299531 
1 1 1   11   33   12 o   56.206   4.2439   68.552   9.7274   58.829   14.020   77.577   13.508   52.119   6.5220   60.293   5.4318 -8.174423 8.487709 
1 1 1   11   33   13 o   29.544   7.9492   16.606   11.374   16.030   12.644   19.047   26.042   27.118   9.3353   31.970   12.869 -4.852634 15.89840 
1 1 1   11   33   14 o   44.991   5.9272   42.898   10.488   61.797   17.597   32.484   13.062   52.638   8.1053   37.343   8.6506 15.29578 11.85448 
1 1 1   11   33   15 o   57.091   4.4081   71.308   10.266   61.217   14.759   80.765   14.289   52.894   6.7655   61.289   5.6527 -8.395565 8.816176 
1 1 1   11   33   16 o   40.959   5.8445   39.032   9.5317   44.007   13.613   34.247   13.351   43.812   7.8201   38.105   8.6878 5.706738 11.68899 
1 1 1   11   33   17 o   27.939   6.4357   18.134   8.5466   16.151   12.563   19.843   11.661   26.840   9.3017   29.038   8.8968 -2.198044 12.87147 
1 1 1   11   33   18 o   69.663   3.6973  103.908   10.575  100.085   14.194  108.678   15.854   68.331   5.0364   70.994   5.4143 -2.663628 7.394574 
1 1 1   11   33   19 o   29.383   6.2637   20.593   8.2204   20.802   11.666   20.386   11.585   29.518   8.8681   29.248   8.8484 0.2703743 12.52744 
1 1 1   11   33   20 f   46.039   4.7183   47.365   8.9113   52.189   12.536   42.437   12.670   48.626   6.2508   43.452   7.0695 5.174442 9.436668 
1 1 1   11   33   21 o   47.973   7.4318   62.168   11.932   64.849   13.306   51.164   26.956   54.273   5.9444   41.674   13.623 12.59912 14.86353 
1 1 1   11   33   22 o   38.149   5.6797   34.524   8.8283   27.308   12.496   41.715   12.474   33.316   8.9176   42.981   7.0366 -9.664921 11.35946 
1 1 1   11   33   23 o   17.833   6.1799 -12.7134   9.4962 -15.4603   26.011 -12.2910   10.200   22.280   10.562   13.386   6.4192 8.894284 12.35977 
1 1 1   11   33   24 o   25.326   7.5245   10.986   11.081   11.106   26.515   10.961   12.197   27.469   12.085   23.184   8.9675 4.285442 15.04906 
1 1 1   11   33   25 o   31.151   8.1666   21.555   11.315   39.304   27.083   17.802   12.454   35.484   13.452   26.818   9.2632 8.666115 16.33327 
1 1 1   11   33   26 o   42.026   8.8049   53.041   19.683   89.106   27.743   16.492   27.929   55.529   12.424   28.523   12.480 27.00558 17.60979 
1 1 1   11   33   27 o   22.928   7.1642   5.1535   11.014   12.591   24.374   3.2449   12.347   26.418   11.606   19.439   8.4029 6.979132 14.32841 
1 1 1   11   33   28 o   16.835   5.5871 -10.7612   10.511 -47.8456   21.305   1.1679   12.083   15.287   7.6766   18.383   8.1199 -3.096349 11.17420 
1 1 1   11   33   29 o   24.382   7.9063   4.9383   17.500   2.1773   22.190   9.4801   28.460   22.853   10.462   25.911   11.857 -3.057373 15.81255 
1 1 1   11   34    0 o   20.925   6.2045   13.126   7.6044   13.126   7.6044   13.126   7.6044   20.925   8.7745   20.925   8.7745 0.000000 0.000000 
1 1 1   11   34    1 o   46.277   3.0866   45.309   5.8487   39.299   8.2941   51.253   8.2488   43.143   4.6611   49.412   4.0476 -6.268295 6.173252 
1 1 1   11   34    2 f   66.701   2.5520   93.122   7.0135   98.043   9.9280   88.219   9.9093   68.486   3.5148   64.916   3.7010 3.569244 5.104038 
1 1 1   11   34    3 o   52.191   2.8702   57.268   6.1707   55.468   8.8513   58.970   8.6073   51.364   4.1782   53.017   3.9362 -1.653629 5.740305 
1 1 1   11   34    4 o   47.252   3.1182   47.931   5.8997   35.060   8.3538   60.738   8.3333   40.663   4.9810   53.841   3.7526 -13.17852 6.236412 
1 1 1   11   34    5 o   69.188   2.8784  101.047   8.1094  103.620   10.736   97.627   12.375   70.331   3.7010   68.045   4.4095 2.286163 5.756856 
1 1 1   11   34    6 o   56.479   3.5043   66.899   7.4728   69.638   13.755   65.752   8.9011   56.977   5.8531   55.980   3.8551 0.9965744 7.008657 
1 1 1   11   34    7 o   32.822   5.8745   25.546   8.2238   16.782   12.205   32.833   11.129   27.486   9.1755   38.159   7.3380 -10.67207 11.74890 
1 1 1   11   34    8 o   30.652   5.7008   19.112   8.2909   37.884   12.668   5.0456   10.966   40.839   7.8053   20.466   8.3110 20.37350 11.40159 
1 1 1   11   34    9 o   79.272   3.3013  133.738   10.732  143.661   14.813  122.775   15.569   82.518   4.3522   76.027   4.9652 6.491806 6.602664 
1 1 1   11   34   10 o   16.159   5.1320  -4.2272   7.2962  -9.7927   10.917   0.2658   9.8087   14.916   7.0004   17.402   7.5062 -2.486289 10.26395 
1 1 1   11   34   11 o   57.330   3.9839   70.710   9.4012   71.948   12.970   69.339   13.647   57.943   5.4271   56.717   5.8337 1.226238 7.967793 
1 1 1   11   34   12 o   33.660   5.8979   26.593   8.2542   32.625   11.749   20.714   11.599   37.612   7.8284   29.709   8.8236 7.903427 11.79578 
1 1 1   11   34   13 o   68.189   5.6706   95.000   12.462   89.267   13.705  122.359   29.938   64.549   5.1480   71.830   10.106 -7.281425 11.34123 
1 1 1   11   34   14 o   42.178   5.6918   38.966   9.5590   61.990   15.102   23.575   12.347   52.944   6.9159   31.411   9.0419 21.53360 11.38363 
1 1 1   11   34   15 o   86.971   3.2150  161.614   11.466  167.778   15.604  154.378   16.905   88.951   4.2531   84.992   4.8225 3.958786 6.430074 
1 1 1   11   34   16 o   35.955   5.6318   29.709   8.6461   15.588   11.771   46.252   12.741   26.222   9.0086   45.689   6.7613 -19.46719 11.26363 
1 1 1   11   34   17 o   79.319   3.4744  135.361   11.317  136.413   15.352  134.110   16.747   79.817   4.6635   78.821   5.1515 0.9960709 6.948841 
1 1 1   11   34   18 o   28.222   6.2274   18.732   8.4808   10.810   11.943   26.789   12.045   23.312   8.9103   33.133   8.7021 -9.820921 12.45471 
1 1 1   11   34   19 f   37.955   7.8610   35.044   11.857   46.014   23.597   31.340   13.714   40.383   12.703   35.528   9.2632 4.854706 15.72197 
1 1 1   11   34   20 o   54.832   7.1912   79.280   13.051   66.187   26.760   83.366   14.949   48.126   13.121   61.537   5.8899 -13.41116 14.38232 
1 1 1   11   34   21 o   45.910   9.5339   62.860   19.252   64.220   26.343   61.301   28.206   46.965   13.103   44.854   13.853 2.111137 19.06779 
1 1 1   11   34   22 o   20.079   8.3434   5.2982   11.388   0.0000   0.0000   5.2982   11.388  ?   ?    20.079   8.3434      ?      ? 
1 1 1   11   34   23 o   19.829   6.4578  -1.6853   10.265  -9.8179   23.415   0.2494   11.421   21.699   10.206   17.960   7.9156 3.738455 12.91553 
1 1 1   11   34   24 o   25.496   7.0742   14.952   11.083  -5.7128   25.048   19.982   12.358   22.978   10.725   28.015   9.2273 -5.037579 14.14836 
1 1 1   11   34   25 o   54.358   7.5029   86.596   13.893   65.468   27.700   93.698   16.059   44.406   13.730   64.310   6.0546 -19.90386 15.00573 
1 1 1   11   34   26 f   20.828   6.6873   1.7950   10.927  -2.3697   23.416   2.9543   12.354   22.467   10.448   19.190   8.3503 3.277473 13.37469 
1 1 1   11   34   27 o   23.502   7.2821   8.3888   11.632   11.771   25.127   7.4665   13.122   25.792   11.531   21.212   8.8963 4.580271 14.56412 
1 1 1   11   35    0 o   33.312   4.8394   26.111   8.3079   26.111   8.3079   26.111   8.3079   33.312   6.8439   33.312   6.8439 0.000000 0.000000 
1 1 1   11   35    1 f  111.674   2.7021  261.712   12.430  256.924   17.090  267.090   18.111  110.630   3.7454  112.717   3.8958 -2.086243 5.404183 
1 1 1   11   35    2 o  110.884   2.3896  256.606   10.805  261.799   16.641  252.822   14.207  111.737   3.6110  110.031   3.1306 1.706429 4.779147 
1 1 1   11   35    3 o  102.096   2.6954  218.388   11.228  214.650   14.778  223.492   17.268  101.196   3.5408  102.995   4.0650 -1.799232 5.390872 
1 1 1   11   35    4 f   40.488   4.6063   39.731   6.4897   28.262   11.670   44.865   7.8082   34.849   8.2478   46.127   4.1042 -11.27802 9.212505 
1 1 1   11   35    5 o   71.408   4.9306  112.460   11.621  111.261   25.498  112.774   13.055   69.800   8.8571   73.017   4.3351 -3.216774 9.861136 
1 1 1   11   35    6 o   75.845   3.5383  123.636   10.983  110.311   15.877  135.866   15.211   71.704   5.3685   79.986   4.6107 -8.281830 7.076684 
1 1 1   11   35    7 o   79.363   3.4715  134.483   11.355  130.997   16.223  137.831   15.898   78.291   5.0240   80.435   4.7921 -2.143303 6.942980 
1 1 1   11   35    8 o   20.534   5.7100   5.1437   7.5032  -1.6592   10.580   12.028   10.643   17.140   7.5830   23.929   8.5391 -6.788551 11.42006 
1 1 1   11   35    9 f   50.504   4.1960   55.396   8.7284   55.774   12.063   54.980   12.645   50.758   5.7621   50.251   6.1012 0.5070724 8.392079 
1 1 1   11   35   10 o   28.556   6.1263   19.170   7.9353   22.310   11.037   15.810   11.417   30.714   8.4484   26.399   8.8741 4.314617 12.25255 
1 1 1   11   35   11 o   43.030   4.9264   41.294   8.4967   35.430   11.599   48.086   12.482   39.280   7.4313   46.780   6.4695 -7.499313 9.852862 
1 1 1   11   35   12 o   76.209   3.3324  124.016   10.435  123.579   14.153  124.537   15.446   76.176   4.5047   76.242   4.9120 -0.6665039E-01 6.664838 
1 1 1   11   35   13 o   29.500   7.5686   18.940   10.053   18.288   11.094   21.937   23.777   27.803   8.7043   31.198   12.384 -3.394424 15.13717 
1 1 1   11   35   14 o   37.827   5.9144   33.325   8.9474   42.723   13.856   26.603   11.718   42.475   8.2065   33.180   8.5189 9.294819 11.82872 
1 1 1   11   35   15 o   36.386   7.4743   28.904   10.445   48.275   21.904   23.202   11.884   41.996   12.030   30.776   8.8738 11.21969 14.94865 
1 1 1   11   35   16 o   23.838   6.3995   10.275   10.175 -21.5974   21.282   19.719   11.585   19.154   9.2084   28.521   8.8893 -9.366644 12.79901 
1 1 1   11   35   17 o   71.833   5.6375  123.239   14.006  110.395   27.716  127.644   16.232   66.921   10.041   76.744   5.1281 -9.822487 11.27502 
1 1 1   11   35   18 o   32.043   7.0754   28.362   10.563   11.848   23.396   32.590   11.838   27.215   11.663   36.871   8.0133 -9.656271 14.15081 
1 1 1   11   35   19 f   51.592   7.2306   64.809   12.973   74.952   26.666   61.663   14.849   51.156   12.698   52.027   6.9200 -0.8708801 14.46117 
1 1 1   11   35   20 o   20.811   6.4422   3.0490   10.293 -19.2336   22.929   8.6729   11.519   19.945   9.5804   21.677   8.6152 -1.732836 12.88434 
1 1 1   11   35   21 o   20.744   7.0201 -17.7056   17.194  -9.5228   22.546 -29.0799   26.582   21.367   10.038   20.120   9.8162 1.246918 14.04014 
1 1 1   11   35   22 o   40.648   8.2663   40.802   13.386   0.0000   0.0000   40.802   13.386  ?   ?    40.648   8.2663      ?      ? 
1 1 1   11   35   23 o   32.713   7.8489   31.035   12.168   27.720   24.986   32.065   13.932   30.726   12.519   34.699   9.4705 -3.972832 15.69785 
1 1 1   11   35   24 o   40.898   7.9275   38.517   11.901   75.789   26.092   28.726   13.373   49.170   12.757   32.626   9.4154 16.54407 15.85506 
1 1 1   11   35   25 o   32.773   7.5719   32.589   11.857   24.916   23.621   35.174   13.710   29.203   12.066   36.344   9.1516 -7.140528 15.14384 
1 1 1   11   36    0 o   42.929   3.3096   39.946   8.0371   39.946   8.0371   39.946   8.0371   42.929   4.6805   42.929   4.6805 0.000000 0.000000 
1 1 1   11   36    1 o   57.552   3.1874   70.669   7.5403   66.046   10.851   74.986   10.485   55.638   4.7287   59.466   4.2752 -3.827686 6.374766 
1 1 1   11   36    2 o   54.544   3.2860   65.251   6.8838   69.111   8.4943   57.867   11.749   57.319   3.5931   51.770   5.5027 5.549339 6.571918 
1 1 1   11   36    3 o   36.867   4.5545   30.403   6.0811   29.949   11.285   30.588   7.2189   35.846   7.8506   37.887   4.6196 -2.041740 9.108918 
1 1 1   11   36    4 o   45.468   3.9657   44.911   6.6963   44.280   12.456   45.168   7.9416   44.763   6.7466   46.173   4.1702 -1.409935 7.931391 
1 1 1   11   36    5 o   34.775   7.2544   26.710   9.3144   36.162   21.707   24.577   10.312   37.144   12.229   32.405   7.8078 4.739010 14.50885 
1 1 1   11   36    6 o   34.883   5.7472   28.485   8.0962   31.487   12.040   26.008   10.939   36.551   8.1897   33.214   8.0655 3.336895 11.49448 
1 1 1   11   36    7 o   21.201   5.8189   7.5977   7.2964   10.076   10.752   5.4821   9.9339   22.659   8.5013   19.743   7.9478 2.916277 11.63787 
1 1 1   11   36    8 o   46.037   4.6478   46.409   8.7734   40.896   11.731   53.407   13.216   42.945   6.6230   49.128   6.5225 -6.182827 9.295516 
1 1 1   11   36    9 o   19.172   5.4422   3.0451   7.0019   11.199   10.303  -3.9511   9.5443   23.051   8.3790   15.293   6.9471 7.757572 10.88440 
1 1 1   11   36   10 o   37.775   5.9801   34.535   9.0741   31.934   13.358   36.764   12.365   36.067   9.0069   39.484   7.8691 -3.416962 11.96020 
1 1 1   11   36   11 o   19.036   5.8003   0.9452   8.6582 -15.8420   16.373   7.4621   10.201   17.298   8.2512   20.774   8.1543 -3.475523 11.60064 
1 1 1   11   36   12 o   31.836   7.0037   25.458   9.7350   23.844   18.300   26.095   11.497   30.864   11.175   32.808   8.4460 -1.944447 14.00746 
1 1 1   11   36   13 o   31.681   7.8378   24.070   14.971   41.418   19.196  -2.8650   23.918   39.441   11.249   23.921   10.917 15.51999 15.67557 
1 1 1   11   36   14 o   71.382   5.0209  108.985   13.218  131.141   25.939  101.215   15.361   74.689   8.4204   68.075   5.4711 6.613861 10.04173 
1 1 1   11   36   15 o   49.049   6.9060   67.248   11.996   44.736   22.893   75.769   14.084   39.511   12.522   58.588   5.8284 -19.07732 13.81202 
1 1 1   11   36   16 o   32.935   7.3865   29.545   11.164   22.684   21.324   32.135   13.104   30.025   11.788   35.844   8.9037 -5.818964 14.77299 
1 1 1   11   36   17 o   42.890   6.1778   62.156   12.158   2.2581   23.727   83.484   14.158   24.355   11.019   61.425   5.5884 -37.07043 12.35555 
1 1 1   11   36   18 o   35.346   7.7720   33.345   11.240   36.147   25.035   32.638   12.579   34.540   12.970   36.152   8.5675 -1.611767 15.54400 
1 1 1   11   36   19 o   33.114   7.8634   28.545   11.031   34.033   25.766   27.313   12.206   33.486   13.011   32.741   8.8344 0.7455978 15.72677 
1 1 1   11   36   20 o   17.799   6.0502  -9.4441   9.9122 -11.0468   22.881  -9.0739   10.998   20.959   9.9274   14.639   6.9185 6.319889 12.10033 
1 1 1   11   36   21 o   24.064   7.3135   9.6711   11.025   13.574   24.920   8.7214   12.293   26.528   11.692   21.600   8.7890 4.927986 14.62703 
1 1 1   11   36   22 o   22.455   7.0469   5.8211   11.023   8.1148   24.377   5.2315   12.359   24.880   11.221   20.030   8.5276 4.850266 14.09376 
1 1 1   11   36   23 o   27.881   7.9119   17.702   11.837   33.710   25.486   13.299   13.366   31.921   12.773   23.841   9.3410 8.080889 15.82377 
1 1 1   11   37    0 o   34.361   4.9926   28.115   8.8406   28.115   8.8406   28.115   8.8406   34.361   7.0606   34.361   7.0606 0.000000 0.000000 
1 1 1   11   37    1 o   24.346   4.4799   13.320   4.9315   6.0804   6.8592   21.065   7.0952   18.135   6.7929   30.557   5.8426 -12.42195 8.959868 
1 1 1   11   37    2 o   24.679   5.2838   12.635   5.4602   19.223   10.132   9.9386   6.4820   28.311   8.2028   21.048   6.6624 7.263115 10.56752 
1 1 1   11   37    3 o   45.547   3.8906   44.891   6.6605   46.143   12.268   44.367   7.9311   45.480   6.5404   45.615   4.2156 -0.1354065 7.781235 
1 1 1   11   37    4 o   81.088   3.2889  139.986   10.940  153.025   16.561  129.892   14.571   84.332   4.7614   77.844   4.5385 6.487282 6.577894 
1 1 1   11   37    5 o   65.196   3.5946   89.819   9.6658   0.0000   0.0000   89.819   9.6658  ?   ?    65.196   3.5946      ?      ? 
1 1 1   11   37    6 o   49.516   6.7637   61.378   12.980   65.703   16.491   54.338   21.041   53.676   7.4490   45.356   11.292 8.320152 13.52738 
1 1 1   11   37    7 o   41.351   5.9532   42.291   9.4230   35.237   16.022   46.022   11.651   37.107   10.167   45.596   6.1956 -8.488392 11.90638 
1 1 1   11   37    8 o   90.155   4.2398  182.513   15.115  165.468   24.370  193.170   19.269   85.729   6.8923   94.581   4.9397 -8.851700 8.479657 
1 1 1   11   37    9 o   22.410   6.3088   8.9245   8.4568   6.4954   15.025   10.051   10.231   22.609   9.5028   22.210   8.3007 0.3992596 12.61769 
1 1 1   11   37   10 o   33.847   7.0140   27.848   10.092   36.074   17.016   23.384   12.534   37.051   10.600   30.642   9.1888 6.408951 14.02809 
1 1 1   11   37   11 o   44.596   6.2568   48.974   10.458   46.454   18.558   50.147   12.659   41.935   10.696   47.257   6.4950 -5.322754 12.51357 
1 1 1   11   37   12 o   18.408   5.9007  -1.8985   8.8949  -5.2298   16.903  -0.6227   10.461   19.748   9.0737   17.068   7.5461 2.680494 11.80148 
1 1 1   11   37   13 o   58.823   10.760   91.332   25.143   0.0000   0.0000   91.332   25.143  ?   ?    58.823   10.760      ?      ? 
1 1 1   11   37   14 o   20.773   6.0952   4.7905   9.4262 -17.4130   18.425   12.662   10.971   17.920   8.6027   23.627   8.6372 -5.706123 12.19047 
1 1 1   11   37   15 o   36.429   7.1926   33.841   10.425   39.891   19.797   31.520   12.262   37.303   11.619   35.555   8.4808 1.748104 14.38516 
1 1 1   11   37   16 o   32.647   7.1083   30.124   10.738   20.335   20.257   33.950   12.664   28.472   11.389   36.822   8.5091 -8.350719 14.21661 
1 1 1   11   37   17 o   70.266   5.2070  109.680   13.590  133.284   26.319  101.099   15.869   73.376   8.6965   67.157   5.7292 6.218536 10.41408 
1 1 1   11   37   18 f   40.875   7.7246   44.884   12.143   55.043   23.859   41.332   14.107   41.592   12.723   40.158   8.7634 1.433590 15.44918 
1 1 1   11   37   19 o   56.578   7.1223   87.940   13.510   79.107   26.830   90.940   15.637   50.004   12.918   63.152   6.0034 -13.14759 14.24452 
1 1 1   11   37   20 o   50.769   7.2776   72.077   13.062   66.774   25.538   73.956   15.201   45.171   13.004   56.367   6.5384 -11.19638 14.55522 
1 1 1   11   38    2 o   26.803   7.2754   16.654   10.509   19.689   11.397  -0.5622   27.147   28.312   8.8159   25.293   11.576 3.019571 14.55089 
1 1 1   11   38    3 o   46.501   7.8490   62.238   13.531   66.231   15.260   47.555   29.263   54.049   6.8456   38.953   14.127 15.09544 15.69802 
1 1 1   11   38    4 o   80.722   7.0971  178.203   18.918  205.550   22.905  119.512   33.555   96.462   5.7571   64.982   12.974 31.48021 14.19420 
1 1 1   11   38    5 o   63.306   12.680  112.715   31.953   0.0000   0.0000  112.715   31.953  ?   ?    63.306   12.680      ?      ? 
1 1 1   11   38    6 f   36.699   7.7066   41.514   13.881   49.670   15.768   13.425   29.262   44.834   8.8411   28.564   12.625 16.27084 15.41312 
1 1 1   11   38    7 o   44.564   7.4382   51.572   13.199   47.027   16.859   58.770   21.217   42.701   9.7824   46.426   11.208 -3.724777 14.87636 
1 1 1   11   38    8 o   40.052   6.2083   37.773   9.6695   50.081   16.383   31.194   11.978   44.553   9.2196   35.552   8.3170 9.000813 12.41664 
1 1 1   11   38    9 f   35.254   6.2473   33.941   9.6032   19.571   16.495   41.308   11.811   27.988   10.524   42.520   6.7349 -14.53185 12.49467 
1 1 1   11   38   10 o   21.231   5.7394   4.8487   9.0639 -25.2533   16.364   18.172   10.887   15.407   7.5555   27.055   8.6416 -11.64832 11.47876 
1 1 1   11   38   11 o   32.432   6.9970   26.101   9.5777   33.622   17.529   22.900   11.436   34.772   10.950   30.092   8.7132 4.680088 13.99401 
1 1 1   11   38   12 o   48.148   5.9251   51.163   10.843   74.218   20.160   41.779   12.862   54.762   8.9259   41.533   7.7947 13.22913 11.85029 
1 1 1   11   38   13 o   27.754   11.949   16.901   24.766   0.0000   0.0000   16.901   24.766  ?   ?    27.754   11.949      ?      ? 
1 1 1   11   38   14 o   33.747   7.3346   27.074   10.217   46.073   20.018   20.381   11.882   39.487   11.555   28.007   9.0367 11.48085 14.66922 
1 1 1   11   38   15 o   39.169   7.3433   38.958   10.991   53.781   21.435   33.671   12.802   42.233   11.833   36.104   8.6997 6.128624 14.68665 
1 1 1   11   38   16 o   32.642   7.7835   22.237   10.875   55.910   23.729   13.283   12.236   41.588   12.682   23.696   9.0280 17.89220 15.56708 
1 1 1   11   38   17 o   41.969   7.4905   43.618   11.389   65.923   23.905   37.070   12.953   45.955   12.348   37.983   8.4825 7.972260 14.98105 
1 1 1   11   39   11 o   23.076   7.6514  -0.7083   15.688  -1.1357   17.781   0.7933   33.327   20.554   9.3927   25.598   12.081 -5.044458 15.30272 
1 1 1   11   39   12 o   23.745   7.9250  -1.9081   16.209  -6.1973   18.210   14.455   35.567   19.521   9.1230   27.968   12.961 -8.446642 15.84995 
1 1 1   11   39   13 o   31.937   14.127   36.603   36.700   0.0000   0.0000   36.603   36.700  ?   ?    31.937   14.127      ?      ? 
1 1 1   12    0    0 o   25.021   7.1159   17.922   10.112   17.922   10.112   17.922   10.112   25.021   10.063   25.021   10.063 0.000000 0.000000 
1 1 1   12    0    1 o  285.002   2.4868  1676.09   41.326  1676.09   41.326  1676.09   41.326  285.002   3.5169  285.002   3.5169 0.000000 0.000000 
1 1 1   12    0    2 f   23.896   5.6441   15.144   7.0135   15.144   7.0135   15.144   7.0135   23.896   7.9819   23.896   7.9819 0.000000 0.000000 
1 1 1   12    0    3 o  191.081   2.1185  753.603   23.598  753.603   23.598  753.603   23.598  191.081   2.9960  191.081   2.9960 0.000000 0.000000 
1 1 1   12    0    4 o  437.808   3.3013  3955.36   84.281  3955.36   84.281  3955.36   84.281  437.808   4.6687  437.808   4.6687 0.000000 0.000000 
1 1 1   12    0    5 f  114.946   2.4130  273.240   16.146  273.240   16.146  273.240   16.146  114.946   3.4124  114.946   3.4124 0.000000 0.000000 
1 1 1   12    0    6 o   99.498   2.5261  204.983   14.618  204.983   14.618  204.983   14.618   99.498   3.5725   99.498   3.5725 0.000000 0.000000 
1 1 1   12    0    7 o  274.385   3.4739  1554.58   55.558  1554.58   55.558  1554.58   55.558  274.385   4.9129  274.385   4.9129 0.000000 0.000000 
1 1 1   12    0    8 o  248.076   3.3212  1270.88   48.019  1270.88   48.019  1270.88   48.019  248.076   4.6970  248.076   4.6970 0.000000 0.000000 
1 1 1   12    0    9 o  509.064   3.7216  5348.07  110.478  5348.07  110.478  5348.07  110.478  509.064   5.2631  509.064   5.2631 0.000000 0.000000 
1 1 1   12    0   10 o  438.042   3.3104  3959.72   84.560  3959.72   84.560  3959.72   84.560  438.042   4.6816  438.042   4.6816 0.000000 0.000000 
1 1 1   12    0   11 o   96.630   2.2010  193.186   12.377  193.186   12.377  193.186   12.377   96.630   3.1127   96.630   3.1127 0.000000 0.000000 
1 1 1   12    0   12 o  235.676   2.6967  1146.60   37.048  1146.60   37.048  1146.60   37.048  235.676   3.8137  235.676   3.8137 0.000000 0.000000 
1 1 1   12    0   13 o   78.751   3.3532  129.331   15.275  129.331   15.275  129.331   15.275   78.751   4.7422   78.751   4.7422 0.000000 0.000000 
1 1 1   12    0   14 o  605.412   6.1147  7575.52  215.827  7575.52  215.827  7575.52  215.827  605.412   8.6474  605.412   8.6474 0.000000 0.000000 
1 1 1   12    0   15 o  398.633   3.1385  3279.81   72.954  3279.81   72.954  3279.81   72.954  398.633   4.4385  398.633   4.4385 0.000000 0.000000 
1 1 1   12    0   16 o  569.601   4.1122  6698.92  136.591  6698.92  136.591  6698.92  136.591  569.601   5.8155  569.601   5.8155 0.000000 0.000000 
1 1 1   12    0   17 o  275.629   2.6026  1568.18   41.826  1568.18   41.826  1568.18   41.826  275.629   3.6807  275.629   3.6807 0.000000 0.000000 
1 1 1   12    0   18 o  343.689   2.9003  2438.31   58.124  2438.31   58.124  2438.31   58.124  343.689   4.1017  343.689   4.1017 0.000000 0.000000 
1 1 1   12    0   19 o  341.180   3.3935  2404.00   67.502  2404.00   67.502  2404.00   67.502  341.180   4.7991  341.180   4.7991 0.000000 0.000000 
1 1 1   12    0   20 o   78.159   3.1452  127.302   14.233  127.302   14.233  127.302   14.233   78.159   4.4480   78.159   4.4480 0.000000 0.000000 
1 1 1   12    0   21 o  180.587   2.9662  674.223   31.206  674.223   31.206  674.223   31.206  180.587   4.1948  180.587   4.1948 0.000000 0.000000 
1 1 1   12    0   22 o   74.673   5.7385  119.399   24.246  119.399   24.246  119.399   24.246   74.673   8.1154   74.673   8.1154 0.000000 0.000000 
1 1 1   12    0   23 o   60.773   5.4458   79.988   18.460   79.988   18.460   79.988   18.460   60.773   7.7016   60.773   7.7016 0.000000 0.000000 
1 1 1   12    0   24 o   62.185   5.1165   83.183   17.903   83.183   17.903   83.183   17.903   62.185   7.2358   62.185   7.2358 0.000000 0.000000 
1 1 1   12    0   25 o   42.784   8.1861   45.378   17.657   45.378   17.657   45.378   17.657   42.784   11.577   42.784   11.577 0.000000 0.000000 
1 1 1   12    0   27 o   14.810   7.0446  -7.2643   17.364  -7.2643   17.364  -7.2643   17.364   14.810   9.9626   14.810   9.9626 0.000000 0.000000 
1 1 1   12    0   28 o  162.922   3.7386  550.361   35.443  550.361   35.443  550.361   35.443  162.922   5.2872  162.922   5.2872 0.000000 0.000000 
1 1 1   12    0   29 o  136.576   3.2106  386.627   25.513  386.627   25.513  386.627   25.513  136.576   4.5405  136.576   4.5405 0.000000 0.000000 
1 1 1   12    0   30 o   29.279   10.098   26.463   20.326   26.463   20.326   26.463   20.326   29.279   14.280   29.279   14.280 0.000000 0.000000 
1 1 1   12    0   31 o  193.326   3.3378  773.984   37.588  773.984   37.588  773.984   37.588  193.326   4.7204  193.326   4.7204 0.000000 0.000000 
1 1 1   12    0   32 o   79.562   6.2731  136.563   28.185  136.563   28.185  136.563   28.185   79.562   8.8715   79.562   8.8715 0.000000 0.000000 
1 1 1   12    0   33 o   96.021   4.5386  193.801   25.159  193.801   25.159  193.801   25.159   96.021   6.4185   96.021   6.4185 0.000000 0.000000 
1 1 1   12    0   34 o  232.522   3.4779  1121.46   47.123  1121.46   47.123  1121.46   47.123  232.522   4.9186  232.522   4.9186 0.000000 0.000000 
1 1 1   12    0   35 o   31.405   13.092   27.451   40.949   27.451   40.949   27.451   40.949   31.405   18.515   31.405   18.515 0.000000 0.000000 
1 1 1   12    0   36 o   49.302   10.272   63.804   25.674   63.804   25.674   63.804   25.674   49.302   14.527   49.302   14.527 0.000000 0.000000 
1 1 1   12    0   37 o   35.192   10.817   38.443   22.988   38.443   22.988   38.443   22.988   35.192   15.297   35.192   15.297 0.000000 0.000000 
1 1 1   12    0   38 o   58.216   7.9017   79.886   23.973   79.886   23.973   79.886   23.973   58.216   11.175   58.216   11.175 0.000000 0.000000 
1 1 1   12    0   39 o   95.107   5.2044  194.020   28.474  194.020   28.474  194.020   28.474   95.107   7.3602   95.107   7.3602 0.000000 0.000000 
1 1 1   12    0   40 o   21.844   9.8460   6.1161   27.731   6.1161   27.731   6.1161   27.731   21.844   13.924   21.844   13.924 0.000000 0.000000 
1 1 1   12    0   41 o   23.089   9.6403   15.344   22.265   15.344   22.265   15.344   22.265   23.089   13.633   23.089   13.633 0.000000 0.000000 
1 1 1   12    0   42 o   19.587   9.0091   2.0650   24.786   2.0650   24.786   2.0650   24.786   19.587   12.741   19.587   12.741 0.000000 0.000000 
1 1 1   12    0   43 o   41.771   10.386   51.359   22.956   51.359   22.956   51.359   22.956   41.771   14.688   41.771   14.688 0.000000 0.000000 
1 1 1   12    0   44 o   15.775   7.5891  -8.1142   21.308  -8.1142   21.308  -8.1142   21.308   15.775   10.733   15.775   10.733 0.000000 0.000000 
1 1 1   12    0   45 o   61.106   6.7432   87.719   22.290   87.719   22.290   87.719   22.290   61.106   9.5363   61.106   9.5363 0.000000 0.000000 
1 1 1   12    0   46 o   14.565   7.1597 -14.1780   21.519 -14.1780   21.519 -14.1780   21.519   14.565   10.125   14.565   10.125 0.000000 0.000000 
1 1 1   12    0   47 o   43.047   11.947   63.564   28.743   63.564   28.743   63.564   28.743   43.047   16.895   43.047   16.895 0.000000 0.000000 
1 1 1   12    0   48 o   34.575   13.088   54.529   36.150   54.529   36.150   54.529   36.150   34.575   18.509   34.575   18.509 0.000000 0.000000 
1 1 1   12    1    0 f  241.270   2.2917  1201.26   32.238  1201.26   32.238  1201.26   32.238  241.270   3.2410  241.270   3.2410 0.000000 0.000000 
1 1 1   12    1    1 o  429.298   3.2459  3802.69   57.472  3801.04   81.238  3804.34   81.317  429.205   4.5891  429.392   4.5916 -0.1862183 6.491713 
1 1 1   12    1    2 o  262.162   2.3850  1417.77   25.789  1416.56   36.450  1418.98   36.491  262.050   3.3724  262.274   3.3734 -0.2236938 4.770032 
1 1 1   12    1    3 o  197.482   2.1427  804.430   17.452  799.707   24.598  809.218   24.764  196.898   3.0289  198.066   3.0315 -1.167389 4.285355 
1 1 1   12    1    4 o  313.297   2.6331  2024.81   34.021  2037.87   48.478  2012.14   47.756  314.292   3.7398  312.302   3.7076 1.989471 5.266140 
1 1 1   12    1    5 o  378.363   2.9714  2953.63   46.367  2940.34   65.193  2967.22   65.960  377.503   4.1871  379.223   4.2172 -1.720032 5.942733 
1 1 1   12    1    6 f  128.432   2.6944  343.332   13.998  357.293   18.314  323.717   21.708  131.606   3.3741  125.258   4.2019 6.347267 5.388867 
1 1 1   12    1    7 o  512.325   5.2895  5421.00  111.771  5423.15  158.211  5418.86  157.925  512.426   7.4858  512.224   7.4752 0.2017822 10.57907 
1 1 1   12    1    8 o  114.459   3.3600  270.254   15.862   0.0000   0.0000  270.254   15.862  ?   ?   114.459   3.3600      ?      ? 
1 1 1   12    1    9 o  490.853   3.6187  4966.74   73.159  5077.11  106.762  4869.03  100.452  495.980   5.2190  485.725   5.0142 10.25488 7.237416 
1 1 1   12    1   10 o  219.960   2.2358  998.054   20.283  1000.77   28.743  995.363   28.627  220.257   3.1640  219.662   3.1598 0.5952606 4.471568 
1 1 1   12    1   11 o  321.406   2.6954  2131.23   35.730  2122.60   50.319  2140.01   50.743  320.750   3.8036  322.062   3.8201 -1.311890 5.390792 
1 1 1   12    1   12 o  398.052   3.6098  3254.17   58.935  3126.69   78.666  3417.26   88.976  389.224   4.9003  406.880   5.3020 -17.65622 7.219684 
1 1 1   12    1   13 o  201.602   3.1961  838.758   26.575  833.420   37.390  844.206   37.777  200.954   4.5113  202.249   4.5288 -1.295578 6.392278 
1 1 1   12    1   14 o  287.535   5.1824  1706.98   61.459   0.0000   0.0000  1706.98   61.459  ?   ?   287.535   5.1824      ?      ? 
1 1 1   12    1   15 o   75.038   3.0909  117.252   9.4570  124.573   12.709  108.167   14.157   77.692   3.9660   72.384   4.7419 5.308220 6.181831 
1 1 1   12    1   16 o  224.995   2.4001  1044.36   22.269  1032.69   31.144  1056.57   31.854  223.710   3.3754  226.280   3.4131 -2.569611 4.800247 
1 1 1   12    1   17 o  224.277   3.1964  1012.69   28.608  1138.81   47.957  943.014   35.644  234.820   4.9516  213.735   4.0434 21.08461 6.392786 
1 1 1   12    1   18 o  435.994   3.3706  3925.31   60.603  3895.42   84.838  3956.47   86.599  434.303   4.7362  437.685   4.7972 -3.382080 6.741275 
1 1 1   12    1   19 o  117.784   2.5979  286.375   12.620  288.155   17.904  284.618   17.792  118.148   3.6741  117.420   3.6738 0.7273178 5.195727 
1 1 1   12    1   20 o  441.568   3.4005  4028.76   61.929  4035.23   87.770  4022.36   87.394  441.919   4.8155  441.216   4.8024 0.7028198 6.800914 
1 1 1   12    1   21 o  159.341   2.7374  522.244   17.527  515.009   22.319  533.885   28.311  157.934   3.4263  160.748   4.2702 -2.814255 5.474833 
1 1 1   12    1   22 o  225.504   3.3079  1016.29   28.977  1153.98   51.710  953.259   34.987  236.191   5.3081  214.816   3.9488 21.37480 6.615848 
1 1 1   12    1   23 o  229.403   3.0176  1087.34   28.550  1075.15   40.139  1099.81   40.616  228.102   4.2665  230.703   4.2685 -2.600708 6.035192 
1 1 1   12    1   24 o   69.957   4.2400  108.292   10.968  119.426   13.314   84.790   19.345   76.012   4.2469   63.902   7.3398 12.11002 8.479919 
1 1 1   12    1   25 o   92.531   3.8414  177.832   14.610  187.246   20.218  167.542   21.137   95.120   5.1534   89.941   5.6980 5.178963 7.682745 
1 1 1   12    1   26 o  115.786   4.6262  279.619   21.842  268.268   33.112  288.363   29.062  113.635   7.0649  117.938   5.9745 -4.302872 9.252461 
1 1 1   12    1   27 o   34.369   7.8246   24.222   12.595   24.377   17.391   24.051   18.264   34.346   10.917   34.392   11.212 -0.4565811E-01 15.64921 
1 1 1   12    1   28 o  182.811   3.0510  690.135   22.850  681.548   30.508  701.109   34.486  181.548   4.0743  184.075   4.5424 -2.526352 6.101910 
1 1 1   12    1   29 o  178.172   3.1335  655.838   22.925  646.017   30.893  667.874   34.201  176.716   4.2386  179.629   4.6163 -2.912445 6.267040 
1 1 1   12    1   30 o   75.741   4.9858  119.387   15.574  117.576   21.914  121.235   22.139   75.159   7.0691   76.323   7.0329 -1.164413 9.971660 
1 1 1   12    1   31 o  115.687   4.6105  285.323   21.244  310.051   27.490  248.654   33.475  122.222   5.4532  109.152   7.4357 13.06937 9.221058 
1 1 1   12    1   32 o  150.935   4.1112  469.024   25.210  501.147   39.734  447.379   32.616  155.126   6.2103  146.745   5.3889 8.380707 8.222468 
1 1 1   12    1   33 o   50.258   8.6497   57.097   17.723   50.327   27.009   62.216   23.487   47.456   13.277   53.061   11.089 -5.604485 17.29932 
1 1 1   12    1   34 o   92.901   4.6865  180.872   17.954  176.488   25.221  185.375   25.565   91.752   6.6647   94.051   6.5904 -2.298683 9.372912 
1 1 1   12    1   35 o   30.725   9.6856 -16.2616   25.239   11.939   39.039 -36.5118   33.082   36.585   15.344   24.866   11.824 11.71940 19.37120 
1 1 1   12    1   36 f   49.939   7.9255   54.283   16.940   87.683   25.591   28.232   22.601   63.518   9.7685   36.359   12.483 27.15873 15.85106 
1 1 1   12    1   37 o   48.993   8.3487   55.549   16.668   56.787   23.166   54.219   24.002   49.660   11.531   48.325   12.076 1.335079 16.69739 
1 1 1   12    1   38 o   72.134   7.0119  113.862   19.619  121.074   34.401  110.385   23.883   72.942   11.435   71.326   8.1186 1.615868 14.02374 
1 1 1   12    1   39 o   91.442   4.9742  179.661   18.760  179.421   26.404  179.905   26.658   91.397   7.0044   91.488   7.0648 -0.9157562E-01 9.948480 
1 1 1   12    1   40 o   38.693   9.2114   32.837   19.090   53.467   26.424   10.316   27.610   46.675   13.159   30.711   12.893 15.96463 18.42282 
1 1 1   12    1   41 o   28.926   8.3339   12.167   15.700   15.440   22.334   8.9687   22.076   30.063   11.981   27.789   11.588 2.273539 16.66776 
1 1 1   12    1   42 o   49.055   8.1685   64.101   20.516   4.8380   32.027  105.343   26.717   30.135   13.270   67.975   9.5296 -37.83984 16.33710 
1 1 1   12    1   43 o   35.344   9.9653   22.677   19.924   13.715   23.392   46.359   38.026   29.247   12.037   41.442   15.885 -12.19519 19.93059 
1 1 1   12    1   44 o   37.697   8.9322   37.027   16.273   40.186   24.493   34.531   21.774   38.829   12.998   36.565   12.255 2.264156 17.86438 
1 1 1   12    1   45 o   26.358   7.8803   9.5839   14.854   14.419   21.030   4.7696   20.985   27.867   11.435   24.849   10.846 3.018515 15.76055 
1 1 1   12    1   46 o   30.360   8.5476   20.670   16.311   12.823   22.788   28.914   23.356   27.558   11.649   33.162   12.512 -5.603846 17.09516 
1 1 1   12    1   47 o   27.260   8.4232   3.6849   19.507 -22.8416   27.531   30.430   27.644   21.542   10.386   32.977   13.264 -11.43538 16.84645 
1 1 1   12    1   48 o   34.698   10.356   36.483   29.267 -13.0642   48.022   65.761   36.915   27.821   13.486   41.575   15.719 -13.75401 20.71150 
1 1 1   12    2    0 o  309.122   2.6071  1971.79   46.993  1971.79   46.993  1971.79   46.993  309.122   3.6870  309.122   3.6870 0.000000 0.000000 
1 1 1   12    2    1 o  648.349   4.5546  8678.32  121.793  8665.80  171.867  8690.95  172.619  647.880   6.4318  648.818   6.4506 -0.9375000 9.109235 
1 1 1   12    2    2 o  155.924   2.0364  501.446   13.096  495.839   18.427  507.167   18.615  155.043   2.8816  156.804   2.8783 -1.761093 4.072863 
1 1 1   12    2    3 o  266.040   2.4133  1459.81   26.476  1445.20   37.072  1475.01   37.825  264.682   3.3959  267.397   3.4297 -2.715302 4.826521 
1 1 1   12    2    4 o  226.792   2.2490  1060.91   21.035  1069.35   29.967  1052.70   29.534  227.682   3.1912  225.903   3.1698 1.778290 4.497942 
1 1 1   12    2    5 o  530.300   3.8430  5803.76   84.045  5769.63  117.890  5839.04  119.850  528.717   5.4061  531.883   5.4633 -3.166260 7.685969 
1 1 1   12    2    6 o  645.981   5.5722  8617.18  139.872  8611.24  171.175  8629.10  242.640  645.830   6.4262  646.131   9.1049 -0.3002930 11.14432 
1 1 1   12    2    7 o  386.836   3.8927  3095.18   61.194  3128.71   80.208  3048.46   94.660  389.377   4.9944  384.295   5.9722 5.081482 7.785319 
1 1 1   12    2    8 o  745.833   6.3043 11523.74  184.003 11411.31  313.752 11582.69  227.171  742.791   10.241  748.876   7.3549 -6.085205 12.60867 
1 1 1   12    2    9 o  286.358   2.7076  1692.31   31.689  1687.92   48.138  1695.66   42.096  286.022   4.0806  286.694   3.5600 -0.6719666 5.415293 
1 1 1   12    2   10 o  747.666   5.1809 11547.44  159.764 11548.00  225.946 11546.89  225.935  747.684   7.3269  747.648   7.3269 0.3570557E-01 10.36182 
1 1 1   12    2   11 o  351.972   2.8425  2555.91   41.262  2540.87   57.970  2571.36   58.745  350.923   4.0052  353.021   4.0346 -2.097931 5.685039 
1 1 1   12    2   12 o  189.351   2.3469  736.623   18.047  756.733   28.270  722.791   23.445  191.517   3.5789  187.184   3.0369 4.332840 4.693733 
1 1 1   12    2   13 o  330.886   3.1996  2259.32   43.654  2272.01   62.542  2247.27   60.961  331.789   4.5703  329.983   4.4792 1.805969 6.399278 
1 1 1   12    2   14 o  340.591   4.5901  2394.49   64.479   0.0000   0.0000  2394.49   64.479  ?   ?   340.591   4.5901      ?      ? 
1 1 1   12    2   15 o  217.556   3.4202  977.091   30.664  1032.22   43.707  923.653   43.031  223.604   4.7392  211.508   4.9327 12.09552 6.840431 
1 1 1   12    2   16 o  242.404   2.4436  1212.48   24.429  1218.48   34.753  1206.63   34.348  242.996   3.4676  241.812   3.4439 1.183563 4.887186 
1 1 1   12    2   17 o  165.411   2.8305  564.496   19.305  577.542   27.709  552.192   26.911  167.267   4.0165  163.556   3.9893 3.710983 5.660994 
1 1 1   12    2   18 o  208.726   2.8945  898.779   24.902  917.266   35.982  881.784   34.499  210.782   4.1389  206.670   4.0473 4.111923 5.788920 
1 1 1   12    2   19 o   76.248   3.0474  120.045   9.5792  115.111   13.452  125.121   13.644   74.657   4.3687   77.839   4.2499 -3.181519 6.094847 
1 1 1   12    2   20 o  138.402   2.4413  395.312   13.932  400.045   19.981  390.835   19.435  139.207   3.4802  137.598   3.4246 1.609451 4.882541 
1 1 1   12    2   21 o  139.664   3.3551  415.410   18.210  443.764   22.728  364.577   30.432  146.583   3.7593  132.745   5.5583 13.83827 6.710243 
1 1 1   12    2   22 o  123.823   2.9623  317.422   14.608  314.343   23.954  319.245   18.432  123.313   4.7098  124.333   3.5943 -1.020546 5.924591 
1 1 1   12    2   23 o  205.057   2.7853  868.405   23.222  867.301   30.381  869.956   36.016  204.930   3.5944  205.184   4.2558 -0.2541656 5.570619 
1 1 1   12    2   24 o  180.919   2.7187  676.587   19.497  677.370   24.414  675.208   32.392  181.111   3.2684  180.727   4.3455 0.3849487 5.437472 
1 1 1   12    2   25 o  238.149   3.4846  1168.31   33.982  1133.16   45.133  1214.33   51.637  234.069   4.6750  242.228   5.1686 -8.159088 6.969260 
1 1 1   12    2   26 o   87.624   4.1284  158.337   14.864  168.174   22.218  150.368   19.998   90.064   5.9813   85.184   5.6920 4.879951 8.256815 
1 1 1   12    2   27 o  219.385   3.4245  996.044   30.984  1011.01   44.062  981.408   43.579  221.016   4.8336  217.754   4.8523 3.262222 6.848977 
1 1 1   12    2   28 o   76.900   5.5481  128.314   16.620  142.375   21.095  105.305   26.986   82.832   6.1747   70.967   9.2196 11.86510 11.09629 
1 1 1   12    2   29 o  148.430   3.4607  456.253   20.966  456.246   32.037  456.258   27.730  148.384   5.2347  148.476   4.5282 -0.9165955E-01 6.921476 
1 1 1   12    2   30 o   39.784   8.2343   34.126   14.376   35.026   20.135   33.190   20.532   40.224   11.537   39.345   11.752 0.8789444 16.46865 
1 1 1   12    2   31 o   91.336   4.8342  174.887   18.095  189.582   24.993  158.700   26.232   95.457   6.3481   87.215   7.2924 8.242622 9.668335 
1 1 1   12    2   32 o   75.725   5.6303  120.218   17.581  118.788   25.023  121.613   24.706   75.264   8.0610   76.185   7.8626 -0.9205246 11.26050 
1 1 1   12    2   33 o   88.837   5.0358  165.080   18.436  155.940   25.743  174.702   26.415   86.294   7.2330   91.380   7.0086 -5.086403 10.07153 
1 1 1   12    2   34 o   64.468   6.9436   90.756   17.824   98.002   24.203   82.171   26.346   67.976   8.6329   60.960   10.878 7.015965 13.88713 
1 1 1   12    2   35 o  101.626   4.5332  216.293   18.924  225.087   28.271  209.153   25.473  103.426   6.6273   99.826   6.1868 3.599899 9.066327 
1 1 1   12    2   36 o  109.285   4.9295  249.090   21.300  239.353   26.369  267.372   36.131  106.645   5.9950  111.925   7.8269 -5.279442 9.859088 
1 1 1   12    2   37 o   41.581   8.2497   39.372   15.934   58.539   22.150   18.813   22.939   50.659   10.922   32.503   12.367 18.15564 16.49940 
1 1 1   12    2   38 f   58.542   6.8806   77.074   16.184   80.077   22.280   73.719   23.549   60.414   8.9415   56.671   10.460 3.743488 13.76117 
1 1 1   12    2   39 o   37.543   9.0438   32.477   17.002   38.238   22.910   25.414   25.367   40.095   12.502   34.992   13.072 5.102951 18.08756 
1 1 1   12    2   40 o   53.710   7.7637   68.319   16.920   44.607   23.955   91.929   23.903   42.904   12.665   64.517   8.9830 -21.61261 15.52746 
1 1 1   12    2   41 o   31.747   8.5626   19.061   16.082   29.016   22.475   8.6166   23.021   35.427   12.432   28.066   11.778 7.361483 17.12510 
1 1 1   12    2   42 o   33.790   8.9940   22.630   19.309  -8.4333   31.743   40.876   24.328   27.326   12.511   40.255   12.925 -12.92886 17.98793 
1 1 1   12    2   43 o   41.402   10.423   46.100   21.789   47.927   25.913   41.691   40.256   42.658   13.295   40.147   16.056 2.510868 20.84604 
1 1 1   12    2   44 o   42.597   8.4298   46.419   16.080   30.042   21.966   65.328   23.604   34.562   12.275   50.631   11.558 -16.06936 16.85962 
1 1 1   12    2   45 o   53.841   7.3175   72.739   15.743   52.748   22.088   93.381   22.445   44.449   11.837   63.233   8.6061 -18.78374 14.63499 
1 1 1   12    2   46 o   34.288   9.1876   32.009   18.062   36.436   23.626   25.785   28.018   36.146   12.741   32.430   13.240 3.715282 18.37530 
1 1 1   12    2   47 o   36.866   9.6501   41.768   19.876   52.209   28.110   31.329   28.109   40.535   13.922   33.197   13.367 7.337959 19.30013 
1 1 1   12    2   48 o   33.692   10.393   30.644   30.968 -22.2141   50.235   63.045   39.330   27.320   13.364   40.064   15.920 -12.74363 20.78581 
1 1 1   12    3    0 o  336.444   2.7462  2335.75   53.875  2335.75   53.875  2335.75   53.875  336.444   3.8837  336.444   3.8837 0.000000 0.000000 
1 1 1   12    3    1 o  141.767   2.0215  414.500   11.819  409.581   16.596  419.563   16.836  140.913   2.8554  142.620   2.8621 -1.706711 4.042918 
1 1 1   12    3    2 o  220.401   2.2234  1002.04   20.211  1002.70   28.605  1001.40   28.561  220.473   3.1457  220.330   3.1429 0.1430206 4.446772 
1 1 1   12    3    3 f  270.293   2.4295  1506.76   27.079  1487.86   37.859  1526.56   38.748  268.559   3.4180  272.028   3.4536 -3.469238 4.858994 
1 1 1   12    3    4 o  148.028   2.0467  451.986   12.496  451.106   17.607  452.879   17.738  147.883   2.8866  148.173   2.9024 -0.2902069 4.093483 
1 1 1   12    3    5 o  731.109   5.4837 11036.53  163.492 11008.08  215.501 11075.10  250.952  730.091   7.1566  732.128   8.3107 -2.036987 10.96744 
1 1 1   12    3    6 o  217.749   2.7253  980.136   23.193  984.320   28.586  972.076   39.676  218.445   3.1728  217.054   4.4320 1.390839 5.450614 
1 1 1   12    3    7 o  279.847   3.2039  1614.08   36.222  1606.84   46.687  1625.02   57.414  279.076   4.0561  280.618   4.9606 -1.542755 6.407733 
1 1 1   12    3    8 o  393.438   3.7275  3207.17   57.491  3154.57   97.520  3235.19   71.174  390.905   6.0486  395.970   4.3581 -5.064423 7.455096 
1 1 1   12    3    9 o  384.345   4.2345  3049.14   67.113  3020.93   93.834  3078.68   96.028  382.529   5.9475  386.161   6.0293 -3.632751 8.469024 
1 1 1   12    3   10 o  151.206   2.4346  471.669   15.183  471.481   21.530  471.854   21.414  151.176   3.4529  151.236   3.4330 -0.5999756E-01 4.869117 
1 1 1   12    3   11 o  695.615   5.0446  9970.20  139.309 10086.91  231.402  9903.85  174.468  698.647   8.0305  692.583   6.1077 6.064209 10.08927 
1 1 1   12    3   12 o  327.245   2.9605  2197.84   39.187  2269.83   62.253  2150.60   50.434  331.641   4.5512  322.850   3.7875 8.791077 5.921031 
1 1 1   12    3   13 o  297.324   3.0361  1824.53   37.229  1806.81   52.787  1842.06   52.513  295.886   4.3255  298.761   4.2617 -2.875458 6.072237 
1 1 1   12    3   14 o  221.781   2.3615  1013.41   21.583  1049.21   31.333  981.089   29.772  225.502   3.3688  218.060   3.3103 7.441650 4.723042 
1 1 1   12    3   15 o  105.561   3.8607  236.036   16.362  267.056   21.793  195.955   24.772  113.736   4.6457   97.386   6.1673 16.35028 7.721301 
1 1 1   12    3   16 o  219.728   2.5962  997.071   23.231  1000.62   30.554  992.206   35.765  220.205   3.3641  219.250   3.9551 0.9548798 5.192306 
1 1 1   12    3   17 o  451.441   3.4447  4206.83   64.102  4269.69   92.493  4148.73   88.921  454.676   4.9322  448.206   4.8102 6.470154 6.889435 
1 1 1   12    3   18 o  537.208   3.9374  5963.91   87.241  5955.28  123.154  5972.61  123.602  536.819   5.5623  537.597   5.5745 -0.7778931 7.874883 
1 1 1   12    3   19 f  138.717   2.4239  397.090   13.865  392.454   19.388  401.943   19.837  137.889   3.4090  139.544   3.4466 -1.655594 4.847773 
1 1 1   12    3   20 o  173.569   2.4041  621.643   17.207  608.356   24.036  635.611   24.644  171.668   3.3947  175.471   3.4052 -3.802704 4.808255 
1 1 1   12    3   21 o  179.282   3.1323  658.940   21.060  651.620   24.963  677.016   39.227  177.646   3.4070  180.918   5.2570 -3.271896 6.264537 
1 1 1   12    3   22 o  107.285   3.4066  239.167   14.887  246.244   19.737  229.826   22.675  109.159   4.3839  105.411   5.2156 3.747612 6.813287 
1 1 1   12    3   23 o  206.115   4.0168  879.276   34.030  879.693   50.258  878.923   46.242  206.129   5.9116  206.101   5.4399 0.2798462E-01 8.033661 
1 1 1   12    3   24 o  162.023   3.3254  534.632   18.981  527.154   21.702  558.968   39.150  159.769   3.2934  164.277   5.7781 -4.508057 6.650796 
1 1 1   12    3   25 o  126.625   3.4968  333.871   18.025  346.357   23.916  317.452   27.425  129.421   4.4805  123.829   5.3698 5.591240 6.993501 
1 1 1   12    3   26 o  126.760   3.5137  332.839   18.288  293.092   25.554  374.568   26.183  118.973   5.2077  134.546   4.7183 -15.57288 7.027307 
1 1 1   12    3   27 o  189.778   3.5791  744.665   27.960  761.601   41.023  729.972   38.210  191.771   5.1865  187.784   4.9335 3.986816 7.158166 
1 1 1   12    3   28 o   90.083   4.3441  169.761   16.003  153.131   23.413  184.343   21.924   85.864   6.6113   94.301   5.6369 -8.436943 8.688124 
1 1 1   12    3   29 o   52.586   7.1031   61.223   14.821   80.724   20.591   40.261   21.349   62.209   8.0253   42.962   11.722 19.24697 14.20626 
1 1 1   12    3   30 o  154.313   3.3906  493.573   21.454  496.688   28.874  489.736   32.055  154.895   4.5196  153.732   5.0556 1.162155 6.781269 
1 1 1   12    3   31 o   64.692   6.6822   90.790   17.031  105.127   23.345   74.478   24.902   70.892   7.9842   58.491   10.717 12.40081 13.36441 
1 1 1   12    3   32 o   44.962   7.6904   41.701   15.709   16.378   21.359   71.543   23.186   31.740   11.967   58.185   9.6618 -26.44470 15.38078 
1 1 1   12    3   33 o   60.926   7.2591   82.454   17.210   68.683   26.527   92.462   22.615   55.567   11.931   66.286   8.2719 -10.71909 14.51811 
1 1 1   12    3   34 f   83.749   6.4312  155.952   21.050  122.903   33.269  178.015   27.184   75.516   10.682   91.982   7.1654 -16.46532 12.86231 
1 1 1   12    3   35 o   70.880   5.9015  106.995   17.249  109.908   24.626  104.190   24.168   71.836   8.3115   69.924   8.3802 1.911987 11.80296 
1 1 1   12    3   36 o  102.975   5.2186  233.311   20.941  254.081   26.451  198.431   34.277  109.920   5.8344   96.031   8.6541 13.88921 10.43712 
1 1 1   12    3   37 o   28.742   8.1876   7.8933   15.534  -4.0705   21.629   20.640   22.325   24.491   10.838   32.993   12.275 -8.502804 16.37526 
1 1 1   12    3   38 o   47.594   8.3267   53.927   16.283   57.841   22.475   49.604   23.622   49.667   11.234   45.521   12.293 4.145367 16.65332 
1 1 1   12    3   39 o   26.473   8.1684  -0.4682   17.085   7.5989   23.677  -9.2315   24.677   28.395   11.932   24.551   11.159 3.844337 16.33689 
1 1 1   12    3   40 o   44.612   8.4534   47.861   15.920   42.827   22.271   53.121   22.765   42.160   12.146   47.064   11.761 -4.903404 16.90686 
1 1 1   12    3   41 o   26.577   7.7087  -9.6964   15.922   29.841   24.296 -39.4590   21.080   35.985   12.895   17.168   8.4502 18.81725 15.41733 
1 1 1   12    3   42 f   27.883   8.3053   8.6603   16.382   4.1178   23.528   12.935   22.824   26.697   11.570   29.069   11.918 -2.372082 16.61059 
1 1 1   12    3   43 o   28.551   8.3961   6.5456   17.089   27.425   25.883  -9.5912   22.754   34.352   13.120   22.749   10.480 11.60348 16.79218 
1 1 1   12    3   44 o   26.407   7.8729   4.4757   15.668 -12.4766   22.030   21.827   22.288   21.551   10.059   31.264   12.114 -9.712307 15.74583 
1 1 1   12    3   45 o   33.226   9.0280   25.431   17.217   42.007   27.920   15.261   21.869   38.191   13.807   28.260   11.636 9.930593 18.05602 
1 1 1   12    3   46 o   24.873   7.7286  -8.7988   17.358 -41.2447   24.387   24.519   24.712   18.112   8.9478   31.635   12.604 -13.52257 15.45720 
1 1 1   12    3   47 o   24.502   8.1114  -6.7394   20.530 -10.9533   28.874  -2.4309   29.196   23.731   11.214   25.273   11.723 -1.541584 16.22286 
1 1 1   12    3   48 f   41.156   10.356   54.408   31.158 -37.7918   49.149  116.356   40.287   25.749   12.717   56.564   16.347 -30.81497 20.71154 
1 1 1   12    3   49 o   34.609   14.744   47.276   36.984   0.0000   0.0000   47.276   36.984  ?   ?    34.609   14.744      ?      ? 
1 1 1   12    4    0 o  288.730   2.5141  1720.28   42.327  1720.28   42.327  1720.28   42.327  288.730   3.5555  288.730   3.5555 0.000000 0.000000 
1 1 1   12    4    1 o  384.763   3.0050  3054.43   47.686  3068.15   67.814  3041.01   67.068  385.617   4.2638  383.909   4.2356 1.707825 6.010062 
1 1 1   12    4    2 o  564.053   4.0434  6567.28   94.065  6562.99  132.906  6571.59  133.151  563.869   5.7148  564.237   5.7216 -0.3685913 8.086764 
1 1 1   12    4    3 o  303.772   2.5906  1901.88   32.431  1946.71   47.013  1861.18   44.797  307.183   3.7107  300.362   3.6161 6.820740 5.181231 
1 1 1   12    4    4 o  301.895   2.5858  1880.01   32.195  1895.57   45.876  1864.92   45.192  303.125   3.6694  300.664   3.6443 2.460449 5.171591 
1 1 1   12    4    5 o  516.141   4.0646  5494.50   85.511  5471.57  112.519  5525.85  131.565  514.902   5.2983  517.380   6.1655 -2.478333 8.129246 
1 1 1   12    4    6 o   37.329   4.4406   29.368   6.3032   29.581   7.7724   28.960   10.773   37.861   4.9773   36.797   7.3555 1.064144 8.881284 
1 1 1   12    4    7 o  114.365   2.4247  269.627   11.433  278.354   16.421  261.414   15.929  116.161   3.4274  112.570   3.4308 3.590286 4.849462 
1 1 1   12    4    8 o  231.546   2.4571  1107.43   23.242  1095.79   35.296  1116.33   30.883  230.465   3.7132  232.627   3.2188 -2.161606 4.914132 
1 1 1   12    4    9 o   57.549   2.7340   68.815   6.4264   64.289   9.5953   72.496   8.6541   55.819   4.1678   59.279   3.5396 -3.460575 5.468042 
1 1 1   12    4   10 o  209.737   3.1339  877.598   26.495  775.165   33.424  1050.77   43.459  193.824   4.1811  225.650   4.6696 -31.82524 6.267878 
1 1 1   12    4   11 o  291.748   2.7639  1748.65   32.709  1797.11   51.445  1715.76   42.377  295.114   4.2265  288.382   3.5628 6.731537 5.527873 
1 1 1   12    4   12 o  482.449   4.1387  4765.08   81.497  5080.50  126.199  4539.44  106.738  495.993   6.1690  468.905   5.5191 27.08798 8.277490 
1 1 1   12    4   13 o  343.037   3.2897  2428.69   46.541  2392.81   65.442  2465.40   66.202  340.473   4.6603  345.600   4.6444 -5.126678 6.579405 
1 1 1   12    4   14 o  226.429   2.3838  1057.84   22.261  1061.84   31.634  1053.92   31.333  226.853   3.3810  226.005   3.3614 0.8479462 4.767604 
1 1 1   12    4   15 o  250.571   2.6289  1294.43   26.962  1306.02   40.805  1285.45   35.920  251.554   3.9329  249.587   3.4894 1.967056 5.257740 
1 1 1   12    4   16 o  315.934   3.0054  2058.87   38.689  2049.58   50.858  2071.62   59.608  315.115   3.9131  316.753   4.5627 -1.638550 6.010867 
1 1 1   12    4   17 o  225.483   2.6059  1047.57   24.083  1065.31   36.279  1033.59   32.202  227.177   3.8719  223.790   3.4889 3.387512 5.211894 
1 1 1   12    4   18 o  243.915   2.5218  1227.77   25.367  1245.28   36.199  1210.88   35.559  245.622   3.5732  242.207   3.5596 3.415146 5.043659 
1 1 1   12    4   19 o  418.754   3.5326  3629.84   60.630  3683.24   81.648  3564.21   90.525  422.243   4.6883  415.266   5.2854 6.978027 7.065133 
1 1 1   12    4   20 o   67.002   5.1363   80.899   11.597   73.250   12.823  115.247   27.173   59.522   5.2233   74.482   8.8456 -14.95984 10.27263 
1 1 1   12    4   21 o  284.895   3.8816  1679.34   45.610  1681.31   64.597  1677.39   64.408  285.060   5.4943  284.729   5.4845 0.3307800 7.763178 
1 1 1   12    4   22 o  143.508   2.8830  425.475   16.801  425.452   21.921  425.507   26.158  143.527   3.7030  143.490   4.4199 0.3620911E-01 5.766096 
1 1 1   12    4   23 o  111.611   3.6948  256.401   16.959  275.329   25.180  240.687   22.944  115.357   5.2924  107.865   5.1572 7.492226 7.389623 
1 1 1   12    4   24 o  418.843   3.6041  3635.41   61.743  3672.20   82.416  3588.36   93.214  421.358   4.7424  416.328   5.4285 5.029297 7.208217 
1 1 1   12    4   25 o   79.444   5.0112  131.557   16.153  128.231   25.039  133.927   21.140   78.529   7.7308   80.360   6.3782 -1.831161 10.02236 
1 1 1   12    4   26 f  201.941   2.8067  848.976   23.072  884.833   30.654  802.120   35.041  206.938   3.5915  196.944   4.3139 9.994080 5.613301 
1 1 1   12    4   27 o   82.029   6.4612  139.682   21.860  139.682   21.860   0.0000   0.0000   82.029   6.4612  ?   ?       ?      ? 
1 1 1   12    4   28 f  218.317   3.0337  980.176   27.110  1030.56   41.361  942.232   35.895  223.175   4.4935  213.460   4.0771 9.715118 6.067477 
1 1 1   12    4   29 o   75.334   4.9415  117.969   15.339  125.555   22.013  110.810   21.385   77.697   6.8693   72.971   7.1054 4.726357 9.882979 
1 1 1   12    4   30 o  130.182   3.6808  353.451   19.630  376.085   26.833  327.392   28.791  134.740   4.8285  125.624   5.5568 9.116302 7.361537 
1 1 1   12    4   31 o   83.687   4.8635  146.307   16.736  133.467   23.690  159.099   23.646   79.973   7.1822   87.400   6.5597 -7.427658 9.726907 
1 1 1   12    4   32 o  183.076   3.3162  693.999   24.937  681.056   33.626  709.813   37.171  181.227   4.4988  184.925   4.8735 -3.698135 6.632486 
1 1 1   12    4   33 o   72.931   6.1370  111.647   18.406  119.726   27.343  104.954   24.889   75.307   8.8034   70.555   8.5529 4.752563 12.27402 
1 1 1   12    4   34 o  105.952   4.9860  235.605   21.103  238.784   34.498  233.704   26.675  106.260   7.8716  105.644   6.1221 0.6166000 9.972047 
1 1 1   12    4   35 o   39.143   8.4522   32.833   15.567   19.143   21.431   48.126   22.651   32.385   12.031   45.902   11.874 -13.51646 16.90430 
1 1 1   12    4   36 o  127.595   4.6071  344.796   23.750  347.592   30.742  340.658   37.403  128.561   5.7977  126.628   7.1617 1.933273 9.214272 
1 1 1   12    4   37 o   29.911   8.2637   13.219   15.013   5.9083   20.978   20.893   21.494   27.030   11.286   32.793   12.074 -5.763172 16.52735 
1 1 1   12    4   38 o   52.307   7.6524   65.823   16.442   35.347   23.700   94.101   22.829   38.925   12.776   65.688   8.4265 -26.76211 15.30470 
1 1 1   12    4   39 o   40.304   8.8592   38.522   16.266   35.299   22.200   42.259   23.902   38.707   12.338   41.901   12.717 -3.194290 17.71847 
1 1 1   12    4   40 o   20.778   6.8123 -18.7480   14.612  -1.2114   20.414 -37.1766   20.926   24.117   10.608   17.439   8.5506 6.677942 13.62470 
1 1 1   12    4   41 o   26.067   8.2245  -4.2797   18.247 -14.0998   25.832   5.5002   25.779   23.853   11.051   28.281   12.184 -4.428217 16.44899 
1 1 1   12    4   42 o   51.061   8.0784   63.870   16.586   63.477   23.691   64.249   23.228   50.804   11.566   51.319   11.281 -0.5148659 16.15672 
1 1 1   12    4   43 o   23.537   7.5656  -7.4602   16.164   2.8724   23.747 -16.3810   22.065   26.081   11.457   20.994   9.8842 5.087023 15.13128 
1 1 1   12    4   44 o   43.906   8.3103   48.844   16.381   27.549   22.188   74.362   24.288   33.452   12.275   54.359   11.206 -20.90694 16.62062 
1 1 1   12    4   45 o   27.841   7.8167   4.3428   16.526   36.751   22.798 -31.5468   23.991   36.534   12.538   19.149   9.3385 17.38510 15.63344 
1 1 1   12    4   46 o   26.407   8.1435   8.0935   16.723   10.353   23.342   5.7106   23.971   26.924   11.596   25.890   11.436 1.033621 16.28693 
1 1 1   12    4   47 o   31.910   9.4264   25.835   19.702   20.335   24.098   36.926   34.219   29.317   12.156   34.503   14.411 -5.186203 18.85280 
1 1 1   12    4   48 o   27.917   9.2656   2.7785   27.764 -26.2957   47.698   17.677   34.145   26.317   12.905   29.517   13.299 -3.199606 18.53117 
1 1 1   12    4   49 o   29.642   13.631   22.552   38.262   0.0000   0.0000   22.552   38.262  ?   ?    29.642   13.631      ?      ? 
1 1 1   12    5    0 o   79.662   2.3359  131.565   10.812  131.565   10.812  131.565   10.812   79.662   3.3035   79.662   3.3035 0.000000 0.000000 
1 1 1   12    5    1 o  278.947   2.4749  1605.06   28.472  1616.15   40.530  1594.26   40.006  279.897   3.5108  277.996   3.4891 1.901764 4.949743 
1 1 1   12    5    2 o  441.705   3.3260  4025.81   60.591  4039.33   86.085  4012.53   85.298  442.440   4.7175  440.971   4.6899 1.468292 6.652044 
1 1 1   12    5    3 o  370.672   2.9346  2834.72   44.864  2826.82   63.222  2842.73   63.674  370.152   4.1412  371.192   4.1591 -1.039825 5.869195 
1 1 1   12    5    4 o  502.287   3.9640  5211.73   81.473  5243.88  108.789  5170.66  122.945  504.080   5.2327  500.494   5.9559 3.585510 7.928000 
1 1 1   12    5    5 o  523.320   4.1265  5633.31   87.489  5550.82  113.156  5755.93  137.954  518.616   5.2901  528.024   6.3345 -9.407837 8.252995 
1 1 1   12    5    6 o  287.582   3.0591  1711.51   34.442  1722.69   42.554  1690.27   58.646  288.972   3.5704  286.191   4.9684 2.780823 6.118256 
1 1 1   12    5    7 o  723.529   5.4039 10832.93  160.800 10545.85  234.652 11087.09  220.791  714.422   7.9635  732.637   7.3068 -18.21490 10.80772 
1 1 1   12    5    8 o  287.345   2.7167  1701.24   31.794  1717.81   49.104  1689.28   41.720  288.538   4.1262  286.152   3.5349 2.385437 5.433361 
1 1 1   12    5    9 o  292.350   2.7361  1765.50   32.727  1746.35   49.377  1780.51   43.705  290.926   4.1151  293.775   3.6071 -2.849640 5.472187 
1 1 1   12    5   10 o  146.360   3.9594  441.980   23.901   0.0000   0.0000  441.980   23.901  ?   ?   146.360   3.9594      ?      ? 
1 1 1   12    5   11 o  148.808   2.1853  455.241   13.065  463.684   21.098  449.990   16.639  149.917   3.4121  147.698   2.7314 2.219223 4.370648 
1 1 1   12    5   12 o  282.844   3.0795  1642.10   33.595  1676.25   59.417  1626.05   40.730  284.956   5.0555  280.732   3.5177 4.224579 6.158965 
1 1 1   12    5   13 o  327.442   3.1605  2210.75   42.639  2262.58   61.984  2164.20   58.748  331.077   4.5393  323.808   4.3988 7.268890 6.320974 
1 1 1   12    5   14 o  131.583   2.7802  357.076   15.082  371.322   21.634  343.605   21.037  134.135   3.9105  129.031   3.9529 5.104263 5.560340 
1 1 1   12    5   15 f  145.444   2.7946  437.553   16.414  441.294   21.207  431.964   25.921  146.234   3.5162  144.654   4.3446 1.580017 5.589219 
1 1 1   12    5   16 o  238.084   3.2959  1161.92   31.370  1136.61   39.541  1204.92   51.529  234.647   4.0857  241.521   5.1729 -6.873627 6.591805 
1 1 1   12    5   17 o   38.870   7.6544   32.658   12.601   28.697   20.345   35.122   16.050   37.397   11.800   40.343   9.7532 -2.946182 15.30881 
1 1 1   12    5   18 o  185.975   2.7770  712.852   21.256  696.240   29.000  732.140   31.248  183.642   3.8287  188.307   4.0234 -4.664200 5.554013 
1 1 1   12    5   19 o   51.921   4.1079   55.874   8.7768   53.021   12.621   58.545   12.213   50.628   6.0442   53.213   5.5649 -2.584679 8.215801 
1 1 1   12    5   20 o  103.430   4.0670  222.070   17.250  228.884   23.393  213.949   25.538  105.196   5.3916  101.665   6.0905 3.531197 8.134093 
1 1 1   12    5   21 o  182.417   2.8618  685.042   21.415  665.533   28.649  709.743   32.237  179.499   3.8698  185.336   4.2172 -5.837418 5.723650 
1 1 1   12    5   22 o  174.074   2.6427  628.091   18.296  634.458   23.069  617.296   30.038  175.304   3.1906  172.845   4.2136 2.458939 5.285316 
1 1 1   12    5   23 o  157.676   2.9351  513.331   18.995  509.162   25.582  518.455   28.358  156.978   3.9512  158.373   4.3414 -1.394302 5.870226 
1 1 1   12    5   24 o  140.473   4.3474  423.216   23.950  357.309   38.739  463.993   30.471  131.187   7.1597  149.759   4.9333 -18.57153 8.694766 
1 1 1   12    5   25 o  110.137   3.4581  252.284   15.611  265.366   21.286  237.059   22.964  113.267   4.5565  107.007   5.2031 6.260246 6.916196 
1 1 1   12    5   26 o   27.782   6.6516   15.639   9.3261   20.983   10.744  -0.6978   18.784   31.183   8.2325   24.381   10.450 6.801489 13.30313 
1 1 1   12    5   27 o  119.738   3.3615  303.321   16.061  327.442   20.779  267.527   25.313  125.846   4.0034  113.631   5.4010 12.21501 6.722968 
1 1 1   12    5   28 o  124.954   4.3354  326.617   20.414  330.545   24.429  317.523   37.169  126.372   4.6869  123.536   7.2949 2.835915 8.670779 
1 1 1   12    5   29 o  104.533   3.7751  226.374   16.252  209.781   22.676  243.898   23.304  100.584   5.4661  108.482   5.2084 -7.898148 7.550183 
1 1 1   12    5   30 f   66.672   6.2398   92.830   17.133   86.880   23.528   99.547   24.997   64.401   8.8580   68.944   8.7907 -4.543327 12.47957 
1 1 1   12    5   31 o  153.800   3.2694  490.151   20.736  479.065   29.048  501.669   29.610  152.026   4.6327  155.574   4.6146 -3.548264 6.538868 
1 1 1   12    5   32 f   55.452   7.1715   68.488   15.620   41.429   21.992   96.035   22.189   43.266   11.936   67.638   7.9538 -24.37215 14.34294 
1 1 1   12    5   33 o   48.139   9.4455   53.552   20.176   33.360   31.202   68.059   26.449   41.055   14.624   55.223   11.958 -14.16817 18.89100 
1 1 1   12    5   34 o   70.150   5.8784  105.550   16.716   83.861   23.661  127.163   23.620   62.664   9.1547   77.635   7.3765 -14.97005 11.75677 
1 1 1   12    5   35 o  105.338   4.1310  233.673   17.858  258.550   25.152  208.383   25.359  111.119   5.4880   99.557   6.1759 11.56200 8.261957 
1 1 1   12    5   36 o   28.987   8.2500   7.8140   15.824   21.441   22.714  -5.0392   22.059   33.466   12.395   24.507   10.891 8.958786 16.50003 
1 1 1   12    5   37 o   88.315   4.8556  167.492   17.487  191.561   24.410  142.117   25.064   95.139   6.2209   81.492   7.4571 13.64715 9.711210 
1 1 1   12    5   38 o   63.641   6.7487   90.214   17.180  106.161   25.106   76.171   23.560   69.607   8.7450   57.675   10.281 11.93217 13.49741 
1 1 1   12    5   39 o   31.498   8.4590   17.544   15.489   27.661   22.622   8.6151   21.252   35.341   12.467   27.655   11.437 7.685690 16.91798 
1 1 1   12    5   40 o   41.827   8.4789   42.509   15.386   43.243   21.397   41.723   22.140   42.243   11.817   41.412   12.162 0.8318710 16.95772 
1 1 1   12    5   41 o   31.838   8.7649   7.0173   20.740 -43.1459   32.322   42.128   27.041   22.631   10.992   41.046   13.655 -18.41515 17.52979 
1 1 1   12    5   42 o   33.612   8.5969   25.353   15.781   15.619   22.811   34.289   21.855   29.923   12.045   37.301   12.270 -7.377718 17.19385 
1 1 1   12    5   43 o   65.187   6.5842   99.755   17.007  117.096   24.010   82.294   24.093   72.067   8.0777   58.307   10.400 13.75950 13.16844 
1 1 1   12    5   44 o   54.991   8.2239   83.059   18.025  101.142   22.951   53.950   29.119   66.436   8.3759   43.547   14.155 22.88870 16.44772 
1 1 1   12    5   45 o   25.259   7.9336   3.1729   16.624   8.4427   23.555  -2.0570   23.466   26.569   11.546   23.948   10.884 2.620609 15.86717 
1 1 1   12    5   46 o   26.185   8.0929   5.8188   16.987  -5.6503   23.927   17.476   24.122   23.231   10.718   29.138   12.128 -5.906527 16.18581 
1 1 1   12    5   47 o   31.736   9.4710   21.929   21.666   48.410   33.590   3.0617   28.352   37.568   14.781   25.903   11.846 11.66441 18.94203 
1 1 1   12    5   48 o   32.125   10.120   29.139   28.457   4.4002   45.019   45.603   36.725   28.818   13.728   35.432   14.873 -6.613901 20.24008 
1 1 1   12    5   49 o   28.524   9.4825   14.566   27.852   18.103   45.807   12.492   35.081   29.449   13.977   27.599   12.819 1.850143 18.96498 
1 1 1   12    6    0 o  186.355   2.1183  716.816   23.012  716.816   23.012  716.816   23.012  186.355   2.9957  186.355   2.9957 0.000000 0.000000 
1 1 1   12    6    1 o  250.023   2.3400  1289.28   24.127  1276.38   33.790  1302.70   34.461  248.747   3.2936  251.299   3.3249 -2.551392 4.680001 
1 1 1   12    6    2 o  133.872   2.0312  369.574   11.213  361.418   15.725  378.013   15.995  132.370   2.8804  135.375   2.8646 -3.005005 4.062344 
1 1 1   12    6    3 o  484.635   3.5732  4846.34   71.411  4814.75   99.983  4879.24  102.029  483.026   5.0187  486.245   5.0875 -3.219330 7.146326 
1 1 1   12    6    4 o  563.551   4.3564  6562.54  100.484  6607.26  134.318  6505.70  151.427  565.772   5.7561  561.331   6.5406 4.441162 8.712758 
1 1 1   12    6    5 o  102.808   2.5030  221.493   10.068  229.547   12.533  206.837   16.907  105.491   2.8806  100.124   4.0941 5.366722 5.005969 
1 1 1   12    6    6 o  407.247   3.3906  3417.06   56.175  3389.29   73.479  3456.10   87.145  405.282   4.3958  409.211   5.1633 -3.928864 6.781108 
1 1 1   12    6    7 o  156.817   2.2163  508.604   14.209  496.913   21.435  517.770   18.979  155.201   3.3485  158.432   2.9045 -3.230560 4.432659 
1 1 1   12    6    8 o  197.434   2.3392  805.614   18.852  793.564   28.689  814.770   25.009  196.127   3.5466  198.740   3.0510 -2.613419 4.678401 
1 1 1   12    6    9 o  371.624   3.1835  2845.91   48.152  2874.37   74.561  2825.54   63.067  373.197   4.8441  370.052   4.1321 3.144897 6.367066 
1 1 1   12    6   10 o  398.824   3.7766  3289.96   58.828  3263.22  100.767  3303.79   72.458  397.527   6.1459  400.121   4.3906 -2.593781 7.553150 
1 1 1   12    6   11 o   73.630   3.2001  119.770   9.0236   85.461   14.417  141.866   11.570   64.338   5.4332   82.923   3.3829 -18.58511 6.400298 
1 1 1   12    6   12 o  241.729   2.8604  1213.67   27.082  1180.82   45.889  1231.22   33.547  239.175   4.6519  244.283   3.3297 -5.107834 5.720725 
1 1 1   12    6   13 o  133.992   2.6467  355.692   13.985  420.431   24.325  323.729   17.092  142.725   4.1323  125.259   3.3084 17.46638 5.293499 
1 1 1   12    6   14 o  163.867   2.7646  553.924   18.680  566.835   26.792  541.711   26.058  165.724   3.9196  162.010   3.8997 3.713730 5.529142 
1 1 1   12    6   15 o  415.967   3.4933  3570.80   59.298  3591.09   90.821  3555.73   78.288  416.954   5.2812  414.981   4.5740 1.972748 6.986632 
1 1 1   12    6   16 o  239.414   2.8240  1183.17   27.877  1223.18   39.620  1143.95   39.230  243.424   3.9463  235.404   4.0405 8.020630 5.647924 
1 1 1   12    6   17 o  392.092   3.6329  3174.85   58.717  3216.03   84.680  3136.72   81.488  394.531   5.2040  389.654   5.0705 4.876587 7.265744 
1 1 1   12    6   18 o  304.192   2.7063  1910.42   33.953  1903.50   47.913  1917.41   48.122  303.638   3.8259  304.745   3.8286 -1.107117 5.412570 
1 1 1   12    6   19 o  122.402   2.4942  309.240   12.587  311.791   18.089  306.846   17.525  122.890   3.5688  121.915   3.4853 0.9752502 4.988378 
1 1 1   12    6   20 o  131.922   3.2849  364.449   16.363  371.749   19.645  347.914   29.566  134.171   3.5500  129.673   5.5281 4.498489 6.569854 
1 1 1   12    6   21 o  376.377   3.1959  2936.52   48.290  2966.43   61.766  2889.49   77.451  378.948   3.9519  373.805   5.0236 5.142609 6.391708 
1 1 1   12    6   22 o  155.865   2.7593  508.086   17.353  535.901   22.692  468.909   26.931  161.098   3.4152  150.632   4.3348 10.46556 5.518528 
1 1 1   12    6   23 o  299.048   3.0581  1844.09   37.315  1817.85   49.132  1879.85   57.361  296.590   4.0164  301.505   4.6127 -4.915100 6.116258 
1 1 1   12    6   24 o  185.223   3.8869  714.620   29.124  687.540   45.415  733.535   37.956  182.147   6.0453  188.299   4.8873 -6.152832 7.773727 
1 1 1   12    6   25 o   28.965   6.7902   17.307   9.1522   20.416   10.571   7.9979   18.291   30.773   8.1857   27.156   10.836 3.616762 13.58039 
1 1 1   12    6   26 o  108.109   3.5563  241.611   15.793  238.175   21.322  245.786   23.506  107.276   4.8190  108.942   5.2313 -1.665855 7.112597 
1 1 1   12    6   27 o  136.227   3.0795  386.629   16.760  395.367   21.342  372.570   27.070  138.305   3.7414  134.149   4.8925 4.155197 6.159084 
1 1 1   12    6   28 o  127.451   4.2658  340.895   20.605  346.998   24.801  327.297   37.023  129.476   4.6443  125.427   7.1567 4.048836 8.531633 
1 1 1   12    6   29 o  161.451   3.2466  535.963   21.496  507.333   28.627  572.971   32.548  156.563   4.4333  166.339   4.7442 -9.776154 6.493146 
1 1 1   12    6   30 o  109.134   4.1409  246.583   18.605  233.641   25.398  261.572   27.332  106.061   5.8059  112.208   5.9058 -6.146919 8.281751 
1 1 1   12    6   31 o   97.934   4.2621  199.858   17.183  186.318   24.349  213.291   24.252   94.593   6.2411  101.274   5.8062 -6.681259 8.524236 
1 1 1   12    6   32 o  138.722   4.1430  413.487   22.506  356.212   36.745  447.872   28.471  130.545   6.8245  146.898   4.6992 -16.35310 8.285921 
1 1 1   12    6   33 o   88.858   5.7344  163.842   20.828  188.313   32.177  146.195   27.325   94.437   8.2612   83.279   7.9552 11.15775 11.46879 
1 1 1   12    6   34 o   32.375   8.6762   16.292   15.799   25.824   24.988   9.9446   20.392   36.264   13.069   28.486   11.415 7.778141 17.35239 
1 1 1   12    6   35 o  110.494   4.0659  256.556   18.505  268.017   25.971  244.735   26.375  113.064   5.5692  107.925   5.9253 5.138924 8.131751 
1 1 1   12    6   36 o   42.841   8.3018   42.840   16.391   20.063   24.272   61.938   22.225   33.423   12.720   52.260   10.672 -18.83750 16.60356 
1 1 1   12    6   37 o   28.792   8.7124   5.1852   18.029   11.182   21.851  -7.6028   31.908   29.008   11.749   28.577   12.868 0.4304256 17.42472 
1 1 1   12    6   38 o  105.970   4.7199  240.690   20.557  248.582   28.233  231.787   29.989  108.009   6.3378  103.932   6.9960 4.077469 9.439873 
1 1 1   12    6   39 o   47.279   8.2424   53.333   16.003   57.547   22.310   48.866   22.967   49.434   11.201   45.124   12.094 4.309845 16.48480 
1 1 1   12    6   40 f   31.068   8.5121   18.350   15.563   18.339   22.037   18.360   21.981   31.072   12.044   31.064   12.032 0.8543015E-02 17.02425 
1 1 1   12    6   41 o   49.149   9.4918   62.306   19.618   58.087   31.610   64.949   25.019   46.915   14.694   51.383   12.020 -4.467354 18.98361 
1 1 1   12    6   42 o   35.226   8.9656   29.044   16.527   33.659   25.085   25.504   21.970   37.038   13.121   33.415   12.222 3.622952 17.93127 
1 1 1   12    6   43 f   53.126   7.9425   70.768   16.879   80.018   23.858   61.499   23.883   57.321   10.478   48.930   11.940 8.390675 15.88503 
1 1 1   12    6   44 o   50.356   8.8980   66.971   18.042   64.307   22.865   71.367   29.371   50.180   11.318   50.533   13.733 -0.3533592 17.79593 
1 1 1   12    6   45 o   50.852   8.4301   70.053   17.450   77.973   24.132   61.372   25.263   54.928   11.035   46.775   12.747 8.153263 16.86010 
1 1 1   12    6   46 o   30.731   8.8031   22.379   17.442   17.084   24.367   27.943   24.977   28.940   12.129   32.523   12.762 -3.583370 17.60617 
1 1 1   12    6   47 o   58.464   9.9282  104.798   23.492  114.051   35.658   97.702   31.227   60.017   14.555   56.911   13.506 3.105488 19.85640 
1 1 1   12    6   48 o   23.864   8.2547 -29.8852   27.818 -68.9620   46.271  -7.7668   34.811   22.540   11.318   25.188   12.019 -2.648779 16.50930 
1 1 1   12    6   49 o   36.822   11.027   63.260   30.577   43.048   48.448   76.641   39.420   32.648   15.129   40.996   16.048 -8.347374 22.05483 
1 1 1   12    7    0 o  102.259   2.0633  216.196   12.284  216.196   12.284  216.196   12.284  102.259   2.9179  102.259   2.9179 0.000000 0.000000 
1 1 1   12    7    1 f  299.256   2.5594  1847.28   31.587  1832.72   44.286  1862.36   45.065  298.056   3.6025  300.456   3.6366 -2.399536 5.118886 
1 1 1   12    7    2 o  236.391   2.2782  1152.62   22.210  1162.22   31.630  1143.28   31.194  237.361   3.2309  235.420   3.2127 1.941467 4.556335 
1 1 1   12    7    3 o  430.077   3.5188  3810.72   61.578  3777.92   80.567  3856.80   95.492  427.880   4.5653  432.273   5.3560 -4.392853 7.037688 
1 1 1   12    7    4 o  348.677   3.0292  2509.07   43.145  2512.16   57.207  2504.99   65.703  348.940   3.9749  348.414   4.5722 0.5257874 6.058488 
1 1 1   12    7    5 o   93.193   2.6449  177.481   9.9877  170.560   12.857  188.014   15.861   90.927   3.4283   95.459   4.0286 -4.532326 5.289859 
1 1 1   12    7    6 o  164.647   2.2273  557.102   14.920  546.762   19.469  571.815   23.223  162.807   2.8994  166.488   3.3819 -3.680298 4.454637 
1 1 1   12    7    7 f  678.336   5.4830  9504.62  153.349  9414.08  213.659  9600.80  220.227  675.018   7.6743  681.653   7.8332 -6.634705 10.96607 
1 1 1   12    7    8 o  206.801   2.3612  881.949   19.914  884.406   30.550  880.134   26.261  207.046   3.5775  206.557   3.0825 0.4894257 4.722310 
1 1 1   12    7    9 o  343.178   4.5115  2390.21   49.397  2498.90  116.656  2366.46   54.527  347.695   8.1347  338.661   3.9037 9.034576 9.022904 
1 1 1   12    7   10 o  419.373   4.1855  3589.01   69.384  3779.89  117.486  3486.79   85.978  427.759   6.6592  410.988   5.0722 16.77164 8.370900 
1 1 1   12    7   11 o  319.533   4.1578  2094.38   40.833  2130.38  100.432  2087.25   44.693  321.006   7.5857  318.060   3.4070 2.946381 8.315645 
1 1 1   12    7   12 o  145.430   3.4551  366.868   15.929  553.516   41.005  333.696   17.287  163.688   6.0737  127.173   3.2957 36.51450 6.910291 
1 1 1   12    7   13 o  197.339   2.6791  814.392   19.866  777.476   36.207  830.292   23.762  194.066   4.5235  200.612   2.8719 -6.545914 5.358160 
1 1 1   12    7   14 o  114.272   3.0048  268.833   14.143  254.135   19.415  285.451   20.643  110.953   4.2425  117.591   4.2564 -6.637344 6.009665 
1 1 1   12    7   15 o  324.595   2.9871  2170.87   39.555  2204.20   60.794  2146.40   52.088  326.726   4.5114  322.464   3.9165 4.262451 5.974252 
1 1 1   12    7   16 o  186.115   2.4598  715.859   18.804  703.856   27.757  726.039   25.564  184.664   3.6444  187.566   3.3045 -2.902206 4.919515 
1 1 1   12    7   17 o  185.394   2.5912  712.794   19.576  732.256   25.961  687.144   29.804  188.356   3.3417  182.431   3.9611 5.925446 5.182414 
1 1 1   12    7   18 o   89.783   2.8497  166.445   10.548  159.564   14.822  173.504   15.013   87.902   4.0883   91.665   3.9711 -3.762909 5.699474 
1 1 1   12    7   19 o  127.615   2.6192  337.593   13.679  347.697   18.401  325.109   20.453  129.770   3.4379  125.460   3.9525 4.310097 5.238467 
1 1 1   12    7   20 o  126.157   2.8994  334.056   14.592  351.577   18.705  306.814   23.324  130.483   3.4757  121.831   4.6417 8.652664 5.798758 
1 1 1   12    7   21 o  397.567   3.3199  3269.22   52.714  3274.74   66.723  3260.06   85.988  398.134   4.0633  397.000   5.2514 1.133057 6.639895 
1 1 1   12    7   22 o  103.356   3.1333  223.827   12.700  231.033   15.832  210.821   21.270  105.761   3.6296  100.951   5.1086 4.810364 6.266669 
1 1 1   12    7   23 o  159.499   3.2012  525.512   20.943  531.067   31.379  521.050   28.124  160.236   4.7480  158.761   4.2950 1.475494 6.402431 
1 1 1   12    7   24 o  285.367   3.3063  1687.94   37.119  1696.05   46.102  1672.97   62.591  286.477   3.9018  284.257   5.3387 2.219513 6.612528 
1 1 1   12    7   25 o  111.871   3.1098  252.420   13.619  239.471   16.609  278.989   23.792  107.647   3.7410  116.096   4.9687 -8.449615 6.219577 
1 1 1   12    7   26 o  253.302   2.8934  1324.35   29.663  1314.71   38.352  1338.69   46.798  252.220   3.6868  254.383   4.4604 -2.163101 5.786814 
1 1 1   12    7   27 o  271.546   3.0020  1517.85   32.924  1490.10   42.281  1560.59   52.478  268.485   3.8182  274.607   4.6334 -6.122009 6.003925 
1 1 1   12    7   28 o  136.904   3.7795  329.800   17.038  296.931   18.679  492.621   41.573  119.841   3.7790  153.966   6.5467 -34.12569 7.559071 
1 1 1   12    7   29 o  172.536   3.9309  616.107   27.120  623.217   44.248  611.829   34.322  173.210   6.1937  171.863   4.8420 1.347778 7.861778 
1 1 1   12    7   30 o   54.884   7.0692   66.328   15.328   79.185   20.905   51.382   22.539   61.497   8.2421   48.270   11.487 13.22655 14.13838 
1 1 1   12    7   31 o  190.085   3.6220  755.019   28.173  703.913   41.660  798.090   38.245  184.023   5.4888  196.146   4.7274 -12.12387 7.244002 
1 1 1   12    7   32 o   68.019   5.8361   99.234   15.987   76.904   23.014  120.061   22.226   60.305   9.2526   75.734   7.1155 -15.42906 11.67223 
1 1 1   12    7   33 o   45.713   9.5766   45.633   19.367   59.015   29.737   35.776   25.521   50.776   13.827   40.651   13.254 10.12553 19.15313 
1 1 1   12    7   34 o  110.225   4.4873  259.173   20.011  229.797   30.307  281.880   26.646  104.368   7.0406  116.082   5.5654 -11.71455 8.974620 
1 1 1   12    7   35 o   79.371   5.0916  134.912   16.442  159.021   23.187  110.529   23.319   86.784   6.4780   71.959   7.8570 14.82579 10.18319 
1 1 1   12    7   36 o   53.231   7.3687   63.996   15.592   58.194   21.871   69.993   22.233   50.555   10.816   55.906   10.010 -5.351135 14.73731 
1 1 1   12    7   37 o   30.077   8.6360   9.6504   18.295   24.989   21.985 -24.8900   32.991   34.260   12.268   25.895   12.158 8.364927 17.27203 
1 1 1   12    7   38 o   42.310   9.1273   42.982   17.377   39.680   23.900   46.684   25.311   40.762   12.778   43.858   13.036 -3.095840 18.25456 
1 1 1   12    7   39 f   30.524   7.8448   9.5433   15.346 -17.3616   21.362   38.235   22.059   20.978   9.8285   40.070   12.230 -19.09188 15.68953 
1 1 1   12    7   40 o   33.463   8.6784   21.045   17.220   39.930   23.967   0.8947   24.757   40.272   12.818   26.654   11.704 13.61827 17.35688 
1 1 1   12    7   41 f   36.970   7.8687   28.137   15.661   59.155   22.604  -0.4976   21.718   49.262   11.358   24.678   10.894 24.58454 15.73748 
1 1 1   12    7   42 o   34.620   8.3378   19.679   16.728   54.993   25.548  -6.8224   22.131   46.083   12.920   23.158   10.542 22.92513 16.67554 
1 1 1   12    7   43 o   23.185   7.3462  -7.5340   15.395 -25.8865   21.936   10.278   21.611   19.199   9.2598   27.171   11.407 -7.972069 14.69248 
1 1 1   12    7   44 o   25.843   8.0757   1.8734   17.377 -10.2102   25.035   13.107   24.138   23.232   10.803   28.453   12.006 -5.221069 16.15131 
1 1 1   12    7   45 o   35.119   8.9489   33.253   17.182   44.283   23.970   21.597   24.641   39.510   12.843   30.727   12.465 8.783134 17.89773 
1 1 1   12    7   46 o   32.800   8.8784   28.049   17.171   17.233   23.501   40.434   25.149   28.646   11.951   36.954   13.133 -8.308565 17.75682 
1 1 1   12    7   47 o   27.380   8.8241   7.6852   21.990   5.1827   32.699   9.7514   29.712   27.271   12.564   27.489   12.394 -0.2181664 17.64811 
1 1 1   12    7   48 o   32.706   10.474   36.069   29.824   44.986   47.743   30.363   38.192   33.902   15.453   31.511   14.143 2.391739 20.94819 
1 1 1   12    7   49 o   36.375   11.092   59.222   29.559   80.326   47.512   45.896   37.755   38.982   16.661   33.769   14.646 5.212749 22.18316 
1 1 1   12    8    0 o  179.785   2.0739  667.190   21.736  667.190   21.736  667.190   21.736  179.785   2.9330  179.785   2.9330 0.000000 0.000000 
1 1 1   12    8    1 o  426.933   3.2360  3760.51   56.969  3796.92   81.588  3725.87   79.582  428.947   4.6117  424.918   4.5409 4.028076 6.472047 
1 1 1   12    8    2 o  430.982   3.9665  3848.70   67.094  3881.78   83.172  3787.05  113.530  433.710   4.6495  428.253   6.4276 5.457153 7.932945 
1 1 1   12    8    3 o  701.933   5.9725 10199.62  163.734 10233.66  201.629 10133.72  280.566  703.911   6.9450  699.956   9.7185 3.954468 11.94493 
1 1 1   12    8    4 o  455.621   3.9245  4285.04   73.747  4295.88  104.736  4274.38  103.858  456.191   5.5665  455.051   5.5337 1.140442 7.849060 
1 1 1   12    8    5 o  576.417   4.7575  6859.14  113.051  6784.18  157.097  6939.65  162.812  573.162   6.6455  579.671   6.8099 -6.509705 9.515072 
1 1 1   12    8    6 o  320.424   2.8882  2118.09   37.766  2115.89   49.902  2121.04   57.778  320.242   3.7781  320.607   4.3694 -0.3646240 5.776306 
1 1 1   12    8    7 o  373.907   3.1827  2889.39   48.724  2848.47   73.201  2921.94   65.287  371.510   4.7773  376.303   4.2066 -4.793182 6.365357 
1 1 1   12    8    8 o  337.210   2.9820  2344.22   40.969  2360.97   63.161  2332.04   53.830  338.233   4.5276  336.187   3.8822 2.045502 5.964078 
1 1 1   12    8    9 o  147.780   2.5269  456.218   14.029  436.881   25.600  464.518   16.772  145.498   4.2659  150.062   2.7098 -4.563797 5.053834 
1 1 1   12    8   10 o  598.169   4.9277  7380.25  121.271  7589.53  178.882  7202.26  164.967  605.966   7.1574  590.372   6.7749 15.59344 9.855339 
1 1 1   12    8   11 o  523.256   5.9238  5648.15   95.112  5690.79  233.743  5639.69  104.122  523.853   10.818  522.659   4.8301 1.194580 11.84769 
1 1 1   12    8   12 o  322.637   2.9246  2149.21   38.497  2143.80   58.894  2153.24   50.869  322.262   4.4310  323.011   3.8183 -0.7495117 5.849163 
1 1 1   12    8   13 o  120.470   2.3065  295.144   11.257  321.765   17.978  277.975   14.438  124.868   3.4907  116.071   3.0158 8.797493 4.613072 
1 1 1   12    8   14 o  152.467   2.3016  479.547   14.470  473.238   20.196  486.202   20.743  151.437   3.2334  153.496   3.2764 -2.058899 4.603283 
1 1 1   12    8   15 o  244.807   3.4578  1237.80   34.913  1241.50   49.429  1234.12   49.320  245.171   4.8882  244.442   4.8920 0.7299194 6.915625 
1 1 1   12    8   16 o  255.794   2.6786  1352.68   28.149  1327.44   41.476  1374.23   38.327  253.566   3.9658  258.022   3.6015 -4.456085 5.357116 
1 1 1   12    8   17 o   82.312   3.5405  136.355   11.860  165.551   18.668  116.597   15.357   89.506   5.0569   75.118   4.9567 14.38744 7.081002 
1 1 1   12    8   18 o  368.382   3.0048  2803.11   45.652  2818.34   64.897  2788.19   64.231  369.371   4.2599  367.393   4.2388 1.977844 6.009506 
1 1 1   12    8   19 o  115.716   3.3412  275.788   14.480  274.382   17.172  279.249   26.937  115.266   3.6120  116.166   5.6221 -0.9002151 6.682446 
1 1 1   12    8   20 f  291.075   2.8443  1747.83   32.997  1740.76   41.579  1759.86   54.232  290.346   3.4721  291.803   4.5061 -1.457550 5.688607 
1 1 1   12    8   21 o  110.630   3.2333  251.465   14.691  237.270   19.710  269.212   22.038  107.144   4.4602  114.115   4.6824 -6.971191 6.466666 
1 1 1   12    8   22 o  213.108   2.8279  936.852   24.640  926.277   32.673  950.795   37.519  211.743   3.7413  214.472   4.2415 -2.728882 5.655722 
1 1 1   12    8   23 o  104.170   4.0518  224.252   17.388  236.783   25.308  213.046   23.932  106.920   5.7389  101.420   5.7212 5.499298 8.103518 
1 1 1   12    8   24 o   88.206   3.4546  161.655   11.866  162.991   14.587  159.042   20.401   88.798   3.9829   87.613   5.6458 1.185890 6.909281 
1 1 1   12    8   25 o   34.020   6.9270   25.619   10.105   29.080   12.218   18.132   17.973   36.646   8.2792   31.394   11.108 5.252016 13.85401 
1 1 1   12    8   26 f  115.775   3.1739  278.096   14.342  279.742   17.662  274.911   24.575  116.341   3.6807  115.209   5.1717 1.132141 6.347772 
1 1 1   12    8   27 o   59.367   6.1244   92.609   11.675  116.312   14.140   41.850   20.692   74.968   4.5731   43.765   11.363 31.20316 12.24887 
1 1 1   12    8   28 o   81.258   3.9950  131.448   12.617  121.527   15.208  153.353   22.598   76.603   4.8136   85.914   6.3773 -9.310654 7.990027 
1 1 1   12    8   29 o  147.263   5.0371  227.116   16.774  195.328   17.220  816.914   74.176   97.142   4.2980  197.383   9.1114 -100.2417 10.07427 
1 1 1   12    8   30 o   94.203   4.3870  182.811   16.948  159.297   22.783  211.940   25.358   87.474   6.3150  100.931   6.0914 -13.45690 8.774080 
1 1 1   12    8   31 o   53.397   6.4253   63.955   11.679   66.681   13.509   55.893   23.236   56.598   5.7873   50.197   11.474 6.400455 12.85055 
1 1 1   12    8   32 o   61.873   6.3200   81.670   13.664   81.312   15.865   82.698   26.887   62.421   6.1624   61.325   11.036 1.095642 12.64005 
1 1 1   12    8   33 o  103.933   5.2756  243.707   20.737  279.857   26.028  180.874   34.314  115.775   5.4508   92.091   9.0343 23.68335 10.55129 
1 1 1   12    8   34 f   46.790   8.5814   48.984   16.624   60.159   25.671   40.913   21.816   51.176   12.312   42.404   11.957 8.772297 17.16279 
1 1 1   12    8   35 o  148.301   3.5684  454.595   21.665  414.257   28.595  508.957   33.196  140.726   4.9267  155.876   5.1635 -15.14961 7.136761 
1 1 1   12    8   36 o   55.933   6.9905   69.581   15.694   60.678   22.020   78.774   22.374   51.593   10.699   60.274   9.0000 -8.680645 13.98109 
1 1 1   12    8   37 o   36.192   8.5905   23.080   17.675  -4.5250   24.535   52.863   25.484   25.624   11.430   46.759   12.828 -21.13437 17.18102 
1 1 1   12    8   38 o   54.764   7.4618   70.316   16.297   45.986   23.005   94.827   23.091   43.724   12.261   65.804   8.5078 -22.07955 14.92367 
1 1 1   12    8   39 o   26.960   7.9804   5.9506   15.148  -1.7733   21.363   13.761   21.482   24.502   10.811   29.418   11.742 -4.916080 15.96082 
1 1 1   12    8   40 o   54.934   8.7810   78.713   20.010   49.581   31.650   98.112   25.827   43.904   14.775   65.963   9.4932 -22.05845 17.56192 
1 1 1   12    8   41 o   28.693   8.2596   12.392   15.523   6.4646   21.886   18.392   22.019   26.664   11.350   30.721   12.002 -4.056446 16.51913 
1 1 1   12    8   42 o   35.535   9.0726   30.914   16.923   31.315   26.077   30.623   22.243   35.796   13.277   35.274   12.368 0.5220566 18.14526 
1 1 1   12    8   43 o   25.398   7.6549   1.8762   15.161   19.294   21.412 -15.6347   21.469   30.147   11.820   20.649   9.7302 9.498377 15.30972 
1 1 1   12    8   44 f   36.326   9.2385   36.231   17.662   39.020   25.360   33.603   24.613   37.373   13.198   35.280   12.931 2.092583 18.47694 
1 1 1   12    8   45 o   39.619   9.1752   47.681   19.037   59.460   23.193   23.358   33.329   46.803   11.968   32.434   13.911 14.36935 18.35048 
1 1 1   12    8   46 o   35.439   9.8280   38.171   21.989   21.713   32.979   51.346   29.506   31.046   13.573   39.832   14.218 -8.786377 19.65606 
1 1 1   12    8   47 o   25.456   8.4012  -2.0766   21.790  -8.5238   32.670   3.0896   29.245   24.959   11.834   25.953   11.928 -0.9933224 16.80247 
1 1 1   12    8   48 o   43.124   10.653   74.341   25.587   97.979   34.951   47.042   37.560   51.600   15.315   34.649   14.812 16.95072 21.30562 
1 1 1   12    9    0 o  432.337   3.7746  3858.11   95.155  3858.11   95.155  3858.11   95.155  432.337   5.3382  432.337   5.3382 0.000000 0.000000 
1 1 1   12    9    1 o  175.362   2.2356  635.322   16.008  641.272   21.245  627.506   24.348  176.317   2.9214  174.406   3.3848 1.910828 4.471205 
1 1 1   12    9    2 o  225.684   2.5708  1050.75   23.929  1041.19   33.707  1060.46   33.976  224.649   3.6379  226.719   3.6334 -2.070145 5.141634 
1 1 1   12    9    3 o  223.714   2.8670  1033.85   25.896  1026.72   40.979  1038.59   33.414  223.058   4.4542  224.369   3.6108 -1.310501 5.733931 
1 1 1   12    9    4 o  279.114   2.8342  1607.38   32.625  1612.32   46.362  1602.53   45.920  279.539   4.0212  278.690   3.9950 0.8491211 5.668308 
1 1 1   12    9    5 f  160.488   2.5277  538.310   15.836  553.722   19.621  509.511   26.821  163.838   2.9036  157.138   4.1384 6.700027 5.055430 
1 1 1   12    9    6 o  480.840   4.4068  4728.86   80.711  4657.05   96.691  4893.87  146.574  475.003   4.9354  486.677   7.3021 -11.67365 8.813581 
1 1 1   12    9    7 o  611.116   4.6649  7726.78  116.928  7592.92  173.985  7837.04  157.904  606.224   6.9585  616.008   6.2150 -9.783813 9.329871 
1 1 1   12    9    8 o  328.513   3.2238  2235.77   39.796  2207.44   73.165  2247.68   47.425  326.970   5.4254  330.056   3.4838 -3.086487 6.447625 
1 1 1   12    9    9 o  256.437   2.8284  1377.13   27.725  1303.09   48.904  1412.19   33.656  251.246   4.7194  261.627   3.1190 -10.38081 5.656875 
1 1 1   12    9   10 o   95.900   2.8474  189.732   11.262   0.0000   0.0000  189.732   11.262  ?   ?    95.900   2.8474      ?      ? 
1 1 1   12    9   11 o  230.634   3.5532  1102.88   27.459  1090.59   59.954  1106.14   30.889  229.730   6.3275  231.537   3.2345 -1.807205 7.106335 
1 1 1   12    9   12 o  503.439   4.5276  5236.90   88.535  5244.48  153.706  5233.13  108.307  503.516   7.4014  503.361   5.2169 0.1548157 9.055185 
1 1 1   12    9   13 o  117.624   2.3273  288.128   10.989  273.612   17.458  297.654   14.143  115.138   3.6764  120.110   2.8549 -4.971611 4.654674 
1 1 1   12    9   14 o  134.912   2.3214  375.314   12.906  397.755   18.513  354.096   18.002  138.833   3.2331  130.990   3.3321 7.843582 4.642815 
1 1 1   12    9   15 f  238.746   2.4637  1176.45   24.259  1184.96   34.393  1168.03   34.222  239.605   3.4803  237.887   3.4880 1.718384 4.927311 
1 1 1   12    9   16 o  314.386   2.9362  2039.60   37.728  2051.91   57.426  2030.26   50.044  315.191   4.4174  313.581   3.8693 1.610413 5.872434 
1 1 1   12    9   17 o  191.822   2.3658  759.550   18.716  758.603   26.324  760.518   26.616  191.702   3.3294  191.942   3.3620 -0.2399750 4.731590 
1 1 1   12    9   18 o  268.501   2.8036  1485.44   30.548  1468.49   39.684  1510.09   47.858  266.665   3.6081  270.338   4.2922 -3.672760 5.607283 
1 1 1   12    9   19 o  160.483   3.0555  534.630   18.639  538.513   22.417  525.934   33.549  161.496   3.3655  159.471   5.1008 2.025299 6.111060 
1 1 1   12    9   20 o  262.313   2.7139  1421.94   28.439  1423.94   36.008  1418.62   46.367  262.612   3.3244  262.015   4.2906 0.5967712 5.427812 
1 1 1   12    9   21 o   73.511   3.5514  105.951   10.253   94.178   12.437  130.919   18.112   67.495   4.4677   79.528   5.5218 -12.03234 7.102860 
1 1 1   12    9   22 o  113.538   2.9385  265.055   13.144  261.817   16.282  271.113   22.272  112.585   3.5064  114.491   4.7164 -1.906212 5.877034 
1 1 1   12    9   23 o  153.445   3.0577  485.047   18.658  480.166   23.404  493.560   30.907  152.442   3.7225  154.448   4.8519 -2.006195 6.115362 
1 1 1   12    9   24 o   76.052   4.3235  119.522   13.503  104.812   18.550  136.103   19.695   71.077   6.3277   81.027   5.8932 -9.949997 8.646982 
1 1 1   12    9   25 o   31.196   6.7788   13.687   9.7852   3.7360   11.679   37.132   17.926   21.102   8.5742   41.290   10.502 -20.18746 13.55755 
1 1 1   12    9   26 o  144.388   2.9236  423.926   16.503  409.323   20.166  453.538   28.716  140.746   3.4739  148.031   4.7034 -7.284805 5.847194 
1 1 1   12    9   27 o  136.294   3.3091  383.248   18.515  371.683   24.851  397.677   27.758  134.011   4.4961  138.576   4.8567 -4.565567 6.618299 
1 1 1   12    9   28 o   36.536   7.2223   29.159   10.703   30.584   12.651   25.569   20.076   37.541   8.3822   35.530   11.764 2.011494 14.44454 
1 1 1   12    9   29 o  116.803   6.8642  290.035   18.516  290.665   19.390  283.512   62.386  118.517   3.9667  115.089   13.143 3.427490 13.72833 
1 1 1   12    9   30 o  185.476   3.0230  714.327   22.432  719.375   28.512  706.125   36.343  186.445   3.7078  184.508   4.7757 1.937210 6.046082 
1 1 1   12    9   31 o   71.372   4.8361  109.251   12.595  112.698   14.850  100.410   23.780   73.667   4.8873   69.077   8.3467 4.590813 9.672289 
1 1 1   12    9   32 o   73.914   5.1812  117.719   14.123  121.644   16.770  108.147   26.190   76.416   5.3208   71.411   8.8920 5.004501 10.36241 
1 1 1   12    9   33 o   80.590   4.4770  138.528   13.424  141.670   15.981  130.998   24.742   82.483   4.6976   78.697   7.6229 3.785820 8.954089 
1 1 1   12    9   34 o   34.166   8.3886   20.944   15.767   3.2275   22.199   38.979   22.397   26.980   11.456   41.353   12.257 -14.37289 16.77715 
1 1 1   12    9   35 o   31.236   8.4064   14.135   16.322  -5.2823   24.696   29.196   21.750   25.907   11.518   36.564   12.248 -10.65667 16.81289 
1 1 1   12    9   36 o   63.318   6.1896   87.235   16.159   90.307   23.087   84.285   22.625   64.435   8.6871   62.200   8.8192 2.234688 12.37918 
1 1 1   12    9   37 o   85.912   5.7431  161.314   20.216  150.198   29.601  171.032   27.676   82.817   8.6660   89.008   7.5389 -6.190720 11.48629 
1 1 1   12    9   38 o   30.869   8.6693   14.760   17.284   25.391   20.920  -8.1062   30.682   34.071   11.992   27.666   12.523 6.404602 17.33867 
1 1 1   12    9   39 o   53.878   7.2223   67.157   15.680   73.915   22.079   60.280   22.273   57.432   9.3211   50.324   11.035 7.107445 14.44462 
1 1 1   12    9   40 o   31.214   8.6751   18.189   16.365   16.376   23.700   19.842   22.625   30.749   12.312   31.679   12.225 -0.9306374 17.35024 
1 1 1   12    9   41 o   29.941   7.7308   10.184   15.352   38.678   21.328 -20.4548   22.115   39.397   12.025   20.484   9.7188 18.91375 15.46160 
1 1 1   12    9   42 o   42.522   8.5987   45.520   16.438   29.848   22.139   64.774   24.539   34.731   12.324   50.313   11.994 -15.58219 17.19731 
1 1 1   12    9   43 o   30.092   8.1953   18.282   15.133   5.4704   21.735   30.338   21.084   25.635   11.115   34.549   12.046 -8.913389 16.39050 
1 1 1   12    9   44 o   60.047   8.0671   93.626   19.318   90.559   29.320   95.979   25.681   57.482   12.705   62.612   9.9446 -5.130474 16.13427 
1 1 1   12    9   45 o   24.302   7.8217 -12.8703   19.944   16.306   24.370 -72.0365   34.704   28.866   12.116   19.737   9.8957 9.128387 15.64348 
1 1 1   12    9   46 o   29.674   9.1633   18.660   21.212   16.606   31.164   20.433   28.955   29.390   13.008   29.959   12.909 -0.5682430 18.32657 
1 1 1   12    9   47 o   30.863   9.0953   20.058   22.156 -17.5669   33.446   49.481   29.576   23.780   11.460   37.946   14.127 -14.16549 18.19062 
1 1 1   12    9   48 o   34.293   10.163   42.085   24.944   20.939   33.936   66.936   36.789   29.014   13.148   39.573   15.499 -10.55890 20.32506 
1 1 1   12   10    0 o   93.341   2.4312  180.440   13.196  180.440   13.196  180.440   13.196   93.341   3.4383   93.341   3.4383 0.000000 0.000000 
1 1 1   12   10    1 o  260.501   2.8955  1400.46   29.384  1400.86   36.059  1399.66   50.697  260.582   3.3551  260.419   4.7200 0.1625977 5.790963 
1 1 1   12   10    2 o  551.279   4.2760  6278.48   96.364  6298.62  128.161  6252.30  146.167  552.344   5.6257  550.213   6.4410 2.131226 8.551928 
1 1 1   12   10    3 o  326.969   2.9276  2187.88   38.649  2120.76   49.465  2293.08   61.929  320.603   3.7408  333.335   4.5045 -12.73257 5.855263 
1 1 1   12   10    4 o  417.726   3.4461  3597.20   58.609  3573.86   76.843  3629.66   90.622  416.137   4.4771  419.314   5.2399 -3.177277 6.892145 
1 1 1   12   10    5 o  236.202   2.4623  1149.28   23.689  1139.74   31.076  1162.51   36.599  235.043   3.2056  237.362   3.7385 -2.319000 4.924640 
1 1 1   12   10    6 o  334.933   2.9754  2302.23   40.312  2251.23   51.881  2379.94   64.040  330.300   3.8083  339.565   4.5726 -9.265350 5.950782 
1 1 1   12   10    7 o  335.018   3.6243  2236.72   46.639  2536.90   85.076  2107.75   55.765  350.465   5.8857  319.571   4.2309 30.89450 7.248562 
1 1 1   12   10    8 o  232.722   2.9761  1080.04   26.929  1229.79   47.996  1011.23   32.532  244.069   4.7679  221.374   3.5631 22.69547 5.952133 
1 1 1   12   10    9 o  334.555   3.2877  2301.20   40.743  2332.19   77.225  2289.24   47.961  336.031   5.5720  333.079   3.4912 2.952545 6.575404 
1 1 1   12   10   10 o  437.601   3.9111  3960.70   64.170  3942.77  118.657  3968.12   76.289  436.752   6.5871  438.450   4.2187 -1.697998 7.822200 
1 1 1   12   10   11 o   53.302   3.9434   55.826   8.2134   88.645   13.161   34.887   10.512   65.518   4.8702   41.085   6.2034 24.43309 7.886758 
1 1 1   12   10   12 o  219.674   2.7030  995.934   22.471  996.377   40.946  995.744   26.880  219.670   4.5193  219.679   2.9667 -0.8804321E-02 5.406057 
1 1 1   12   10   13 o  133.448   2.2426  364.879   12.038  379.072   19.462  356.084   15.320  135.526   3.4817  131.370   2.8275 4.156006 4.485195 
1 1 1   12   10   14 o  130.606   2.3317  351.329   12.545  375.587   18.178  329.268   17.335  134.903   3.2671  126.309   3.3276 8.593864 4.663387 
1 1 1   12   10   15 o  126.186   2.3765  328.652   12.368  325.886   17.453  331.442   17.530  125.652   3.3678  126.719   3.3541 -1.067009 4.753067 
1 1 1   12   10   16 o  168.601   2.4623  585.149   17.026  602.109   25.630  571.753   22.778  170.773   3.6388  166.429   3.3184 4.344498 4.924672 
1 1 1   12   10   17 o  141.817   2.4741  415.012   14.415  418.306   21.387  412.270   19.514  142.325   3.6433  141.309   3.3482 1.015427 4.948110 
1 1 1   12   10   18 o   79.169   3.5709  128.595   10.974  126.641   13.369  132.631   19.213   78.291   4.1402   80.048   5.8193 -1.756912 7.141846 
1 1 1   12   10   19 o  160.135   2.6424  531.172   17.040  536.921   21.916  522.383   27.097  161.261   3.2951  159.009   4.1317 2.252060 5.284781 
1 1 1   12   10   20 o  234.830   2.6531  1139.05   24.797  1138.91   31.215  1139.30   40.825  234.861   3.2225  234.799   4.2157 0.6198120E-01 5.306226 
1 1 1   12   10   21 o  149.007   2.9349  460.209   17.953  474.190   24.463  443.892   26.429  151.485   3.9154  146.529   4.3731 4.956039 5.869828 
1 1 1   12   10   22 o  244.331   3.1194  1234.99   31.418  1207.61   44.853  1261.37   44.022  241.658   4.5001  247.005   4.3212 -5.347321 6.238885 
1 1 1   12   10   23 o  157.546   2.9400  513.927   17.695  515.168   21.343  511.197   31.649  157.928   3.2766  157.164   4.8825 0.7635193 5.880099 
1 1 1   12   10   24 o  114.491   3.3768  270.206   15.867  261.206   21.258  281.527   23.842  112.363   4.5870  116.620   4.9568 -4.257278 6.753539 
1 1 1   12   10   25 f  119.864   3.1927  300.671   15.468  316.630   20.287  278.513   23.905  123.752   3.9747  115.977   4.9975 7.774139 6.385408 
1 1 1   12   10   26 o  177.243   3.3937  653.052   24.700  593.127   35.345  710.247   34.531  169.225   5.0641  185.262   4.5192 -16.03719 6.787327 
1 1 1   12   10   27 o   53.136   6.0625   67.314   10.983   76.305   13.054   45.522   20.323   60.677   5.2161   45.594   10.946 15.08293 12.12507 
1 1 1   12   10   28 o   93.738   4.8381  180.041   18.544  152.732   24.628  215.794   28.180   85.642   6.9724  101.835   6.7092 -16.19295 9.676121 
1 1 1   12   10   29 o   93.417   6.1690  193.831   20.416  205.833   23.924  161.666   39.166   99.506   5.8293   87.328   10.874 12.17871 12.33801 
1 1 1   12   10   30 f   79.847   4.6580  140.063   13.454  148.959   15.934  117.964   25.114   84.745   4.5586   74.948   8.1245 9.797005 9.316034 
1 1 1   12   10   31 o  128.963   3.8580  346.850   20.432  354.937   27.827  337.390   30.096  130.658   5.1637  127.268   5.7335 3.390915 7.716004 
1 1 1   12   10   32 o   24.356   6.7858   7.4409   10.405   14.997   11.561 -24.7970   23.879   27.051   8.9253   21.661   10.224 5.389973 13.57164 
1 1 1   12   10   33 o   43.948   6.2563   58.270   11.439   78.904   13.343   1.0465   22.219   61.448   5.2646   26.448   11.351 35.00035 12.51266 
1 1 1   12   10   34 o   22.845   7.3227  -9.9772   14.963  -5.2207   21.285 -14.6248   21.040   24.033   10.688   21.658   10.013 2.375143 14.64540 
1 1 1   12   10   35 o  172.774   3.6561  626.661   25.997  602.946   37.549  648.495   36.030  169.521   5.3704  176.027   4.9626 -6.506760 7.312239 
1 1 1   12   10   36 o   47.410   8.1399   53.169   15.755   55.611   21.615   50.401   23.011   48.806   11.001   46.014   12.000 2.792084 16.27975 
1 1 1   12   10   37 o   26.240   7.9741  -1.0894   15.801   14.332   24.336 -12.3294   20.776   30.797   12.425   21.684   9.9985 9.112928 15.94826 
1 1 1   12   10   38 o   26.526   8.2478  -0.2765   17.244   6.9711   20.986 -15.3440   30.258   26.977   11.278   26.074   12.038 0.9034138 16.49557 
1 1 1   12   10   39 o   36.866   9.4738   30.203   17.898   37.400   30.578   26.452   22.075   39.454   14.420   34.278   12.291 5.176544 18.94768 
1 1 1   12   10   40 o   23.469   7.4306  -6.9158   15.276   6.2493   21.833 -19.5426   21.382   26.651   11.340   20.287   9.6052 6.364389 14.86127 
1 1 1   12   10   41 o   21.049   6.9568 -15.7265   15.181 -24.9608   21.825  -7.0716   21.130   19.509   9.3647   22.589   10.290 -3.079838 13.91354 
1 1 1   12   10   42 o   36.000   8.7516   31.802   16.155   20.591   21.994   44.936   23.806   30.863   12.013   41.137   12.730 -10.27375 17.50313 
1 1 1   12   10   43 o   27.981   8.3836   11.699   16.760   10.726   23.668   12.678   23.738   27.684   11.794   28.279   11.918 -0.5952091 16.76719 
1 1 1   12   10   44 o   24.035   7.6529  -3.7173   16.511   11.721   23.598 -18.5222   23.109   27.478   11.743   20.591   9.8166 6.886587 15.30577 
1 1 1   12   10   45 o   31.513   9.3017   23.945   19.898   25.376   25.068   21.507   32.717   31.592   12.658   31.434   13.633 0.1575203 18.60350 
1 1 1   12   10   46 o   34.011   9.8039   35.236   21.608   42.029   32.208   29.675   29.140   35.730   14.337   32.292   13.376 3.438686 19.60777 
1 1 1   12   10   47 o   22.908   7.7878 -14.9595   21.238 -17.3665   33.326 -13.3134   27.559   23.531   11.365   22.286   10.651 1.245031 15.57568 
1 1 1   12   10   48 o   39.573   9.4164   45.482   21.949  105.253   34.231   3.7547   28.602   54.247   14.861   24.900   11.568 29.34668 18.83280 
1 1 1   12   11    0 o  100.431   2.2994  208.702   13.438  208.702   13.438  208.702   13.438  100.431   3.2519  100.431   3.2519 0.000000 0.000000 
1 1 1   12   11    1 o  267.267   2.5841  1475.94   28.270  1491.01   37.828  1456.89   42.544  268.823   3.4118  265.710   3.8821 3.113129 5.168280 
1 1 1   12   11    2 o  411.867   3.3971  3502.02   57.147  3504.20   75.741  3499.14   87.076  412.044   4.4568  411.690   5.1282 0.3537903 6.794215 
1 1 1   12   11    3 o  150.228   2.1574  462.693   13.234  446.184   17.387  485.427   20.403  147.066   2.8665  153.389   3.2251 -6.323730 4.314844 
1 1 1   12   11    4 o  405.269   3.5947  3390.23   60.070  3359.89   83.849  3422.22   86.099  403.411   5.0395  407.127   5.1274 -3.716034 7.189363 
1 1 1   12   11    5 o  356.748   3.3026  2622.98   48.515  2698.47   71.030  2556.97   66.423  361.544   4.7634  351.952   4.5758 9.592529 6.605153 
1 1 1   12   11    6 o   87.255   2.2341  156.914   8.0154  155.018   10.886  159.158   11.846   86.682   3.0449   87.828   3.2701 -1.146675 4.468211 
1 1 1   12   11    7 o  182.945   2.6059  682.526   18.307  712.849   32.827  668.839   22.055  185.837   4.2828  180.052   2.9699 5.785538 5.211830 
1 1 1   12   11    8 o  212.285   2.7230  941.955   22.771  888.793   37.797  972.242   28.529  207.497   4.4165  217.072   3.1865 -9.575317 5.446017 
1 1 1   12   11    9 o  147.239   3.2992  451.601   15.948  441.051   35.676  454.235   17.829  146.100   5.9205  148.378   2.9133 -2.277771 6.598480 
1 1 1   12   11   10 o  129.883   2.6838  345.910   14.071  359.075   22.515  337.473   18.025  131.887   4.1391  127.879   3.4175 4.007782 5.367612 
1 1 1   12   11   11 o  124.059   2.8085  314.648   13.917  305.878   17.498  329.750   22.962  121.742   3.4847  126.375   4.4053 -4.632614 5.616928 
1 1 1   12   11   12 o  164.028   2.9338  535.902   19.447  658.356   31.612  461.345   24.666  178.566   4.2922  149.491   4.0006 29.07472 5.867540 
1 1 1   12   11   13 o  140.747   3.5401  408.897   20.551   0.0000   0.0000  408.897   20.551  ?   ?   140.747   3.5401      ?      ? 
1 1 1   12   11   14 o   54.426   3.5202   61.188   7.8942   65.024   11.279   57.505   11.052   56.099   4.8748   52.752   5.0798 3.347416 7.040493 
1 1 1   12   11   15 o  112.423   2.4161  260.905   11.203  262.193   15.892  259.634   15.795  112.699   3.4189  112.148   3.4148 0.5511703 4.832117 
1 1 1   12   11   16 o  131.687   3.1539  358.807   16.921  355.417   25.978  361.305   22.299  131.124   4.8035  132.249   4.0882 -1.125015 6.307741 
1 1 1   12   11   17 o  147.683   2.4672  448.788   14.969  467.505   22.354  433.574   20.155  150.458   3.6023  144.908   3.3722 5.550140 4.934424 
1 1 1   12   11   18 o  191.706   4.3036  729.321   23.600  717.547   25.352  805.755   64.595  186.423   3.2972  196.988   7.9505 -10.56491 8.607129 
1 1 1   12   11   19 o  169.260   2.3655  591.591   16.513  594.710   23.266  588.426   23.439  169.711   3.3240  168.809   3.3665 0.9017487 4.730972 
1 1 1   12   11   20 o   52.849   4.5394   57.935   9.1746   57.981   11.073   57.835   16.387   52.936   5.0715   52.763   7.5303 0.1730919 9.078826 
1 1 1   12   11   21 o  190.180   2.6090  748.308   19.691  751.232   24.715  743.227   32.584  190.737   3.1417  189.623   4.1663 1.113342 5.218033 
1 1 1   12   11   22 o  119.003   3.2893  296.516   15.419  305.530   19.311  280.662   25.611  121.587   3.8508  116.418   5.3338 5.169167 6.578604 
1 1 1   12   11   23 o   40.517   5.7024   45.703   9.7104   66.002   11.797   3.0552   17.100   56.463   5.0657   24.570   10.218 31.89347 11.40472 
1 1 1   12   11   24 o  120.023   3.3101  294.364   16.280  257.075   21.717  342.202   24.597  111.451   4.7244  128.595   4.6376 -17.14375 6.620220 
1 1 1   12   11   25 o  129.681   2.9679  343.721   15.008  335.559   18.331  360.312   26.136  127.432   3.4877  131.930   4.8031 -4.497849 5.935824 
1 1 1   12   11   26 o   54.534   6.4489   78.357   12.137  103.637   15.039   31.131   20.555   70.722   5.1558   38.347   11.823 32.37485 12.89790 
1 1 1   12   11   27 o  262.824   3.3675  1430.45   36.489  1376.02   51.275  1486.31   51.938  257.744   4.8234  267.904   4.7005 -10.15982 6.734927 
1 1 1   12   11   28 o  133.742   4.1881  373.030   23.020  395.797   31.943  348.428   33.205  138.056   5.6098  129.429   6.2202 8.627441 8.376209 
1 1 1   12   11   29 o   51.346   6.4950   60.793   11.425   65.211   13.293   48.302   22.352   55.995   5.7560   46.697   11.645 9.298515 12.98997 
1 1 1   12   11   30 o   85.378   4.1743  139.738   13.034  127.257   14.975  178.741   26.472   78.308   4.6366   92.448   6.9428 -14.13947 8.348671 
1 1 1   12   11   31 o   62.659   5.4320   75.677   12.942   65.968   15.193  101.351   24.706   56.130   6.5626   69.188   8.6577 -13.05779 10.86391 
1 1 1   12   11   32 o   63.645   5.3437   89.639   12.196   94.456   14.350   77.106   23.149   67.284   5.1708   60.006   9.3532 7.277817 10.68736 
1 1 1   12   11   33 o   27.846   7.2918   8.0201   9.8409   2.4988   11.146   27.536   20.956   19.864   8.2544   35.828   12.023 -15.96335 14.58354 
1 1 1   12   11   34 o   21.793   7.1320 -15.0420   15.142 -14.5427   21.813 -15.5063   21.035   22.138   10.221   21.448   9.9494 0.6905632 14.26393 
1 1 1   12   11   35 o   41.082   6.8912   45.405   11.810   56.575   13.742   13.841   23.101   51.638   6.4524   30.526   12.179 21.11155 13.78238 
1 1 1   12   11   36 o   39.242   7.6933   35.027   11.183   35.017   12.474   35.067   25.241   39.588   7.9163   38.897   13.194 0.6913338 15.38666 
1 1 1   12   11   37 o   27.591   7.2121   15.027   10.259   17.885   11.644   5.1137   21.685   28.448   8.9194   26.734   11.336 1.714216 14.42417 
1 1 1   12   11   38 o   48.772   8.7992   37.282   11.269   32.235   11.760   94.048   39.438   37.851   7.7924   59.693   15.779 -21.84214 17.59842 
1 1 1   12   11   39 o   37.914   9.7927   32.892   19.698   40.433   30.769   27.654   25.641   40.516   14.513   35.312   13.152 5.204350 19.58536 
1 1 1   12   11   40 o   29.754   8.3151   15.333   15.437   6.8310   21.858   23.793   21.804   26.749   11.363   32.759   12.142 -6.010372 16.63023 
1 1 1   12   11   41 o   38.179   8.0973   34.726   15.623   11.313   21.987   58.601   22.202   27.880   11.590   48.478   11.311 -20.59822 16.19454 
1 1 1   12   11   42 o   26.594   7.9573   5.6082   15.724  -8.0442   21.782   20.465   22.723   22.343   10.279   30.845   12.150 -8.501228 15.91465 
1 1 1   12   11   43 o   32.035   8.9968   23.957   17.864   31.552   26.059   17.223   24.538   34.512   13.169   29.558   12.262 4.953835 17.99356 
1 1 1   12   11   44 o   25.171   7.8787   3.9835   16.206   7.5200   23.025   0.5111   22.815   26.101   11.378   24.240   10.901 1.861139 15.75742 
1 1 1   12   11   45 o   24.771   8.4512 -16.4956   23.467 -27.8373   45.817 -12.4621   27.323   26.533   12.932   23.010   10.884 3.523039 16.90236 
1 1 1   12   11   46 o   24.053   8.1004 -12.5940   21.614  -2.6160   33.717 -19.5542   28.161   26.153   12.283   21.954   10.564 4.198891 16.20088 
1 1 1   12   11   47 o   43.199   11.816   80.389   28.689   64.615   35.290  111.129   49.264   39.924   15.303   46.475   18.009 -6.550411 23.63301 
1 1 1   12   11   48 o   27.226   8.7449   1.8133   21.611   46.476   34.775 -26.2898   27.585   34.276   14.434   20.175   9.8764 14.10063 17.48977 
1 1 1   12   12    0 o  488.278   4.1387  4922.81  117.834  4922.81  117.834  4922.81  117.834  488.278   5.8530  488.278   5.8530 0.000000 0.000000 
1 1 1   12   12    1 o  218.954   2.3682  989.209   21.201  989.417   28.192  988.940   32.165  218.988   3.1213  218.920   3.5623 0.6826782E-01 4.736324 
1 1 1   12   12    2 o  282.486   2.6625  1646.93   30.734  1648.07   40.792  1645.42   46.742  282.613   3.4996  282.359   4.0136 0.2539673 5.325040 
1 1 1   12   12    3 o  314.219   2.8622  2019.90   36.252  2120.06   58.384  1957.06   46.248  320.478   4.4170  307.959   3.6411 12.51920 5.724320 
1 1 1   12   12    4 f  250.140   2.5248  1290.47   25.748  1286.66   33.914  1295.66   39.563  249.716   3.2928  250.564   3.8283 -0.8482208 5.049558 
1 1 1   12   12    5 o  403.155   3.3567  3354.45   55.193  3347.39   72.787  3364.00   84.659  402.690   4.3825  403.620   5.0855 -0.9293518 6.713324 
1 1 1   12   12    6 o  202.656   2.4955  825.509   20.519  971.721   32.831  731.789   26.285  216.993   3.6684  188.318   3.3842 28.67525 4.991014 
1 1 1   12   12    7 o  214.783   2.6314  961.224   21.383  929.013   38.637  975.447   25.674  212.130   4.4160  217.437   2.8628 -5.306747 5.262801 
1 1 1   12   12    8 o  119.746   2.6729  281.467   12.491  340.525   22.317  254.527   15.073  128.433   4.2131  111.060   3.2906 17.37251 5.345871 
1 1 1   12   12    9 o  282.226   3.8761  1652.20   34.293  1635.59   81.710  1655.75   37.782  281.190   7.0454  283.262   3.2339 -2.071960 7.752182 
1 1 1   12   12   10 o  247.399   2.8793  1256.05   27.502  1284.84   48.572  1242.46   33.366  249.428   4.7214  245.370   3.2969 4.058182 5.758608 
1 1 1   12   12   11 f  218.540   2.5945  961.091   22.983  1119.39   36.900  860.761   29.377  232.863   3.8420  204.216   3.4878 28.64658 5.188993 
1 1 1   12   12   12 o  403.942   3.8284  3380.25   60.490  3347.59  103.244  3397.32   74.643  402.309   6.2222  405.576   4.4622 -3.266296 7.656790 
1 1 1   12   12   13 o  304.894   3.2244  1907.46   37.826  1955.84   67.277  1885.10   45.740  307.612   5.3027  302.177   3.6700 5.434387 6.448851 
1 1 1   12   12   14 o  274.582   2.5603  1556.36   28.989  1543.03   40.522  1570.34   41.488  273.379   3.5938  275.784   3.6475 -2.404144 5.120515 
1 1 1   12   12   15 o  116.014   2.9564  282.012   13.439  291.335   16.741  265.114   22.538  118.785   3.4170  113.244   4.8255 5.540886 5.912826 
1 1 1   12   12   16 o  373.930   3.2996  2889.25   50.200  2883.64   65.775  2897.09   77.689  373.568   4.2690  374.292   5.0325 -0.7244263 6.599300 
1 1 1   12   12   17 o  221.429   3.1366  1016.90   27.690  1027.63   35.038  999.062   45.190  223.052   3.8086  219.806   4.9846 3.245865 6.273113 
1 1 1   12   12   18 f  224.989   2.6636  1044.88   24.323  1041.59   31.671  1049.60   37.977  224.590   3.4191  225.388   4.0853 -0.7983093 5.327255 
1 1 1   12   12   19 o  115.742   2.7305  272.688   12.690  259.826   16.027  294.299   20.775  112.160   3.4645  119.324   4.2213 -7.163963 5.461011 
1 1 1   12   12   20 o  170.656   2.7843  602.503   19.474  608.020   26.176  595.664   29.142  171.553   3.6995  169.760   4.1622 1.792892 5.568621 
1 1 1   12   12   21 o  210.769   2.6353  907.058   21.898  882.044   27.053  954.586   37.291  206.663   3.1739  214.875   4.2078 -8.212112 5.270577 
1 1 1   12   12   22 o  168.547   3.3880  580.066   23.392  518.298   30.992  661.831   35.658  158.264   4.7479  178.830   4.8345 -20.56548 6.776048 
1 1 1   12   12   23 o  174.992   2.8099  634.931   20.113  648.483   26.937  617.857   30.236  177.139   3.6870  172.846   4.2413 4.293533 5.619809 
1 1 1   12   12   24 f  139.349   3.1063  401.757   17.775  402.206   24.050  401.215   26.388  139.455   4.1814  139.242   4.5948 0.2132568 6.212584 
1 1 1   12   12   25 o  120.551   3.0687  302.598   14.549  307.193   18.112  294.240   24.429  121.911   3.6020  119.191   4.9692 2.720276 6.137423 
1 1 1   12   12   26 o  153.572   3.0240  480.838   18.578  460.006   23.340  516.860   30.691  149.154   3.7940  157.989   4.7100 -8.835144 6.048039 
1 1 1   12   12   27 f   52.350   5.7839   58.708   11.196   59.579   13.526   56.813   19.953   53.540   6.1251   51.160   9.8131 2.380325 11.56781 
1 1 1   12   12   28 o   70.320   4.6064  102.711   12.459  102.159   15.093  103.891   22.077   70.153   5.2162   70.487   7.5939 -0.3342361 9.212855 
1 1 1   12   12   29 o  263.216   3.6454  1441.99   39.295  1417.81   58.918  1461.36   52.738  261.101   5.4710  265.331   4.8191 -4.229828 7.290830 
1 1 1   12   12   30 o   67.673   7.6535   98.536   13.739   98.219   14.712  100.703   38.416   68.723   5.1903   66.624   14.400 2.099571 15.30703 
1 1 1   12   12   31 o  116.624   4.7456  283.097   22.827  283.097   22.827   0.0000   0.0000  116.624   4.7456  ?   ?       ?      ? 
1 1 1   12   12   32 o   31.414   7.4593   19.940   10.346   19.954   11.876   19.894   21.071   30.239   8.9152   32.589   11.962 -2.350454 14.91851 
1 1 1   12   12   33 o  123.022   3.3918  313.346   16.164  307.846   19.654  324.846   28.417  121.639   3.9175  124.406   5.5382 -2.766563 6.783645 
1 1 1   12   12   34 o   35.560   7.1987   17.538   14.939 -18.9950   20.550   58.488   21.756   20.420   9.5901   50.700   10.738 -30.28026 14.39733 
1 1 1   12   12   35 o   89.148   4.8518  170.003   17.796  169.887   24.348  170.135   26.077   89.228   6.6159   89.068   7.0985 0.1604385 9.703614 
1 1 1   12   12   36 o   55.419   6.6969   69.023   12.329   69.025   14.012   69.017   25.951   57.007   5.9593   53.832   11.995 3.175495 13.39389 
1 1 1   12   12   37 f   79.082   5.4128  134.705   17.600  126.172   23.770  145.060   26.185   76.379   7.5456   81.786   7.7626 -5.406754 10.82562 
1 1 1   12   12   38 o   66.548   5.1555   95.198   12.448   93.941   14.492   98.735   24.311   66.543   5.2802   66.554   8.8565 -0.1082611E-01 10.31104 
1 1 1   12   12   39 o   41.321   6.8533   51.677   12.209   63.990   13.664   2.9101   27.192   54.600   6.0678   28.042   12.290 26.55792 13.70662 
1 1 1   12   12   40 o   48.637   6.9043   53.496   11.778   51.743   13.512   59.041   24.037   48.761   6.7185   48.514   12.064 0.2470665 13.80856 
1 1 1   12   12   41 o   43.226   7.1815   42.141   11.053   38.829   12.587   53.299   23.102   41.125   7.7040   45.328   12.122 -4.203728 14.36297 
1 1 1   12   12   42 o   69.924   6.2071  113.843   16.643   77.061   22.747  156.223   24.416   56.113   10.204   83.734   7.0698 -27.62116 12.41418 
1 1 1   12   12   43 o   27.570   8.4689   6.4762   18.770 -11.0836   26.594   23.907   26.496   23.424   10.972   31.716   12.904 -8.291498 16.93786 
1 1 1   12   12   44 o   36.557   8.4669   33.620   17.548   63.015   24.697   3.6543   24.936   47.483   12.456   25.632   11.472 21.85017 16.93372 
1 1 1   12   12   45 o   27.269   12.154   10.310   27.686   0.0000   0.0000   10.310   27.686  ?   ?    27.269   12.154      ?      ? 
1 1 1   12   12   46 o   28.020   9.1920   3.3484   27.491   27.166   33.421 -46.4836   48.342   31.301   13.675   24.738   12.287 6.563454 18.38395 
1 1 1   12   12   47 o   31.655   9.7340   33.898   23.765   22.596   46.148   37.978   27.724   30.094   14.207   33.216   13.310 -3.121910 19.46793 
1 1 1   12   13    0 o   77.592   2.4946  124.968   11.237  124.968   11.237  124.968   11.237   77.592   3.5279   77.592   3.5279 0.000000 0.000000 
1 1 1   12   13    1 o  585.641   4.8161  7090.73  116.331  7080.60  164.167  7100.95  164.868  585.224   6.8014  586.059   6.8207 -0.8358765 9.632295 
1 1 1   12   13    2 o  297.684   2.9480  1819.89   36.024  1921.11   54.157  1739.55   48.245  305.061   4.3043  290.307   4.0293 14.75473 5.895945 
1 1 1   12   13    3 f  324.465   2.6864  2172.56   35.946  2156.02   50.395  2189.69   51.288  323.209   3.7804  325.720   3.8177 -2.510834 5.372760 
1 1 1   12   13    4 o  277.100   2.6570  1582.95   29.985  1573.39   39.350  1596.19   46.305  276.121   3.4553  278.079   4.0373 -1.957916 5.314010 
1 1 1   12   13    5 o  363.737   3.1240  2731.05   46.360  2727.83   61.207  2735.38   71.003  363.516   4.0824  363.957   4.7300 -0.4404907 6.248093 
1 1 1   12   13    6 o  304.779   2.8209  1897.67   34.590  2005.39   56.087  1831.54   43.942  311.658   4.3633  297.900   3.5764 13.75839 5.641718 
1 1 1   12   13    7 o  373.536   3.5112  2879.27   48.900  2887.88   91.450  2875.82   57.868  373.803   5.9317  373.268   3.7588 0.5350037 7.022332 
1 1 1   12   13    8 o   66.525   3.1724   90.895   7.6280   92.401   15.042   90.374   8.8503   66.873   5.4537   66.177   3.2426 0.6965179 6.344848 
1 1 1   12   13    9 o  154.361   3.6286  517.600   21.858  394.215   34.405  601.110   28.305  138.087   6.0409  170.635   4.0219 -32.54736 7.257285 
1 1 1   12   13   10 o  172.583   2.6308  587.560   16.980  679.623   32.628  553.368   19.884  181.409   4.3608  163.757   2.9440 17.65244 5.261561 
1 1 1   12   13   11 f  315.666   2.8931  2042.07   36.859  2131.65   59.077  1984.96   47.166  321.253   4.4586  310.079   3.6880 11.17340 5.786259 
1 1 1   12   13   12 o  185.835   2.2662  712.523   16.882  713.977   27.311  711.624   21.477  185.969   3.5607  185.700   2.8042 0.2687225 4.532320 
1 1 1   12   13   13 o  181.683   2.6407  670.725   18.361  710.706   33.241  653.171   22.026  185.473   4.3453  177.892   3.0020 7.581131 5.281451 
1 1 1   12   13   14 o  431.030   4.0869  3838.93   68.264  3863.75  119.191  3826.81   83.275  431.800   6.6926  430.261   4.6926 1.539246 8.173867 
1 1 1   12   13   15 o  187.102   2.9819  737.385   21.565  681.962   37.004  765.887   26.537  181.607   4.9403  192.597   3.3406 -10.98972 5.963739 
1 1 1   12   13   16 o  280.449   2.7877  1627.64   32.022  1650.62   43.005  1599.05   47.974  282.705   3.6882  278.194   4.1811 4.510529 5.575380 
1 1 1   12   13   17 o  140.076   3.0130  398.578   16.553  384.040   20.288  427.522   28.627  136.362   3.6073  143.790   4.8271 -7.427444 6.026081 
1 1 1   12   13   18 o   81.826   3.3530  139.413   10.912  142.126   13.794  134.875   17.838   82.930   4.0330   80.722   5.3578 2.208366 6.706017 
1 1 1   12   13   19 o  249.231   2.7727  1281.11   28.048  1269.89   36.478  1297.34   43.869  247.942   3.5671  250.520   4.2457 -2.578110 5.545299 
1 1 1   12   13   20 o  178.751   3.2926  657.300   24.148  627.455   32.256  695.356   36.423  174.179   4.4900  183.322   4.8173 -9.142563 6.585291 
1 1 1   12   13   21 o   79.039   4.0463  137.394   12.172  154.843   15.210  106.312   20.301   86.533   4.2617   71.545   6.8796 14.98874 8.092664 
1 1 1   12   13   22 o  100.762   3.7674  207.910   15.567  183.920   20.798  238.469   23.473   94.227   5.3516  107.298   5.3041 -13.07152 7.534776 
1 1 1   12   13   23 o   99.479   3.3117  207.453   13.039  214.776   16.450  195.074   21.387  101.925   3.9130   97.033   5.3440 4.892059 6.623456 
1 1 1   12   13   24 o   73.035   4.1216  112.971   11.406  116.830   13.788  104.606   20.301   75.141   4.4490   70.929   6.9395 4.211433 8.243233 
1 1 1   12   13   25 o  166.396   3.0978  570.003   21.123  548.246   28.093  598.302   32.039  162.788   4.1841  170.004   4.5693 -7.216507 6.195634 
1 1 1   12   13   26 o   95.673   3.5532  185.615   13.278  177.495   16.181  202.357   23.235   92.608   4.2363   98.738   5.7055 -6.129761 7.106306 
1 1 1   12   13   27 o  167.313   3.9660  571.042   27.109  483.717   35.807  688.315   41.495  152.579   5.6899  182.047   5.5264 -29.46866 7.931967 
1 1 1   12   13   28 o  116.562   3.7820  281.656   18.157  262.741   25.027  302.672   26.381  112.433   5.3971  120.691   5.2997 -8.258339 7.564052 
1 1 1   12   13   29 o  213.208   3.3336  943.399   29.310  930.696   41.004  956.672   41.912  211.746   4.6951  214.669   4.7337 -2.923096 6.667212 
1 1 1   12   13   30 o   47.303   8.8914   35.904   11.744   31.957   12.336   74.085   38.366   38.212   8.0800   56.393   15.841 -18.18176 17.78278 
1 1 1   12   13   31 o   65.788   5.5357   93.785   12.679   95.745   14.573   87.681   25.716   67.725   5.2172   63.850   9.7652 3.874111 11.07149 
1 1 1   12   13   32 o  140.565   3.5925  406.962   20.670  354.288   27.395  476.580   31.495  130.155   5.1033  150.975   5.0579 -20.81976 7.185095 
1 1 1   12   13   33 o   48.042   6.6000   52.727   11.004   54.557   12.696   47.201   22.062   50.885   6.0493   45.198   11.732 5.687252 13.20005 
1 1 1   12   13   34 f   31.362   8.3620   17.760   14.873   12.381   20.610   23.604   21.484   28.974   11.521   33.750   12.123 -4.776327 16.72403 
1 1 1   12   13   35 o  107.910   3.8230  253.454   15.468  265.637   18.655  226.655   27.669  112.755   4.0115  103.065   6.5091 9.689980 7.645950 
1 1 1   12   13   36 o   19.008   6.2942  -9.1653   10.093  -7.7723   11.358 -14.3955   22.008   16.047   7.3971   21.968   10.186 -5.920532 12.58840 
1 1 1   12   13   37 o   52.465   6.3924   58.423   11.500   55.206   13.090   69.304   24.072   50.809   6.2463   54.122   11.155 -3.312828 12.78479 
1 1 1   12   13   38 o   73.514   5.7885  127.563   15.400  140.714   18.571   98.615   27.554   81.318   5.5371   65.710   10.167 15.60765 11.57695 
1 1 1   12   13   39 o   42.659   7.8539   53.767   12.560   59.213   13.318   9.9863   37.764   52.419   6.1602   32.898   14.450 19.52180 15.70786 
1 1 1   12   13   40 o   19.758   6.4001  -4.0739   10.334  -0.2572   11.596 -18.7990   22.777   18.522   8.0743   20.994   9.9322 -2.471609 12.80015 
1 1 1   12   13   41 o   41.151   7.1065   46.540   11.665   53.021   13.410   26.390   23.645   49.086   6.6239   33.216   12.575 15.87015 14.21308 
1 1 1   12   13   42 o   37.880   10.326   40.024   21.157   40.668   23.804   37.601   46.169   38.418   12.814   37.343   16.196 1.074776 20.65153 
1 1 1   12   13   43 o   24.532   7.2560   9.7006   11.448   13.735   12.645  -8.6192   26.945   25.060   9.2553   24.004   11.177 1.055742 14.51191 
1 1 1   12   13   44 o   34.530   8.1016   32.158   12.321   32.681   13.713   29.966   28.066   36.016   9.1985   33.044   13.339 2.971901 16.20324 
1 1 1   12   13   45 o   33.081   10.293   31.880   27.160   21.950   47.941   36.573   32.959   32.041   14.916   34.122   14.188 -2.080845 20.58615 
1 1 1   12   13   46 o   29.145   9.8485   22.833   14.063   22.833   14.063   0.0000   0.0000   29.145   9.8485  ?   ?       ?      ? 
1 1 1   12   13   47 o   27.602   8.9879   12.680   23.284   28.048   35.955   1.5813   30.557   30.261   13.640   24.943   11.708 5.318491 17.97572 
1 1 1   12   14    0 o   79.273   2.4410  130.377   11.238  130.377   11.238  130.377   11.238   79.273   3.4520   79.273   3.4520 0.000000 0.000000 
1 1 1   12   14    1 o  333.265   3.1339  2293.22   43.076  2291.66   60.898  2294.79   60.940  333.152   4.4320  333.379   4.4320 -0.2273560 6.267782 
1 1 1   12   14    2 o  446.052   3.6189  4102.19   65.649  4154.69  101.994  4065.06   85.780  448.425   5.5147  443.678   4.6876 4.747131 7.237765 
1 1 1   12   14    3 o  291.723   2.5206  1755.74   30.318  1780.56   43.546  1732.40   42.236  293.721   3.5946  289.724   3.5345 3.996368 5.041191 
1 1 1   12   14    4 o  363.174   3.1165  2723.75   46.208  2726.27   61.161  2720.41   70.531  363.401   4.0806  362.947   4.7117 0.4548035 6.233036 
1 1 1   12   14    5 o  229.725   2.3492  1092.93   21.728  1071.11   34.545  1107.21   27.949  227.803   3.6767  231.647   2.9253 -3.844376 4.698460 
1 1 1   12   14    6 o   41.705   4.1981   41.876   6.0685   23.586   10.088   52.247   7.5966   33.100   7.5561   50.311   3.6609 -17.21177 8.396224 
1 1 1   12   14    7 o  428.364   3.8568  3797.14   61.852  3780.26  114.650  3804.06   73.459  427.500   6.5024  429.228   4.1494 -1.728455 7.713574 
1 1 1   12   14    8 o   63.662   3.8145   78.021   7.8359   93.217   18.806   74.829   8.6198   67.115   6.7937   60.210   3.4711 6.904949 7.629089 
1 1 1   12   14    9 o  247.345   3.6133  1281.62   28.320  1237.26   66.133  1291.58   31.339  244.522   6.5575  250.168   3.0373 -5.646286 7.226701 
1 1 1   12   14   10 o  157.187   2.5885  505.098   15.534  523.287   28.100  497.093   18.641  159.172   4.2803  155.202   2.9122 3.970810 5.177051 
1 1 1   12   14   11 o  284.076   2.6056  1672.04   29.797  1639.51   47.397  1693.30   38.315  281.743   4.0788  286.409   3.2435 -4.666138 5.211202 
1 1 1   12   14   12 o  154.736   2.2236  496.421   13.845  484.302   22.020  504.345   17.805  153.149   3.4860  156.323   2.7615 -3.174133 4.447296 
1 1 1   12   14   13 o  295.378   3.0730  1794.42   33.732  1822.80   63.621  1783.32   39.785  296.864   5.1961  293.893   3.2822 2.970947 6.145901 
1 1 1   12   14   14 o  196.297   2.4892  793.328   19.887  810.083   30.873  781.445   26.000  198.043   3.7797  194.551   3.2402 3.491974 4.978462 
1 1 1   12   14   15 o   83.189   2.6413  142.877   9.0606  145.670   12.979  140.222   12.655   83.981   3.7470   82.396   3.7237 1.584755 5.282641 
1 1 1   12   14   16 o  262.252   2.7200  1421.38   29.156  1425.02   38.745  1416.62   44.269  262.670   3.5764  261.833   4.0993 0.8371277 5.440086 
1 1 1   12   14   17 o  280.248   3.3657  1611.05   37.440  1576.33   46.722  1673.36   62.588  276.170   4.1018  284.326   5.3372 -8.155609 6.731307 
1 1 1   12   14   18 o  229.932   2.4579  1091.99   23.308  1096.21   33.136  1087.84   32.792  230.372   3.4874  229.493   3.4644 0.8788605 4.915732 
1 1 1   12   14   19 o   91.003   3.0306  172.129   11.196  176.599   14.701  165.956   17.275   92.440   3.8559   89.566   4.6765 2.874008 6.061116 
1 1 1   12   14   20 o  322.845   3.8399  2148.99   49.615  2118.29   62.764  2200.14   81.011  319.952   4.7562  325.738   6.0299 -5.785980 7.679899 
1 1 1   12   14   21 o  104.628   3.9941  227.603   17.163  204.555   24.354  250.343   24.191   99.321   5.9452  109.935   5.3352 -10.61414 7.988116 
1 1 1   12   14   22 o   32.988   6.9503   22.620   9.3424   22.687   10.837   22.425   18.433   32.369   8.1289   33.608   11.276 -1.239193 13.90051 
1 1 1   12   14   23 o   60.721   5.4144   85.326   10.979   93.454   12.860   63.475   21.086   67.195   4.6402   54.247   9.7843 12.94834 10.82881 
1 1 1   12   14   24 f  202.829   2.7737  844.449   22.072  830.627   27.185  871.187   37.809  200.496   3.2874  205.161   4.4683 -4.665237 5.547307 
1 1 1   12   14   25 o   42.406   7.1370   38.275   13.610   15.272   19.161   61.701   19.336   30.505   11.368   54.307   8.6328 -23.80191 14.27393 
1 1 1   12   14   26 o   96.400   4.2762  194.003   16.864  199.982   22.665  186.589   25.239   98.127   5.6003   94.674   6.4637 3.453621 8.552362 
1 1 1   12   14   27 o   66.808   5.3785   81.259   13.263   68.287   15.201  122.625   27.145   57.237   6.4393   76.380   8.6168 -19.14272 10.75704 
1 1 1   12   14   28 o   36.015   6.2115   33.130   10.883   48.108   12.848  -4.9202   20.478   48.004   6.4891   24.026   10.594 23.97834 12.42306 
1 1 1   12   14   29 o   60.089   5.1426   70.062   11.865   61.227   14.047   92.057   22.165   54.118   6.2934   66.059   8.1351 -11.94100 10.28526 
1 1 1   12   14   30 o  169.878   3.5677  602.697   24.228  606.008   30.753  597.280   39.338  170.724   4.3674  169.031   5.6426 1.693832 7.135358 
1 1 1   12   14   31 o  102.744   4.2364  222.430   17.868  231.345   24.438  212.191   26.191  105.069   5.6392  100.420   6.3235 4.649384 8.472770 
1 1 1   12   14   32 o   96.104   3.7910  189.761   13.776  184.033   16.366  203.685   25.515   93.972   4.2226   98.236   6.2973 -4.264061 7.581986 
1 1 1   12   14   33 o   51.334   6.5102   60.520   11.492   62.991   13.322   53.337   22.715   54.673   5.9080   47.995   11.603 6.678532 13.02047 
1 1 1   12   14   34 o   58.684   5.5656   70.355   11.876   65.925   13.684   83.875   23.906   55.751   5.9512   61.618   9.4067 -5.866920 11.13119 
1 1 1   12   14   35 o   24.884   7.1877  -5.8307   10.008 -13.3234   11.072   27.609   23.391   14.304   6.8123   35.465   12.659 -21.16181 14.37544 
1 1 1   12   14   36 o   36.040   7.0966   33.276   11.209   40.003   12.958   13.274   22.343   42.408   7.6916   29.672   11.928 12.73673 14.19322 
1 1 1   12   14   37 o   26.494   6.7275   14.523   10.121   21.469   11.367 -12.0603   22.237   30.624   8.6293   22.364   10.323 8.259964 13.45502 
1 1 1   12   14   38 o   25.955   7.5260   4.1897   11.054  -1.0282   12.516   22.690   23.568   19.057   8.3457   32.854   12.526 -13.79681 15.05200 
1 1 1   12   14   39 o   31.343   8.8889   6.7513   10.784   2.5621   11.287   50.611   36.521   19.523   8.2225   43.163   15.762 -23.64006 17.77778 
1 1 1   12   14   40 o   38.613   7.4824   38.436   11.670   40.990   13.502   30.895   23.202   42.085   8.0724   35.141   12.601 6.944393 14.96477 
1 1 1   12   14   41 o   81.611   5.1825  148.912   17.362  146.513   23.390  151.856   25.911   81.176   6.9860   82.046   7.6570 -0.8701859 10.36506 
1 1 1   12   14   42 o   21.430   6.9610  -5.7366   11.300  -9.3544   12.740   7.6042   24.465   16.226   7.5984   26.633   11.666 -10.40641 13.92204 
1 1 1   12   14   43 o   34.029   8.5053   22.300   17.588  -6.8572   23.440   59.863   26.605   22.798   10.550   45.260   13.344 -22.46197 17.01057 
1 1 1   12   14   44 o   24.764   7.6216   9.4168   12.735   13.041   13.730 -12.9100   34.075   24.540   9.5079   24.988   11.915 -0.4477959 15.24327 
1 1 1   12   14   45 f   27.976   8.4217   9.0002   12.727   2.5348   13.848   44.179   32.301   20.098   8.7906   35.854   14.368 -15.75640 16.84339 
1 1 1   12   14   46 o   16.029   7.5482  -8.5387   12.881  -8.5387   12.881   0.0000   0.0000   16.029   7.5482  ?   ?       ?      ? 
1 1 1   12   15    0 o  117.686   2.2810  286.364   15.631  286.364   15.631  286.364   15.631  117.686   3.2258  117.686   3.2258 0.000000 0.000000 
1 1 1   12   15    1 o  361.170   3.0908  2696.39   45.693  2671.27   68.826  2716.19   61.100  359.634   4.6401  362.707   4.0843 -3.073700 6.181596 
1 1 1   12   15    2 o  177.100   2.2228  646.076   16.062  655.263   24.662  639.307   21.168  178.183   3.3557  176.017   2.9158 2.165482 4.445561 
1 1 1   12   15    3 o  107.603   2.3344  239.034   10.355  241.603   14.471  236.338   14.825  108.197   3.2427  107.009   3.3589 1.188324 4.668789 
1 1 1   12   15    4 o   93.392   2.8025  184.808   10.486  155.043   16.049  206.979   13.851   86.642   4.4911  100.141   3.3536 -13.49860 5.604993 
1 1 1   12   15    5 o  231.534   2.3741  1103.33   21.941  1118.92   35.992  1094.12   27.679  232.807   3.7484  230.261   2.9145 2.545380 4.748151 
1 1 1   12   15    6 o  125.623   2.4835  329.848   11.781  315.524   21.301  336.160   14.140  123.608   4.1781  127.638   2.6860 -4.030151 4.967045 
1 1 1   12   15    7 o  349.848   3.3477  2538.76   44.045  2504.04   80.833  2553.43   52.528  348.006   5.6317  351.690   3.6213 -3.683319 6.695496 
1 1 1   12   15    8 o   75.608   3.6005  116.642   8.6075  120.526   20.501  115.811   9.4839   76.308   6.5140   74.908   3.0697 1.399994 7.201020 
1 1 1   12   15    9 o   35.993   5.0329   35.450   6.4499   11.715   12.523   44.019   7.5247   25.819   9.2576   46.167   3.9518 -20.34772 10.06574 
1 1 1   12   15   10 o  143.756   2.5543  424.303   14.058  433.347   25.214  420.223   16.934  144.825   4.2211  142.686   2.8775 2.138245 5.108617 
1 1 1   12   15   11 o   83.781   2.3902  142.945   8.0176  153.037   13.207  137.055   10.090   86.079   3.7199   81.482   3.0023 4.597076 4.780307 
1 1 1   12   15   12 o  141.706   2.2108  416.607   12.584  405.286   20.094  423.912   16.141  140.096   3.4776  143.316   2.7306 -3.219315 4.421518 
1 1 1   12   15   13 o  245.560   2.5543  1234.37   25.326  1297.55   40.599  1194.12   32.404  250.627   3.9275  240.493   3.2668 10.13400 5.108588 
1 1 1   12   15   14 o   66.772   4.6997  109.502   10.234   63.556   19.690  126.508   11.979   55.282   8.6357   78.262   3.7112 -22.97987 9.399354 
1 1 1   12   15   15 o  263.900   2.7152  1441.60   29.340  1415.08   44.005  1462.83   39.368  261.680   4.0773  266.120   3.5867 -4.440308 5.430368 
1 1 1   12   15   16 o  163.783   2.4378  554.542   16.364  558.452   21.985  549.686   24.503  164.446   3.2414  163.121   3.6420 1.325348 4.875500 
1 1 1   12   15   17 o  135.851   2.7224  380.427   15.119  374.604   20.018  388.160   23.067  134.660   3.6043  137.041   4.0812 -2.381210 5.444880 
1 1 1   12   15   18 o  150.036   2.4692  466.485   15.225  443.822   22.151  486.780   20.962  146.558   3.6645  153.515   3.3107 -6.956726 4.938492 
1 1 1   12   15   19 o   43.070   4.5583   40.021   7.6214   28.551   10.842   51.227   10.716   36.402   7.4715   49.738   5.2238 -13.33614 9.116515 
1 1 1   12   15   20 f  304.980   3.7700  1910.16   45.924  1862.29   57.776  1992.31   75.685  299.993   4.6695  309.967   5.9201 -9.973999 7.539997 
1 1 1   12   15   21 o   59.552   4.3692   72.571   9.9687   70.892   11.981   76.347   17.971   58.514   4.9645   60.590   7.1911 -2.076424 8.738331 
1 1 1   12   15   22 o  144.969   2.7635  435.107   15.814  436.553   19.712  432.495   26.492  145.363   3.2878  144.576   4.4427 0.7866058 5.526958 
1 1 1   12   15   23 o   72.593   3.8688  104.454   11.071   94.132   13.511  125.550   19.314   67.416   4.8590   77.769   6.0216 -10.35256 7.737556 
1 1 1   12   15   24 o  165.408   2.7731  554.396   18.022  529.833   22.101  603.155   31.138  160.116   3.3466  170.699   4.4227 -10.58318 5.546210 
1 1 1   12   15   25 o  231.840   3.5960  1099.13   33.998  1017.10   44.268  1217.08   53.084  221.504   4.8455  242.176   5.3146 -20.67125 7.191909 
1 1 1   12   15   26 o  201.231   3.7286  839.996   30.775  832.023   41.311  849.937   46.130  200.230   5.0023  202.232   5.5306 -2.002533 7.457235 
1 1 1   12   15   27 o   41.092   7.2015   37.521   11.786   38.816   14.604   35.101   19.962   42.191   8.6818   39.994   11.492 2.196819 14.40296 
1 1 1   12   15   28 f   37.421   6.8804   34.529   11.161   42.823   12.919   10.117   22.162   45.219   6.9267   29.624   11.890 15.59565 13.76075 
1 1 1   12   15   29 o   65.995   5.0643   87.427   12.486   81.995   14.613  102.120   24.033   62.638   5.6564   69.353   8.4020 -6.714684 10.12863 
1 1 1   12   15   30 o  120.763   4.7763  311.678   23.439  266.146   34.337  351.408   32.074  112.115   7.4256  129.411   6.0093 -17.29549 9.552509 
1 1 1   12   15   31 o   54.960   8.0625   60.923   11.974   58.708   12.701   78.607   35.887   52.841   5.8279   57.079   15.035 -4.237446 16.12491 
1 1 1   12   15   32 o   40.430   7.1562   34.106   10.501   31.418   11.971   43.080   21.872   37.673   7.9538   43.186   11.899 -5.512070 14.31231 
1 1 1   12   15   33 o   31.402   7.7034   13.294   10.551   6.8980   11.802   38.753   23.546   22.225   8.7557   40.579   12.677 -18.35439 15.40683 
1 1 1   12   15   34 o   89.255   4.4732  163.368   14.280  157.173   16.385  182.943   29.126   86.548   4.5900   91.962   7.6791 -5.414581 8.946325 
1 1 1   12   15   35 o   64.819   7.2327   98.075   18.156  112.821   24.168   78.973   27.507   71.962   8.1428   57.677   11.956 14.28503 14.46537 
1 1 1   12   15   36 o   26.221   7.0487   12.748   10.648   18.327   12.041  -7.2726   22.810   28.645   9.0816   23.798   10.783 4.847113 14.09745 
1 1 1   12   15   37 o   22.360   7.5127  -5.7499   10.615  -4.8817   11.119 -14.6877   35.674   16.657   7.5393   28.064   12.997 -11.40724 15.02531 
1 1 1   12   15   38 o   50.005   6.9319   56.200   12.634   53.482   14.817   63.442   24.187   49.390   7.2734   50.620   11.803 -1.229191 13.86370 
1 1 1   12   15   39 o   64.503   6.4695  103.909   13.427  111.585   15.507   80.914   26.840   72.233   5.2053   56.773   11.846 15.45998 12.93894 
1 1 1   12   15   40 o   47.330   8.2023   57.507   15.913   61.629   22.477   53.364   22.532   49.336   11.290   45.324   11.901 4.011715 16.40460 
1 1 1   12   15   41 o   19.743   6.4667  -5.3012   10.334  -5.3824   11.686  -5.0102   22.136   16.596   7.5956   22.891   10.468 -6.294292 12.93343 
1 1 1   12   15   42 o   28.440   7.4206   19.612   11.180   23.191   12.405   4.1260   25.802   30.678   9.1281   26.203   11.702 4.475355 14.84127 
1 1 1   12   15   43 o   26.230   7.6792   10.566   11.248   7.3233   12.586   23.431   25.070   21.665   8.8629   30.795   12.543 -9.130337 15.35839 
1 1 1   12   15   44 o   26.511   7.8675   14.266   12.779   15.744   14.076   7.3352   30.481   25.840   9.7206   27.182   12.373 -1.341486 15.73504 
1 1 1   12   15   45 o   34.437   7.4247   39.210   13.642   47.557   14.966  -1.7853   33.166   43.339   8.6754   25.536   12.052 17.80264 14.84948 
1 1 1   12   15   46 o   24.573   7.4466   12.352   12.754   16.324   13.987  -7.2427   31.068   25.403   9.6587   23.743   11.337 1.659998 14.89320 
1 1 1   12   16    0 f  125.058   2.2589  323.288   16.453  323.288   16.453  323.288   16.453  125.058   3.1946  125.058   3.1946 0.000000 0.000000 
1 1 1   12   16    1 o  140.935   2.1452  409.842   12.374  410.566   18.701  409.278   16.503  141.039   3.2148  140.831   2.8412 0.2081757 4.290374 
1 1 1   12   16    2 o  166.271   2.1929  570.192   14.896  573.351   22.714  567.809   19.731  166.665   3.3043  165.876   2.8840 0.7896729 4.385877 
1 1 1   12   16    3 o  147.807   2.3081  450.968   14.070  454.453   19.840  447.442   19.956  148.383   3.2418  147.232   3.2862 1.150818 4.616112 
1 1 1   12   16    4 o  199.981   2.6591  832.507   21.053  801.167   34.740  850.698   26.468  196.946   4.2768  203.016   3.1610 -6.069962 5.318112 
1 1 1   12   16    5 o  163.675   2.5210  556.509   16.105  542.438   27.500  563.855   19.870  162.059   4.1142  165.291   2.9146 -3.231689 5.041987 
1 1 1   12   16    6 o  212.491   2.6286  936.503   21.120  922.065   38.382  942.773   25.294  211.254   4.4052  213.728   2.8694 -2.474747 5.257277 
1 1 1   12   16    7 o  242.605   3.5753  1227.48   27.355  1200.70   64.473  1233.35   30.210  240.770   6.4925  244.441   2.9964 -3.670959 7.150594 
1 1 1   12   16    8 o  305.264   3.9945  1952.30   38.597  1891.06   90.298  1965.99   42.694  301.955   7.2505  308.572   3.3546 -6.616821 7.988958 
1 1 1   12   16    9 o  244.312   2.8628  1236.61   27.172  1222.69   47.005  1243.60   33.299  243.202   4.6861  245.422   3.2897 -2.220520 5.725509 
1 1 1   12   16   10 o  378.648   3.5308  2981.93   50.583  2921.34   91.692  3008.44   60.646  375.659   5.9179  381.637   3.8529 -5.978210 7.061621 
1 1 1   12   16   11 o  380.840   3.1194  2988.33   47.232  3031.35   78.228  2963.66   59.251  382.885   4.9537  378.796   3.7925 4.089111 6.238746 
1 1 1   12   16   12 o  242.212   2.5268  1215.89   25.094  1166.85   37.132  1257.12   34.045  237.679   3.7878  246.745   3.3453 -9.065231 5.053597 
1 1 1   12   16   13 o   79.655   2.5109  130.610   7.9932  132.802   13.080  129.303   10.098   80.172   3.9557   79.138   3.0938 1.033867 5.021880 
1 1 1   12   16   14 o   92.540   3.0437  177.159   11.601  179.732   16.052  174.348   16.783   93.250   4.1737   91.829   4.4313 1.420555 6.087394 
1 1 1   12   16   15 o  103.963   3.0355  223.209   12.941  192.129   17.918  257.097   18.710   96.393   4.5070  111.534   4.0673 -15.14064 6.070917 
1 1 1   12   16   16 o   99.740   2.6448  203.391   10.818  185.427   14.393  226.713   16.400   94.735   3.6837  104.745   3.7961 -10.01078 5.289634 
1 1 1   12   16   17 o  194.493   2.7225  781.859   21.770  782.329   29.635  781.307   32.086  194.574   3.6927  194.412   4.0016 0.1615143 5.445067 
1 1 1   12   16   18 o  260.517   3.3265  1396.11   34.966  1443.35   55.968  1365.86   44.780  264.026   5.1396  257.008   4.2245 7.018707 6.652934 
1 1 1   12   16   19 o   87.763   3.6758  159.985   13.266  149.533   19.047  169.835   18.489   84.954   5.4359   90.573   4.9494 -5.619835 7.351518 
1 1 1   12   16   20 o  127.446   3.7059  338.536   16.917  340.682   19.599  332.262   33.505  128.387   3.7012  126.506   6.4214 1.880844 7.411706 
1 1 1   12   16   21 o  144.057   2.9470  434.545   16.211  443.692   19.641  414.999   28.711  146.548   3.2495  141.566   4.9172 4.982346 5.893933 
1 1 1   12   16   22 f   92.944   3.2203  171.901   11.829  156.392   14.499  202.780   20.458   86.954   4.0427   98.934   5.0137 -11.98030 6.440557 
1 1 1   12   16   23 o   53.922   4.8804   60.769   10.132   61.243   12.325   59.779   17.796   54.338   5.4993   53.506   8.0642 0.8314133 9.760804 
1 1 1   12   16   24 o  166.553   3.3767  578.031   23.058  537.994   33.738  613.119   31.585  161.058   5.0790  172.049   4.4510 -10.99120 6.753316 
1 1 1   12   16   25 o  138.979   3.2781  400.101   18.742  395.532   25.533  405.438   27.597  138.144   4.4813  139.814   4.7857 -1.669952 6.556278 
1 1 1   12   16   26 o  110.338   3.5311  246.940   14.685  238.699   17.384  267.469   27.437  107.349   3.9264  113.326   5.8701 -5.977264 7.062212 
1 1 1   12   16   27 o  111.858   3.8176  259.677   17.557  232.143   24.204  290.253   25.506  105.587   5.5579  118.129   5.2350 -12.54218 7.635151 
1 1 1   12   16   28 o   68.544   4.4905   92.481   11.930   82.216   14.272  116.284   21.734   62.754   5.5143   74.335   7.0889 -11.58118 8.981028 
1 1 1   12   16   29 o   55.746   7.5628   86.157   17.688   12.491   28.962  129.985   22.339   32.970   13.461   78.521   6.8977 -45.55090 15.12558 
1 1 1   12   16   30 o  143.166   4.0784  430.952   24.058  416.781   34.399  444.520   33.659  140.788   5.9240  145.544   5.6072 -4.755493 8.156813 
1 1 1   12   16   31 o   36.182   7.5085   34.050   11.931   40.478   12.589 -22.6283   37.382   43.678   6.9883   28.686   13.292 14.99163 15.01697 
1 1 1   12   16   32 o   36.982   7.3521   31.399   11.099   32.333   13.179   29.123   20.582   37.908   8.6238   36.056   11.910 1.851624 14.70412 
1 1 1   12   16   33 o   33.282   6.8922   27.415   11.543   38.356   13.628  -0.3731   21.719   41.345   8.2804   25.219   11.020 16.12552 13.78448 
1 1 1   12   16   34 o   56.715   10.569   60.625   13.175   58.052   13.514  109.866   59.124   52.183   6.2791   61.248   20.183 -9.064320 21.13723 
1 1 1   12   16   35 o   50.523   7.5635   58.796   18.606   4.5579   25.871  116.909   26.779   28.348   12.209   72.697   8.9314 -44.34943 15.12709 
1 1 1   12   16   36 o   29.398   7.5404   17.691   10.643   18.180   12.099   16.021   22.381   28.508   9.1106   30.289   12.018 -1.781025 15.08084 
1 1 1   12   16   37 o   63.587   6.8437  100.528   15.829  121.805   20.281   67.371   25.318   75.011   6.5555   52.164   12.015 22.84668 13.68733 
1 1 1   12   16   38 o   60.785   5.5109   77.495   12.739   70.789   15.066   94.314   23.860   57.136   6.3932   64.434   8.9781 -7.297787 11.02176 
1 1 1   12   16   39 o   16.896   5.7247 -13.6476   10.160  -8.5742   11.590 -30.4829   21.113   15.728   7.3262   18.064   8.7987 -2.335514 11.44942 
1 1 1   12   16   40 o   54.804   8.6108  106.650   14.625  113.619   15.273   29.761   50.734   72.701   5.0936   36.906   16.451 35.79525 17.22153 
1 1 1   12   16   41 o   25.303   7.2763   12.157   11.282   16.906   12.188 -16.2678   29.820   26.773   9.1681   23.833   11.301 2.939371 14.55255 
1 1 1   12   16   42 o   25.178   7.3330   11.638   10.850   13.764   11.918   1.3402   26.228   24.808   9.0126   25.548   11.570 -0.7397175 14.66603 
1 1 1   12   16   43 o   29.484   9.0495   10.370   20.311   43.359   33.602  -8.6213   25.495   36.167   14.597   22.802   10.700 13.36466 18.09893 
1 1 1   12   16   44 o   50.066   8.6531   65.279   15.189   58.567   17.059   90.956   33.366   48.284   8.8936   51.848   14.846 -3.563343 17.30625 
1 1 1   12   16   45 o   24.892   7.5622   12.434   13.339   16.620   14.780  -5.9477   30.974   25.727   9.8935   24.057   11.440 1.669178 15.12445 
1 1 1   12   17    0 o  388.755   3.0212  3120.75   68.489  3120.75   68.489  3120.75   68.489  388.755   4.2727  388.755   4.2727 0.000000 0.000000 
1 1 1   12   17    1 o  186.127   2.2368  714.762   17.015  718.242   25.895  712.118   22.572  186.513   3.3663  185.742   2.9464 0.7709808 4.473607 
1 1 1   12   17    2 o  192.988   2.2630  769.241   17.858  766.313   27.063  771.499   23.766  192.649   3.4060  193.328   2.9806 -0.6786957 4.526053 
1 1 1   12   17    3 o  180.817   2.5761  674.016   18.298  679.109   31.087  671.316   22.634  181.300   4.1574  180.334   3.0432 0.9653778 5.152176 
1 1 1   12   17    4 f  152.870   2.5253  475.946   15.147  503.936   26.101  461.734   18.598  156.182   4.0520  149.559   3.0151 6.622742 5.050680 
1 1 1   12   17    5 o  117.983   2.3978  280.867   10.688  303.711   19.893  271.598   12.672  121.251   3.9779  114.716   2.6783 6.534752 4.795512 
1 1 1   12   17    6 o   73.687   2.7503  109.659   7.6151  118.214   14.298  106.271   8.9975   75.625   4.5839   71.750   3.0405 3.875641 5.500566 
1 1 1   12   17    7 o  117.302   3.2345  292.296   11.974  272.207   27.844  296.854   13.263  114.673   5.8872  119.932   2.6814 -5.258492 6.469086 
1 1 1   12   17    8 o  188.444   2.5590  733.459   18.049  733.150   33.508  733.585   21.422  188.360   4.3132  188.529   2.7549 -0.1690369 5.117913 
1 1 1   12   17    9 o   51.695   3.7384   59.201   6.9001   47.239   12.956   63.937   8.1524   47.748   6.5790   55.643   3.5523 -7.895130 7.476738 
1 1 1   12   17   10 f  168.492   2.5325  584.099   16.015  591.649   29.691  581.000   19.018  169.206   4.2545  167.777   2.7484 1.429001 5.064972 
1 1 1   12   17   11 o   61.386   2.9084   81.889   6.8871   65.021   11.296   91.868   8.6887   56.069   4.8848   66.703   3.1582 -10.63428 5.816844 
1 1 1   12   17   12 o  132.704   2.1956  363.258   11.700  365.225   18.858  362.026   14.919  132.977   3.4383  132.431   2.7313 0.5458984 4.391154 
1 1 1   12   17   13 o  158.553   2.2055  514.223   13.965  538.238   23.045  500.286   17.556  161.427   3.4613  155.678   2.7342 5.749130 4.410949 
1 1 1   12   17   14 f  185.057   2.2899  706.350   17.467  738.778   25.205  676.389   24.228  189.139   3.2311  180.975   3.2459 8.163528 4.579892 
1 1 1   12   17   15 o  151.694   2.5942  475.533   16.219  473.851   23.360  477.098   22.536  151.429   3.7402  151.959   3.5958 -0.5297852 5.188346 
1 1 1   12   17   16 o   52.393   4.3014   56.229   9.2337   48.721   12.344   65.766   13.913   48.467   6.1752   56.320   5.9894 -7.852695 8.602724 
1 1 1   12   17   17 o  123.508   2.4250  315.145   12.353  311.491   17.443  318.822   17.495  122.788   3.4443  124.227   3.4146 -1.438461 4.850007 
1 1 1   12   17   18 f  104.470   3.0052  227.290   12.742  235.303   16.771  216.345   19.599  106.693   3.8111  102.247   4.6475 4.446564 6.010315 
1 1 1   12   17   19 o  148.680   2.5791  459.742   15.649  434.740   23.542  479.535   20.947  145.008   3.9363  152.351   3.3335 -7.342575 5.158186 
1 1 1   12   17   20 o  124.940   3.0203  326.212   14.449  331.965   17.531  314.027   25.515  126.751   3.3535  123.129   5.0242 3.622261 6.040539 
1 1 1   12   17   21 o  169.430   3.3822  593.129   19.804  592.001   22.522  596.976   41.587  169.269   3.2260  169.590   5.9455 -0.3213501 6.764340 
1 1 1   12   17   22 o   83.536   3.9181  149.482   11.999  155.611   14.214  134.289   22.379   86.733   3.9736   80.339   6.7539 6.394211 7.836107 
1 1 1   12   17   23 o  146.925   3.0607  446.937   18.516  445.305   25.434  448.778   27.007  146.657   4.2048  147.193   4.4486 -0.5362549 6.121329 
1 1 1   12   17   24 o  103.838   3.6741  223.337   15.680  198.327   21.646  250.950   22.744   97.712   5.3710  109.965   5.0148 -12.25246 7.348173 
1 1 1   12   17   25 o   26.841   6.4366   1.5403   9.4213 -10.7882   11.144   32.419   17.637   15.240   7.1271   38.442   10.720 -23.20160 12.87316 
1 1 1   12   17   26 o   57.088   6.3033   70.344   14.327   65.166   21.403   74.547   19.285   54.622   9.8632   59.554   7.8514 -4.931633 12.60663 
1 1 1   12   17   27 o   47.303   5.9247   46.962   10.516   44.791   12.648   51.825   18.927   46.198   6.6380   48.407   9.8157 -2.208759 11.84948 
1 1 1   12   17   28 o   80.408   3.9915  128.308   12.651  113.360   15.410  159.210   22.156   73.708   5.0690   87.108   6.1670 -13.39976 7.982934 
1 1 1   12   17   29 o   41.766   6.6010   46.235   11.511   60.912   13.855   13.520   20.685   53.779   6.2465   29.754   11.631 24.02482 13.20205 
1 1 1   12   17   30 o   23.697   6.7550   7.2315   9.2975   9.3487   10.618   0.2695   19.253   23.028   8.4851   24.366   10.513 -1.337578 13.51005 
1 1 1   12   17   31 o   86.726   5.2728  136.439   14.118  125.526   15.258  201.421   37.232   77.428   4.7779   96.023   9.4012 -18.59476 10.54560 
1 1 1   12   17   32 o   40.818   8.8872   33.688   11.712   32.335   12.364   45.511   36.560   37.942   8.1444   43.694   15.799 -5.752537 17.77438 
1 1 1   12   17   33 o   81.450   4.2255  138.216   13.161  133.734   15.778  148.465   23.861   79.751   4.7969   83.149   6.9577 -3.398949 8.451048 
1 1 1   12   17   34 o   55.061   6.9605   73.304   12.882   77.816   14.870   59.741   25.783   60.502   5.9592   49.619   12.581 10.88304 13.92092 
1 1 1   12   17   35 o   46.339   8.1721   52.428   15.628   57.744   21.512   46.489   22.741   49.221   10.886   43.457   12.192 5.763626 16.34430 
1 1 1   12   17   36 o   72.062   4.6778  105.023   12.788   94.820   15.057  131.440   24.228   66.714   5.4721   77.411   7.5885 -10.69740 9.355684 
1 1 1   12   17   37 o   35.553   5.7722   35.942   12.009   57.318   13.641 -37.7377   25.325   51.447   6.4285   19.659   9.5888 31.78820 11.54431 
1 1 1   12   17   38 o   78.821   5.4724  138.014   17.511  108.485   23.771  173.054   25.895   69.172   8.3322   88.470   7.0965 -19.29855 10.94470 
1 1 1   12   17   39 o   29.468   7.1705   21.116   11.505   28.535   13.446   0.8437   22.227   34.319   9.2775   24.616   10.936 9.703720 14.34099 
1 1 1   12   17   40 o   22.076   7.4282  -5.5402   11.323  -5.7774   11.995  -3.5991   34.308   16.674   7.6548   27.478   12.733 -10.80325 14.85643 
1 1 1   12   17   41 o   26.557   7.7630   9.2954   11.445   5.1745   12.814   25.555   25.452   21.037   8.8050   32.077   12.788 -11.03999 15.52602 
1 1 1   12   17   42 o   26.760   7.4638   15.920   11.036   17.390   12.310   9.9005   24.906   26.751   9.2113   26.769   11.747 -0.1849365E-01 14.92757 
1 1 1   12   17   43 o   35.401   9.0386   23.102   22.324   80.511   32.020 -31.1995   31.141   49.194   14.672   21.609   10.560 27.58477 18.07714 
1 1 1   12   17   44 o   37.290   8.5499   41.588   13.868   40.463   15.607   45.808   30.231   38.799   9.7615   35.782   14.040 3.017529 17.09988 
1 1 1   12   17   45 o   23.051   7.3357   6.5789   12.390   8.0975   13.577  -0.9821   30.295   21.630   9.0591   24.473   11.540 -2.843840 14.67137 
1 1 1   12   18    0 o  166.747   2.3829  574.449   23.155  574.449   23.155  574.449   23.155  166.747   3.3700  166.747   3.3700 0.000000 0.000000 
1 1 1   12   18    1 o  211.653   2.3304  926.355   20.198  912.455   30.320  937.445   27.081  210.208   3.4971  213.098   3.0812 -2.890869 4.660895 
1 1 1   12   18    2 o   70.419   2.6501   99.495   7.1482  110.246   13.046   94.882   8.5452   73.041   4.3305   67.796   3.0560 5.245796 5.300197 
1 1 1   12   18    3 o   84.748   2.6878  149.740   9.0473  143.038   14.787  153.750   11.438   83.199   4.3092   86.297   3.2136 -3.097801 5.375565 
1 1 1   12   18    4 o  102.718   2.5629  218.068   10.434  217.280   17.332  218.515   13.067  102.552   4.0977  102.884   3.0793 -0.3320694 5.125751 
1 1 1   12   18    5 o  253.170   2.7989  1319.76   26.432  1334.14   49.490  1314.02   31.264  254.040   4.7233  252.301   3.0044 1.738937 5.597888 
1 1 1   12   18    6 o  148.822   3.1463  473.078   15.044  433.417   34.039  482.705   16.771  144.710   5.7032  152.933   2.6588 -8.222931 6.292505 
1 1 1   12   18    7 o  193.348   3.3085  780.128   20.214  761.562   47.500  784.233   22.337  191.773   6.0054  194.923   2.7784 -3.149887 6.616971 
1 1 1   12   18    8 o  120.755   2.4996  299.657   11.289  304.750   21.073  297.607   13.370  121.433   4.2076  120.077   2.6996 1.355682 4.999108 
1 1 1   12   18    9 o  144.003   2.5230  414.959   13.747  461.829   25.679  396.131   16.275  149.482   4.1650  138.524   2.8486 10.95816 5.045984 
1 1 1   12   18   10 o   96.179   2.7024  195.621   9.5836  181.016   17.870  201.517   11.354   93.557   4.6312   98.802   2.7864 -5.244957 5.404778 
1 1 1   12   18   11 o   51.236   3.0284   52.141   6.1256   61.527   10.623   47.466   7.4976   54.541   4.7223   47.930   3.7927 6.610874 6.056788 
1 1 1   12   18   12 o  130.920   2.2048  352.277   11.579  360.993   18.802  346.953   14.696  132.199   3.4483  129.641   2.7485 2.557892 4.409630 
1 1 1   12   18   13 o  121.334   2.2093  301.649   10.726  313.711   17.589  294.508   13.533  123.230   3.4606  119.438   2.7473 3.792709 4.418540 
1 1 1   12   18   14 f  176.991   2.2830  647.018   16.666  644.383   23.548  649.663   23.590  176.629   3.2324  177.352   3.2250 -0.7227783 4.566035 
1 1 1   12   18   15 o   59.477   3.2664   73.426   7.9745   65.183   11.281   81.659   11.274   56.119   4.8737   62.836   4.3503 -6.716755 6.532887 
1 1 1   12   18   16 o   60.136   3.8676   74.402   9.5496   65.466   12.956   85.034   14.131   56.203   5.5889   64.068   5.3477 -7.864952 7.735286 
1 1 1   12   18   17 o  119.585   2.4178  294.704   11.910  313.150   17.362  278.310   16.368  123.110   3.4192  116.060   3.4193 7.050133 4.835609 
1 1 1   12   18   18 o  214.423   2.8225  952.395   24.913  989.016   34.626  913.090   35.872  218.725   3.8383  210.120   4.1393 8.605362 5.644988 
1 1 1   12   18   19 o  190.078   2.8207  751.286   21.316  731.599   34.941  762.955   26.901  188.010   4.5060  192.147   3.3945 -4.137497 5.641484 
1 1 1   12   18   20 o   71.233   3.1064  104.926   9.1223  100.828   12.706  109.285   13.105   69.798   4.4136   72.668   4.3726 -2.870499 6.212861 
1 1 1   12   18   21 o  137.392   3.6524  383.756   16.847  378.389   18.891  404.609   37.238  135.301   3.3853  139.483   6.4730 -4.182587 7.304770 
1 1 1   12   18   22 o  130.995   2.8924  355.257   14.976  355.324   18.684  355.136   25.048  131.084   3.4558  130.906   4.6392 0.1782074 5.784893 
1 1 1   12   18   23 o  128.791   3.2553  343.088   17.269  327.676   23.686  360.576   25.231  125.717   4.5680  131.866   4.6391 -6.149338 6.510586 
1 1 1   12   18   24 o   37.805   6.4627   28.488   9.4488   22.983   11.342   40.976   17.083   32.452   8.4061   43.157   9.8185 -10.70480 12.92536 
1 1 1   12   18   25 o   63.807   4.6130   79.794   11.090   72.881   12.997   98.296   21.265   59.184   5.3246   68.430   7.5344 -9.245594 9.225990 
1 1 1   12   18   26 o   38.641   7.4017   33.733   13.219   13.716   19.814   49.789   17.746   29.739   11.450   47.542   9.3831 -17.80350 14.80350 
1 1 1   12   18   27 o  105.674   3.3387  227.773   13.905  216.887   17.106  248.977   23.874  102.169   4.0593  109.178   5.3018 -7.009720 6.677353 
1 1 1   12   18   28 o   64.178   8.1392  101.132   15.463  105.994   17.069   78.873   36.519   71.044   5.8253   57.312   15.200 13.73170 16.27846 
1 1 1   12   18   29 o   93.616   4.0058  185.788   14.456  188.871   17.656  179.517   25.180   95.129   4.4999   92.104   6.6284 3.025230 8.011517 
1 1 1   12   18   30 o   30.724   7.2435   19.663   10.020   19.574   11.757   19.899   19.157   29.795   8.8913   31.653   11.438 -1.858761 14.48700 
1 1 1   12   18   31 o   97.007   4.5744  202.237   18.132  176.545   26.140  226.063   25.172   90.759   6.9830  103.256   5.9107 -12.49748 9.148703 
1 1 1   12   18   32 o   33.094   9.1747   0.7063   17.696 -16.4017   20.446   51.785   35.329   20.622   9.6470   45.566   15.609 -24.94417 18.34936 
1 1 1   12   18   33 f   34.194   7.3005   22.676   9.7948   18.415   11.138   37.219   20.577   28.739   8.6718   39.650   11.747 -10.91186 14.60105 
1 1 1   12   18   34 o   45.642   6.7667   56.030   11.388   66.226   13.394   29.422   21.637   55.717   5.8284   35.567   12.214 20.14967 13.53342 
1 1 1   12   18   35 o   46.624   6.8599   50.717   11.548   51.478   13.465   48.599   22.454   48.812   6.6884   44.435   11.979 4.376869 13.71989 
1 1 1   12   18   36 o   29.777   7.6792   19.062   11.671   20.399   13.754   15.625   22.058   29.853   9.7298   29.701   11.883 0.1519337 15.35842 
1 1 1   12   18   37 o   19.783   6.4407  -5.3636   9.6086  -6.1012   10.736  -2.3932   21.544   15.789   7.2459   23.776   10.650 -7.987633 12.88149 
1 1 1   12   18   38 o   31.272   7.6444   16.747   10.734   9.5545   12.224   40.980   22.436   23.107   8.9661   39.438   12.384 -16.33117 15.28886 
1 1 1   12   18   39 o   29.374   7.4983   19.897   10.858   19.840   12.665   20.054   21.095   28.775   9.3346   29.973   11.737 -1.197718 14.99665 
1 1 1   12   18   40 o   49.400   9.3665   57.702   12.781   54.964   13.329   88.988   45.059   49.660   6.5074   49.140   17.566 0.5203934 18.73302 
1 1 1   12   18   41 o   37.809   8.0383   33.904   11.635   29.575   13.056   50.596   25.639   34.394   9.0730   41.224   13.272 -6.830494 16.07653 
1 1 1   12   18   42 o   23.854   6.7537   10.716   10.996   18.377   12.380 -17.8953   23.926   27.148   9.2402   20.560   9.8522 6.587914 13.50734 
1 1 1   12   18   43 o   39.147   10.319   55.788   22.769   46.306   33.249   64.161   31.244   35.952   14.517   42.342   14.669 -6.389652 20.63784 
1 1 1   12   18   44 o   25.165   7.8707   2.7890   12.660  -5.1029   14.042   37.058   29.261   17.606   8.1538   32.724   13.465 -15.11770 15.74141 
1 1 1   12   19    0 o  221.494   2.2136  1012.91   28.586  1012.91   28.586  1012.91   28.586  221.494   3.1305  221.494   3.1305 0.000000 0.000000 
1 1 1   12   19    1 o  217.231   2.3012  974.383   20.039  974.340   32.403  974.410   25.501  217.195   3.6172  217.267   2.8457 -0.7208252E-01 4.602441 
1 1 1   12   19    2 o  260.666   2.8115  1408.82   27.634  1391.60   50.500  1416.19   33.016  259.423   4.7197  261.908   3.0564 -2.485291 5.622945 
1 1 1   12   19    3 o  183.356   2.5914  694.859   18.754  693.026   31.455  695.870   23.361  183.124   4.1646  183.587   3.0852 -0.4632721 5.182899 
1 1 1   12   19    4 f  216.204   2.6319  954.473   21.171  991.537   40.072  940.121   24.935  219.003   4.4363  213.405   2.8330 5.597717 5.263738 
1 1 1   12   19    5 o  197.388   2.5521  807.960   19.006  797.048   34.690  812.640   22.719  196.364   4.2833  198.411   2.7762 -2.046829 5.104284 
1 1 1   12   19    6 o  112.329   3.2507  279.256   11.585  232.565   25.954  290.873   12.946  105.950   5.9394  118.709   2.6442 -12.75954 6.501428 
1 1 1   12   19    7 o  308.199   3.1230  1957.55   35.748  1978.47   67.399  1949.37   42.168  309.170   5.2856  307.229   3.3278 1.941071 6.245925 
1 1 1   12   19    8 o  311.223   3.2374  1997.60   38.877  2018.31   68.518  1987.76   47.213  312.259   5.3202  310.187   3.6904 2.071808 6.474795 
1 1 1   12   19    9 o  167.286   2.5696  574.735   16.469  587.303   29.501  569.045   19.850  168.553   4.2436  166.020   2.8989 2.533295 5.139250 
1 1 1   12   19   10 o  135.704   2.6108  354.014   13.625  454.702   25.313  312.944   16.167  148.309   4.1382  123.099   3.1842 25.21085 5.221524 
1 1 1   12   19   11 f   69.861   3.0470   98.635   7.6649  105.642   15.390   96.324   8.8393   71.429   5.2239   68.294   3.1381 3.134926 6.094000 
1 1 1   12   19   12 o   98.236   2.3129  197.776   9.0683  205.420   14.962  193.338   11.401   99.706   3.6383   96.766   2.8566 2.939568 4.625755 
1 1 1   12   19   13 o  168.977   2.8234  590.790   19.212  592.711   24.659  587.823   30.644  169.371   3.5300  168.582   4.4073 0.7894287 5.646727 
1 1 1   12   19   14 o  143.794   2.4245  424.492   14.262  407.336   18.837  447.536   21.831  140.425   3.2523  147.164   3.5967 -6.738800 4.849088 
1 1 1   12   19   15 o  152.537   2.2817  480.551   14.354  488.461   20.460  472.885   20.142  153.773   3.2260  151.301   3.2277 2.471786 4.563400 
1 1 1   12   19   16 o   72.694   3.4847  109.023   10.427  103.374   14.203  115.627   15.355   70.662   4.8733   74.726   4.9823 -4.063988 6.969372 
1 1 1   12   19   17 o  121.270   3.0828  303.420   15.391  330.384   22.389  279.263   21.192  126.370   4.2956  116.171   4.4228 10.19862 6.165519 
1 1 1   12   19   18 o   55.825   3.6469   63.473   8.3030   78.597   12.622   51.936   11.024   61.596   4.9682   50.054   5.3400 11.54269 7.293782 
1 1 1   12   19   19 o  132.523   2.8381  363.034   15.034  364.289   24.510  362.277   19.035  132.656   4.4796  132.389   3.4861 0.2674866 5.676271 
1 1 1   12   19   20 o  153.116   3.2806  478.479   20.521  435.963   26.857  538.116   31.809  145.087   4.4882  161.145   4.7859 -16.05727 6.561110 
1 1 1   12   19   21 o  131.695   2.8604  359.417   14.909  360.365   18.642  357.735   24.834  132.008   3.4240  131.381   4.5830 0.6267090 5.720776 
1 1 1   12   19   22 o   58.367   7.3877   76.535   11.602   77.611   12.457   69.496   31.858   61.149   4.9392   55.584   13.925 5.564804 14.77549 
1 1 1   12   19   23 o  118.663   3.3666  292.439   16.462  295.807   22.883  288.826   23.700  119.390   4.6471  117.936   4.8723 1.453918 6.733154 
1 1 1   12   19   24 o   46.294   5.9438   51.341   9.8989   59.809   12.029   33.579   17.422   53.596   5.4418   38.992   10.569 14.60418 11.88758 
1 1 1   12   19   25 o   62.200   8.7590   46.459   11.933   40.554   12.263  151.666   51.762   43.934   6.7676   80.465   16.158 -36.53070 17.51808 
1 1 1   12   19   26 o   82.666   4.9528  150.222   16.138  114.287   24.659  177.143   21.343   73.322   8.1541   92.009   5.6242 -18.68699 9.905662 
1 1 1   12   19   27 o   31.803   6.9598   18.473   9.5855   12.276   11.408   33.350   17.678   25.183   8.8562   38.423   10.739 -13.23932 13.91952 
1 1 1   12   19   28 o   49.896   5.9114   50.942   11.562   41.304   14.349   68.783   19.523   43.207   8.3545   56.585   8.3653 -13.37880 11.82272 
1 1 1   12   19   29 o   24.893   7.1748  -1.8548   13.773 -30.9775   21.265   19.190   18.077   18.763   9.0662   31.023   11.123 -12.25984 14.34951 
1 1 1   12   19   30 o   24.297   6.8829   7.3438   9.2670   6.1818   10.662   10.933   18.738   21.131   8.3231   27.462   10.965 -6.330303 13.76577 
1 1 1   12   19   31 o   80.454   4.1863  142.707   12.690  152.029   15.446  123.351   22.257   85.170   4.3971   75.738   7.1251 9.432617 8.372667 
1 1 1   12   19   32 o   78.943   5.9683  130.968   14.000  128.612   15.194  144.218   36.033   78.238   4.7086   79.649   10.969 -1.411545 11.93667 
1 1 1   12   19   33 f   66.958   5.2867   93.034   12.313   89.218   13.952  106.477   26.185   64.905   5.2120   69.012   9.1995 -4.107826 10.57335 
1 1 1   12   19   34 o   50.010   6.6327   64.211   11.484   72.521   13.511   42.585   21.797   58.346   5.6145   41.673   12.019 16.67352 13.26544 
1 1 1   12   19   35 o   80.601   5.2097  141.258   16.929  105.204   22.858  185.061   25.195   68.832   8.0516   92.369   6.6134 -23.53712 10.41946 
1 1 1   12   19   36 o   61.965   7.9357   94.745   19.366   81.301   29.266  105.218   25.830   56.186   12.901   67.744   9.2446 -11.55841 15.87149 
1 1 1   12   19   37 o   72.581   4.8008  116.818   12.946  117.892   15.391  114.221   23.935   74.215   5.0282   70.947   8.1798 3.267967 9.601701 
1 1 1   12   19   38 o   54.646   6.5423   74.937   12.488   80.705   14.860   61.066   23.044   60.817   5.9241   48.475   11.667 12.34194 13.08456 
1 1 1   12   19   39 o   22.844   6.6199   7.3993   10.495   14.415   12.068 -14.3735   21.260   25.301   9.0860   20.387   9.6301 4.913776 13.23986 
1 1 1   12   19   40 o   18.718   6.0405  -5.2383   10.519   3.9960   11.713 -43.7272   23.914   19.881   8.3750   17.556   8.7068 2.324265 12.08092 
1 1 1   12   19   41 o   25.575   6.8716   14.508   11.501   23.416   12.844 -21.5444   25.839   30.247   9.3489   20.903   10.073 9.343973 13.74314 
1 1 1   12   19   42 o   21.815   6.6921   3.1032   12.069   13.095   13.633 -33.1082   25.952   24.356   9.4639   19.273   9.4643 5.083448 13.38426 
1 1 1   12   19   43 o   33.518   8.5980   26.716   13.138   18.066   14.805   58.773   28.500   26.474   9.9672   40.562   14.013 -14.08847 17.19608 
1 1 1   12   19   44 o   31.750   7.1154   31.978   13.822   45.900   15.778 -13.9422   28.656   41.397   9.4494   22.103   10.641 19.29394 14.23085 
1 1 1   12   20    0 o   33.353   4.7065   25.552   8.1271   25.552   8.1271   25.552   8.1271   33.353   6.6560   33.353   6.6560 0.000000 0.000000 
1 1 1   12   20    1 o  247.184   2.4122  1261.51   23.859  1263.79   38.777  1260.12   30.266  247.318   3.8015  247.050   2.9703 0.2683563 4.824307 
1 1 1   12   20    2 o  228.105   2.6627  1072.65   22.766  1080.71   42.242  1069.35   27.027  228.619   4.4799  227.591   2.8792 1.027924 5.325371 
1 1 1   12   20    3 o   85.375   2.6104  149.435   8.8724  154.941   14.724  146.295   11.118   86.582   4.1231   84.169   3.2025 2.412788 5.220747 
1 1 1   12   20    4 o  173.936   2.4659  621.244   16.099  633.782   29.895  616.122   19.106  175.107   4.1393  172.765   2.6813 2.342148 4.931842 
1 1 1   12   20    5 o   81.925   2.6152  133.362   8.0269  151.350   15.316  126.549   9.4250   85.559   4.3402   78.291   2.9188 7.268700 5.230329 
1 1 1   12   20    6 o  101.395   3.2335  215.285   10.417  208.486   24.256  216.822   11.535  100.306   5.8631  102.484   2.7290 -2.178055 6.467040 
1 1 1   12   20    7 o  184.508   2.5270  718.579   17.813  662.012   31.212  745.903   21.693  178.938   4.2292  190.078   2.7670 -11.14029 5.053961 
1 1 1   12   20    8 o  201.349   2.6779  821.106   20.481  880.615   37.686  796.164   24.398  206.344   4.4282  196.354   3.0127 9.990005 5.355806 
1 1 1   12   20    9 o  207.917   2.6298  894.966   20.552  889.399   37.823  897.298   24.481  207.368   4.4223  208.466   2.8473 -1.098312 5.259624 
1 1 1   12   20   10 o   87.886   2.8119  166.746   9.0483  143.963   16.730  176.165   10.757   83.403   4.8637   92.370   2.8236 -8.967110 5.623878 
1 1 1   12   20   11 o  161.619   2.6630  534.802   16.789  555.311   29.151  524.623   20.537  163.861   4.3133  159.378   3.1243 4.482971 5.325966 
1 1 1   12   20   12 o  201.383   2.2993  840.750   18.614  824.122   29.719  851.484   23.878  199.699   3.6082  203.066   2.8510 -3.367279 4.598571 
1 1 1   12   20   13 o  115.774   2.4463  277.159   11.647  274.129   17.087  279.789   15.918  115.173   3.5970  116.374   3.3164 -1.201294 4.892557 
1 1 1   12   20   14 o   90.277   2.6631  167.944   9.8966  160.490   13.489  176.634   14.565   88.117   3.7115   92.437   3.8202 -4.319389 5.326275 
1 1 1   12   20   15 o   61.422   3.1646   77.524   7.9883   86.473   11.861   70.094   10.807   64.644   4.4485   58.199   4.5022 6.445713 6.329218 
1 1 1   12   20   16 o  102.294   2.5674  216.088   10.821  202.568   15.063  230.503   15.554   98.988   3.6895  105.601   3.5711 -6.613266 5.134723 
1 1 1   12   20   17 o  154.842   2.5492  494.612   16.114  502.731   24.704  488.600   21.259  155.921   3.8415  153.764   3.3521 2.156723 5.098447 
1 1 1   12   20   18 o  178.393   3.2072  678.165   21.583  610.317   38.414  709.465   26.091  171.523   5.4301  185.262   3.4146 -13.73953 6.414444 
1 1 1   12   20   19 o  162.350   2.6313  545.181   17.616  530.368   24.770  560.341   25.058  160.115   3.7509  164.585   3.6914 -4.470367 5.262665 
1 1 1   12   20   20 o   96.618   2.7418  192.592   10.908  207.184   15.945  179.759   14.954  100.047   3.8642   93.188   3.8907 6.859039 5.483599 
1 1 1   12   20   21 o   90.256   4.9987  163.057   17.024  153.149   20.065  188.518   32.166   85.793   5.6706   94.719   8.2337 -8.926842 9.997453 
1 1 1   12   20   22 o   45.063   7.9030   43.421   11.053   43.573   11.857   42.418   30.544   45.698   6.2908   44.428   14.500 1.270466 15.80598 
1 1 1   12   20   23 o   36.025   6.5397   29.535   9.6699   33.158   12.083   23.080   16.127   39.033   7.7785   33.017   10.515 6.015862 13.07933 
1 1 1   12   20   24 o  183.594   3.3272  698.356   25.195  698.356   25.195   0.0000   0.0000  183.594   3.3272  ?   ?       ?      ? 
1 1 1   12   20   25 f   82.790   4.7752  148.333   15.660  128.083   24.887  161.607   20.149   77.701   7.7657   87.880   5.5592 -10.17861 9.550428 
1 1 1   12   20   26 o  118.158   4.2116  301.628   19.635  262.217   31.575  326.477   25.072  111.310   6.8776  125.005   4.8630 -13.69441 8.423206 
1 1 1   12   20   27 o   33.128   6.8816   23.817   9.5662   22.818   11.611   25.928   16.879   32.011   8.6077   34.244   10.739 -2.233833 13.76318 
1 1 1   12   20   28 o   75.191   4.0837  116.796   11.857  112.683   14.321  125.758   21.141   73.389   4.7311   76.993   6.6575 -3.603149 8.167407 
1 1 1   12   20   29 o   24.948   6.9003   8.9097   9.5421   7.2799   11.342   12.858   17.653   22.118   8.6217   27.778   10.776 -5.660393 13.80054 
1 1 1   12   20   30 o  114.685   3.8161  276.354   17.917  232.906   24.454  326.707   26.326  104.872   5.6537  124.498   5.1270 -19.62544 7.632165 
1 1 1   12   20   31 o   27.485   6.9058   15.426   9.3721   16.812   11.048   11.869   17.699   27.657   8.6910   27.313   10.734 0.3435555 13.81161 
1 1 1   12   20   32 o   22.750   6.2285   6.5755   9.5141   15.683   10.920 -22.1254   19.385   26.763   8.6661   18.737   8.9485 8.025965 12.45700 
1 1 1   12   20   33 o   34.844   7.9033   30.890   11.496   34.554   12.112  -2.3888   36.506   39.134   7.7781   30.553   13.760 8.580942 15.80654 
1 1 1   12   20   34 o   65.460   4.9218   90.407   12.018   86.508   14.128  100.612   22.859   63.698   5.3777   67.223   8.2447 -3.525070 9.843515 
1 1 1   12   20   35 o   34.428   7.3996   23.270   10.700   15.505   12.519   44.312   20.610   26.710   9.2839   42.146   11.525 -15.43635 14.79922 
1 1 1   12   20   36 o   45.000   7.3784   48.397   16.026   12.005   22.032   89.294   23.356   27.907   11.601   62.094   9.1197 -34.18629 14.75674 
1 1 1   12   20   37 o   23.703   6.8868   0.4245   9.8393  -6.9298   11.292   23.625   20.055   15.897   7.3444   31.509   11.652 -15.61213 13.77351 
1 1 1   12   20   38 o   51.752   6.3379   62.495   11.951   60.111   14.161   68.395   22.280   51.886   6.6173   51.619   10.811 0.2671471 12.67581 
1 1 1   12   20   39 o   32.306   7.7189   16.734   10.769   7.9453   12.045   51.736   24.038   21.873   8.7705   42.739   12.705 -20.86609 15.43783 
1 1 1   12   20   40 o   32.594   7.7444   17.915   11.078   7.9851   12.462   55.307   24.183   21.824   8.8609   43.363   12.704 -21.53937 15.48890 
1 1 1   12   20   41 f   25.966   8.2471   9.4573   12.252   9.6182   12.797   7.6861   42.455   22.544   9.0398   29.388   13.796 -6.844149 16.49416 
1 1 1   12   20   42 o   22.835   7.3416   1.9721   12.773  -0.8650   14.548   11.511   26.677   19.192   8.6610   26.479   11.857 -7.287792 14.68329 
1 1 1   12   20   43 o   33.904   8.2492   35.949   13.624   36.922   15.605   32.829   27.938   36.338   10.066   31.470   13.072 4.867785 16.49844 
1 1 1   12   21    0 o  242.388   2.3558  1213.28   33.292  1213.28   33.292  1213.28   33.292  242.388   3.3316  242.388   3.3316 0.000000 0.000000 
1 1 1   12   21    1 o  290.454   2.5644  1742.69   30.715  1765.52   43.980  1720.96   42.913  292.307   3.6480  288.601   3.6052 3.705597 5.128851 
1 1 1   12   21    2 o  186.884   2.2108  716.344   16.455  740.149   27.261  702.701   20.639  189.276   3.4921  184.492   2.7123 4.783737 4.421697 
1 1 1   12   21    3 o  126.520   2.7467  331.197   14.313  311.807   20.274  350.463   20.209  122.815   4.0025  130.224   3.7626 -7.408867 5.493379 
1 1 1   12   21    4 o  216.929   2.6864  980.415   22.859  946.710   38.530  998.723   28.397  213.953   4.3663  219.904   3.1309 -5.951859 5.372808 
1 1 1   12   21    5 o  100.920   3.1435  202.667   10.038  223.315   24.254  198.399   11.027  103.811   5.6646   98.030   2.7273 5.780891 6.286950 
1 1 1   12   21    6 f  171.753   3.2266  593.070   17.084  636.470   42.394  584.656   18.667  175.223   5.8661  168.284   2.6894 6.938248 6.453250 
1 1 1   12   21    7 o   94.580   2.6124  187.775   9.2848  177.705   16.877  192.146   11.119   92.690   4.4146   96.469   2.7945 -3.778824 5.224727 
1 1 1   12   21    8 o  117.652   2.6847  296.469   12.420  246.777   19.880  328.285   15.907  109.226   4.4128  126.078   3.0591 -16.85275 5.369466 
1 1 1   12   21    9 o   97.724   2.6423  201.666   9.6225  187.258   17.648  207.762   11.479   95.137   4.4976  100.311   2.7745 -5.173592 5.284571 
1 1 1   12   21   10 o  157.782   2.5489  522.716   15.203  493.633   27.336  535.741   18.294  154.484   4.2902  161.080   2.7535 -6.595688 5.097863 
1 1 1   12   21   11 o  184.462   2.6128  676.942   17.520  759.255   35.030  649.485   20.232  191.570   4.4336  177.355   2.7658 14.21420 5.225527 
1 1 1   12   21   12 o  103.882   2.3359  226.325   9.6567  209.409   15.564  236.912   12.313  100.651   3.7492  107.113   2.7872 -6.462021 4.671706 
1 1 1   12   21   13 o  273.077   3.1977  1518.51   34.765  1452.80   43.365  1636.71   58.161  265.054   3.9668  281.099   5.0166 -16.04446 6.395455 
1 1 1   12   21   14 o   71.887   3.0116  106.917   8.9131   98.573   12.478  115.610   12.737   69.016   4.3834   74.757   4.1308 -5.741196 6.023107 
1 1 1   12   21   15 o   53.614   3.9749   60.391   8.6312   64.490   11.428   54.947   13.169   55.793   4.9661   51.434   6.2078 4.359432 7.949798 
1 1 1   12   21   16 o  118.891   2.4496  292.146   11.993  270.771   16.788  314.426   17.140  114.442   3.5567  123.339   3.3693 -8.896935 4.899188 
1 1 1   12   21   17 o  143.917   2.4310  428.239   14.430  430.683   20.437  425.810   20.376  144.327   3.4333  143.507   3.4426 0.8197327 4.861984 
1 1 1   12   21   18 o   81.178   3.8223  136.720   12.736  138.209   19.009  135.507   17.157   81.553   5.6513   80.804   5.1481 0.7487717 7.644595 
1 1 1   12   21   19 o  117.602   2.9607  289.029   14.068  273.331   21.907  300.045   18.351  114.800   4.6267  120.403   3.6954 -5.602715 5.921365 
1 1 1   12   21   20 o   76.159   3.1906  121.357   9.8974  112.733   14.911  128.150   13.233   73.679   4.9067   78.640   4.0799 -4.960999 6.381295 
1 1 1   12   21   21 o  109.930   2.6229  250.735   11.865  232.195   16.835  269.031   16.724  105.866   3.8555  113.993   3.5571 -8.127434 5.245754 
1 1 1   12   21   22 o  123.457   4.4118  323.710   20.939  332.684   25.583  305.498   36.444  126.433   4.9059  120.481   7.3340 5.951904 8.823611 
1 1 1   12   21   23 o   26.967   8.0449   1.5451   9.8113  -0.6129   10.361   20.284   30.530   17.921   7.7223   36.013   14.116 -18.09177 16.08985 
1 1 1   12   21   24 o  128.915   3.5299  345.165   18.461  337.279   23.911  356.801   29.046  127.233   4.5566  130.596   5.3924 -3.363701 7.059795 
1 1 1   12   21   25 o   57.656   4.4952   68.204   10.382   62.546   12.994   78.194   17.267   54.554   5.7748   60.757   6.8903 -6.203140 8.990299 
1 1 1   12   21   26 o   30.791   6.1166   22.367   9.2511   32.665   11.382   2.3238   15.879   38.579   7.4229   23.003   9.7239 15.57607 12.23330 
1 1 1   12   21   27 o   93.079   4.8429  191.195   17.464  161.504   28.857  208.355   21.938   86.601   8.0791   99.557   5.3426 -12.95634 9.685876 
1 1 1   12   21   28 o   24.390   6.7247   8.4091   8.9523   6.6678   10.559   12.860   16.882   21.323   8.3169   27.457   10.570 -6.133608 13.44940 
1 1 1   12   21   29 o   52.276   5.6885   65.097   10.459   72.758   12.651   48.557   18.590   58.726   5.2234   45.827   10.107 12.89867 11.37705 
1 1 1   12   21   30 o   56.603   4.9959   70.097   11.036   73.095   13.765   64.702   18.465   58.735   5.6822   54.470   8.2189 4.264130 9.991861 
1 1 1   12   21   31 o  105.833   4.4308  244.085   18.859  216.207   29.016  264.476   24.816   99.997   7.0353  111.670   5.3881 -11.67321 8.861572 
1 1 1   12   21   32 o   39.652   6.9099   36.744   10.253   36.992   11.891   36.024   20.242   40.696   7.3554   38.608   11.700 2.087399 13.81979 
1 1 1   12   21   33 o   53.813   8.1507   55.383   11.989   50.779   12.685   93.902   36.692   48.499   6.3417   59.128   15.017 -10.62879 16.30137 
1 1 1   12   21   34 o   43.222   6.7345   40.956   10.470   37.424   12.084   51.595   20.974   40.678   7.4779   45.765   11.202 -5.086395 13.46892 
1 1 1   12   21   35 o   40.887   6.8487   46.444   11.783   57.164   13.983   20.198   21.880   51.026   6.6445   30.748   11.978 20.27732 13.69748 
1 1 1   12   21   36 o   25.686   7.7727   7.0086   14.657   6.8402   20.687   7.1783   20.769   25.618   10.973   25.754   11.012 -0.1355972 15.54549 
1 1 1   12   21   37 o   36.355   7.0826   23.789   10.271   12.871   11.701   60.445   21.440   24.390   8.9195   48.321   11.004 -23.93105 14.16516 
1 1 1   12   21   38 o   48.389   6.0650   47.452   10.982   34.913   12.844   81.546   21.178   38.067   8.4052   58.711   8.7458 -20.64380 12.12996 
1 1 1   12   21   39 o   21.667   6.5486   4.6936   10.561   11.029   12.078 -15.8819   21.766   23.220   8.9398   20.113   9.5715 3.107038 13.09712 
1 1 1   12   21   40 o   33.854   7.2896   17.878   11.216   3.4413   12.845   64.212   23.012   19.995   8.6071   47.713   11.767 -27.71843 14.57924 
1 1 1   12   21   41 o   39.830   8.0340   53.715   14.619   58.106   15.509   18.705   43.791   49.383   7.6145   30.278   14.149 19.10479 16.06802 
1 1 1   12   21   42 o   46.351   8.3470   57.954   13.951   51.728   15.774   80.326   29.902   44.750   8.8597   47.951   14.149 -3.201305 16.69391 
1 1 1   12   22    0 o  170.714   2.1684  602.020   21.576  602.020   21.576  602.020   21.576  170.714   3.0665  170.714   3.0665 0.000000 0.000000 
1 1 1   12   22    1 o  214.275   2.2690  948.262   20.051  958.085   28.564  938.720   28.153  215.368   3.2156  213.182   3.2019 2.186264 4.537915 
1 1 1   12   22    2 o  138.773   2.3677  391.949   13.234  372.100   16.794  424.461   21.493  134.229   3.0335  143.317   3.6362 -9.088043 4.735395 
1 1 1   12   22    3 o   67.257   2.8488   91.802   7.5978   99.684   12.853   87.569   9.4196   69.414   4.4896   65.100   3.5082 4.314095 5.697674 
1 1 1   12   22    4 o  127.100   2.4401  339.213   11.789  319.550   20.975  348.294   14.254  124.314   4.0909  129.885   2.6608 -5.571053 4.880122 
1 1 1   12   22    5 o   49.403   4.0973   47.231   6.5555   56.203   15.633   45.317   7.2210   51.982   7.2918   46.824   3.7390 5.157692 8.194543 
1 1 1   12   22    6 o  149.517   2.4651  470.551   14.041  439.046   24.820  485.380   17.028  145.708   4.1300  153.326   2.6926 -7.617920 4.930250 
1 1 1   12   22    7 o  114.893   2.4892  267.339   10.788  286.180   20.087  259.703   12.788  117.637   4.1401  112.150   2.7647 5.486847 4.978407 
1 1 1   12   22    8 o  177.252   2.5951  656.830   17.931  626.049   30.509  673.074   22.163  173.976   4.2519  180.529   2.9766 -6.552643 5.190230 
1 1 1   12   22    9 o   89.395   2.8255  175.710   9.1940  142.222   16.827  189.962   10.977   82.876   4.9227   95.914   2.7749 -13.03810 5.650981 
1 1 1   12   22   10 o   80.504   2.9231  135.913   8.4899  130.184   16.531  137.966   9.8944   79.276   5.0559   81.732   2.9352 -2.455505 5.846123 
1 1 1   12   22   11 o  207.529   2.7482  899.226   22.223  863.827   37.924  917.737   27.424  204.292   4.5009  210.766   3.1548 -6.474060 5.496430 
1 1 1   12   22   12 o  113.376   2.7089  262.580   11.197  272.700   21.894  258.995   13.030  114.768   4.6253  111.985   2.8212 2.782707 5.417775 
1 1 1   12   22   13 f   37.124   4.7748   29.931   6.9780   49.304   10.273   13.335   9.5080   48.776   5.1065   25.473   8.0696 23.30284 9.549588 
1 1 1   12   22   14 o   83.290   3.0567  141.753   10.303  134.601   13.200  152.901   16.481   80.661   3.9679   85.919   4.6509 -5.257347 6.113484 
1 1 1   12   22   15 o   23.132   6.1066   8.4057   7.8754   10.681   11.160   6.1492   11.115   24.414   8.7408   21.849   8.5300 2.564741 12.21316 
1 1 1   12   22   16 o   91.456   2.7616  174.333   10.338  152.998   14.837  194.469   14.414   85.954   4.1851   96.958   3.6044 -11.00380 5.523256 
1 1 1   12   22   17 o   82.384   3.0775  140.103   10.220  143.260   16.361  138.083   13.088   83.100   4.7736   81.667   3.8855 1.433487 6.155052 
1 1 1   12   22   18 o   43.790   6.9372   50.788   9.5093   23.917   24.791   55.423   10.297   35.912   13.006   51.669   4.8318 -15.75743 13.87442 
1 1 1   12   22   19 o  130.593   2.6809  354.200   14.252  346.909   21.877  359.576   18.785  129.374   4.0999  131.811   3.4554 -2.436600 5.361821 
1 1 1   12   22   20 o   75.332   3.1214  117.497   9.5896  120.011   14.774  115.667   12.606   75.990   4.7139   74.673   4.0930 1.316948 6.242861 
1 1 1   12   22   21 o  147.004   2.5924  447.437   15.627  454.614   23.476  441.727   20.940  148.020   3.8454  145.988   3.4778 2.031769 5.184757 
1 1 1   12   22   22 o  115.634   3.3463  277.077   15.891  243.581   21.688  315.907   23.351  108.095   4.8646  123.173   4.5965 -15.07755 6.692678 
1 1 1   12   22   23 o  114.720   5.9144  269.697   16.373  266.986   17.188  296.285   53.820  113.380   3.6755  116.060   11.243 -2.679832 11.82888 
1 1 1   12   22   24 o   79.968   5.6506  138.785   13.667  139.804   14.971  133.692   33.472   81.864   4.4341   78.072   10.395 3.792313 11.30111 
1 1 1   12   22   25 o   33.291   6.5124   22.587   8.8923   17.549   10.832   33.001   15.572   28.371   8.5500   38.211   9.8257 -9.840359 13.02489 
1 1 1   12   22   26 o   20.998   5.6335   2.9888   8.4280   14.983   10.168 -23.3456   15.066   26.367   8.3440   15.630   7.5711 10.73717 11.26698 
1 1 1   12   22   27 o   71.998   5.6556  109.139   15.706  122.066   28.224  103.340   18.903   74.423   9.1949   69.573   6.5875 4.849556 11.31110 
1 1 1   12   22   28 o   81.880   3.7407  141.607   12.143  141.773   15.226  141.318   20.127   82.212   4.4902   81.549   5.9840 0.6634903 7.481314 
1 1 1   12   22   29 o   45.553   6.0865   49.474   10.113   54.625   12.203   38.180   18.069   50.736   5.8316   40.369   10.685 10.36687 12.17309 
1 1 1   12   22   30 o   97.893   3.5259  198.268   13.787  186.371   17.238  219.391   22.969   94.147   4.4392  101.638   5.4791 -7.490685 7.051774 
1 1 1   12   22   31 o   64.509   6.4585   99.740   15.473   66.154   23.411  125.795   20.620   52.600   11.138   76.418   6.5421 -23.81788 12.91705 
1 1 1   12   22   32 o   86.897   4.3973  171.751   14.194  187.390   17.277  139.268   24.899   94.245   4.4446   79.549   7.5889 14.69585 8.794671 
1 1 1   12   22   33 o   22.173   6.6763   0.4976   8.9903  -3.0600   10.141   13.556   19.429   16.362   7.3198   27.983   11.167 -11.62107 13.35263 
1 1 1   12   22   34 o   29.016   8.1242   16.687   11.007   18.167   11.557   2.2375   36.111   27.986   8.9000   30.045   13.594 -2.058678 16.24843 
1 1 1   12   22   35 o   30.326   7.3889   13.083   9.8989   5.5808   11.089   42.507   21.961   20.531   8.3500   40.121   12.193 -19.58986 14.77784 
1 1 1   12   22   36 o   23.906   6.7926   10.217   9.9738   13.605   11.525   0.1089   19.906   24.791   8.8817   23.020   10.280 1.771666 13.58517 
1 1 1   12   22   37 o   32.807   7.0767   29.169   10.946   34.722   12.904   14.915   20.674   37.936   8.4622   27.678   11.345 10.25834 14.15344 
1 1 1   12   22   38 o   33.376   7.4904   26.597   10.501   22.876   12.191   37.303   20.676   30.261   9.0592   36.491   11.931 -6.229286 14.98085 
1 1 1   12   22   39 o   21.569   6.6075   4.2086   10.972   10.652   12.519 -17.1364   22.786   22.974   9.0285   20.165   9.6500 2.809566 13.21502 
1 1 1   12   22   40 o   23.785   7.1669   9.4846   11.239   10.091   12.888   7.5577   22.966   22.623   9.0719   24.946   11.098 -2.322859 14.33379 
1 1 1   12   22   41 o   37.331   7.9842   44.187   13.416   47.082   15.257   34.312   28.177   42.573   8.9719   32.089   13.210 10.48404 15.96840 
1 1 1   12   23    0 o   78.189   2.6217  127.065   11.895  127.065   11.895  127.065   11.895   78.189   3.7076   78.189   3.7076 0.000000 0.000000 
1 1 1   12   23    1 o  106.412   2.2380  233.893   9.8216  233.168   13.802  234.638   13.980  106.245   3.1496  106.578   3.1803 -0.3328323 4.475964 
1 1 1   12   23    2 o  135.739   2.3832  377.247   13.084  363.976   16.788  397.778   20.881  132.748   3.0662  138.730   3.6493 -5.982132 4.766402 
1 1 1   12   23    3 o   86.141   2.8700  153.877   10.147  158.435   13.814  148.534   14.956   87.544   3.8257   84.738   4.2792 2.805603 5.739998 
1 1 1   12   23    4 o   36.960   5.4088   28.531   7.0849   29.922   14.395   28.086   8.1389   37.105   9.3963   36.815   5.3601 0.2902374 10.81765 
1 1 1   12   23    5 o   76.421   3.6661  131.799   8.6636  104.904   19.787  138.178   9.6363   71.044   6.7530   81.799   2.8563 -10.75475 7.332205 
1 1 1   12   23    6 o  165.721   2.4827  561.411   15.413  582.355   28.828  553.028   18.239  167.788   4.1657  163.654   2.7022 4.134598 4.965344 
1 1 1   12   23    7 o  107.088   2.6152  246.071   10.671  212.438   18.430  263.034   13.089  101.318   4.4103  112.857   2.8119 -11.53865 5.230479 
1 1 1   12   23    8 o  170.079   2.5822  584.454   16.683  632.616   30.756  564.378   19.858  174.856   4.2647  165.303   2.9126 9.553177 5.164406 
1 1 1   12   23    9 o  125.047   2.6427  316.820   12.942  343.698   22.504  303.539   15.819  128.885   4.2334  121.210   3.1644 7.674973 5.285368 
1 1 1   12   23   10 o  147.137   3.5628  453.349   20.946  469.056   26.775  428.575   33.627  150.551   4.3121  143.724   5.6728 6.827011 7.125663 
1 1 1   12   23   11 o  170.914   3.4295  637.579   18.612  554.838   42.139  657.632   20.745  163.392   6.2530  178.435   2.8188 -15.04312 6.858954 
1 1 1   12   23   12 o  112.591   2.7259  265.869   11.315  254.128   21.283  270.496   13.360  110.752   4.6593  114.430   2.8307 -3.678085 5.451724 
1 1 1   12   23   13 o   80.968   2.8730  135.822   9.5330  116.430   13.277  156.456   13.696   74.980   4.2934   86.957   3.8188 -11.97621 5.745951 
1 1 1   12   23   14 o  141.022   2.8309  406.476   15.551  427.596   27.158  396.173   18.968  143.626   4.5845  138.417   3.3225 5.209808 5.661867 
1 1 1   12   23   15 o   41.851   4.9378   36.908   8.2528   30.176   11.222   44.838   12.179   37.323   7.5493   46.380   6.3669 -9.056683 9.875670 
1 1 1   12   23   16 o  143.198   2.3936  424.251   14.136  427.305   20.056  421.236   19.928  143.710   3.3837  142.686   3.3863 1.024612 4.787103 
1 1 1   12   23   17 o  136.289   2.7346  387.231   15.269  354.531   22.275  416.212   20.971  130.785   4.1295  141.794   3.5858 -11.00920 5.469115 
1 1 1   12   23   18 o   38.656   4.8195   32.115   7.3734   30.066   11.338   33.616   9.7062   37.168   7.6513   40.144   5.8623 -2.976250 9.638922 
1 1 1   12   23   19 o   49.830   3.9298   50.357   7.8990   58.934   12.904   45.216   9.9895   53.089   5.8931   46.572   5.2006 6.516186 7.859653 
1 1 1   12   23   20 o   44.901   4.4017   40.489   7.9358   50.462   13.204   34.851   9.9289   49.007   6.5328   40.796   5.9009 8.210304 8.803302 
1 1 1   12   23   21 f   56.794   3.6055   67.476   8.3726   66.613   12.655   68.148   11.166   56.421   5.4382   57.168   4.7355 -0.7465248 7.211053 
1 1 1   12   23   22 o   97.962   2.6523  199.352   10.713  204.504   15.386  194.504   14.925   99.187   3.7611   96.736   3.7407 2.451393 5.304610 
1 1 1   12   23   23 o   99.055   3.3893  204.040   12.980  202.049   15.783  208.202   22.816   98.542   3.8833   99.568   5.5560 -1.026482 6.778561 
1 1 1   12   23   24 o   40.888   7.8816   40.141   11.035   42.266   11.775   24.811   31.626   44.706   6.3862   37.070   14.412 7.636269 15.76312 
1 1 1   12   23   25 o   53.113   4.6570   59.595   9.7722   58.272   12.135   62.035   16.482   52.521   5.6020   53.705   7.4410 -1.183773 9.314028 
1 1 1   12   23   26 o   41.993   6.1263   40.450   10.105   44.058   12.838   34.573   16.383   45.352   6.8632   38.635   10.150 6.717602 12.25251 
1 1 1   12   23   27 o   71.251   4.1940  102.662   11.738   92.005   14.261  125.047   20.668   66.024   5.2369   76.478   6.5524 -10.45382 8.388065 
1 1 1   12   23   28 o   67.417   4.9823   97.653   13.791   98.781   20.540   96.728   18.609   67.644   7.3622   67.191   6.7150 0.4533539 9.964609 
1 1 1   12   23   29 o   28.385   6.5221   18.577   9.3240   24.540   11.136   4.5979   17.051   32.771   8.2461   24.000   10.107 8.770964 13.04426 
1 1 1   12   23   30 o   37.093   6.5916   29.814   9.5719   25.166   11.570   39.895   17.040   33.101   8.4467   41.086   10.122 -7.985516 13.18323 
1 1 1   12   23   31 o   53.753   5.8240   63.812   11.144   62.355   13.048   67.740   21.425   53.907   5.8688   53.599   10.061 0.3073883 11.64790 
1 1 1   12   23   32 o   26.369   6.1522   14.697   9.6351   25.815   11.395 -13.1882   18.046   33.342   8.3146   19.396   9.0701 13.94672 12.30445 
1 1 1   12   23   33 o   22.697   6.6435   6.1065   8.8471   5.2694   10.093   8.8830   18.381   19.854   8.0046   25.539   10.605 -5.685139 13.28702 
1 1 1   12   23   34 o   22.810   7.3670   0.9892   10.731   2.2998   11.390  -9.3626   32.010   19.248   8.1903   26.373   12.248 -7.125137 14.73409 
1 1 1   12   23   35 o   32.878   6.9433   28.106   10.086   31.181   11.976   20.607   18.704   36.134   8.2211   29.622   11.192 6.512711 13.88660 
1 1 1   12   23   36 o   53.430   5.5331   60.754   11.296   53.114   13.342   80.095   21.227   48.740   6.6368   58.119   8.8552 -9.378750 11.06618 
1 1 1   12   23   37 o   41.362   7.6718   46.428   14.295   65.822   20.050   26.377   20.387   51.057   9.8785   31.667   11.741 19.38950 15.34360 
1 1 1   12   23   38 o   20.883   6.2170   3.9558   10.044   12.630   11.397 -26.2062   21.253   23.706   8.7804   18.061   8.8039 5.645161 12.43399 
1 1 1   12   23   39 o   32.186   7.5931   18.218   11.455   5.7917   13.186   56.442   23.128   20.948   8.8586   43.424   12.335 -22.47655 15.18618 
1 1 1   12   23   40 o   28.554   6.6635   21.169   12.289   38.144   14.771 -17.0030   22.151   37.706   9.5020   19.403   9.3445 18.30318 13.32695 
1 1 1   12   24    0 o  228.963   2.3326  1082.85   31.138  1082.85   31.138  1082.85   31.138  228.963   3.2988  228.963   3.2988 0.000000 0.000000 
1 1 1   12   24    1 o   34.230   4.2978   24.847   5.9027   21.649   8.3548   28.034   8.3405   31.693   6.6057   36.768   5.5000 -5.074627 8.595648 
1 1 1   12   24    2 o  102.624   2.5742  215.315   10.701  205.678   13.753  230.103   17.036   99.765   3.3424  105.482   3.9159 -5.717316 5.148324 
1 1 1   12   24    3 o   31.520   5.0095   21.908   7.0787   35.925   9.7632   6.3728   10.278   41.614   5.6884   21.427   8.2475 20.18709 10.01894 
1 1 1   12   24    4 o  125.510   3.3961  325.554   17.580   0.0000   0.0000  325.554   17.580  ?   ?   125.510   3.3961      ?      ? 
1 1 1   12   24    5 o   60.944   3.6532   76.650   8.3686   77.786   15.475   76.180   9.9488   61.200   6.1307   60.689   3.9746 0.5110245 7.306371 
1 1 1   12   24    6 o  124.267   3.2802  324.405   12.646  312.729   30.306  326.866   13.915  122.723   5.9874  125.811   2.6816 -3.087822 6.560489 
1 1 1   12   24    7 o   54.061   4.1571   50.981   6.9519   76.494   18.441   46.755   7.5057   60.576   7.3809   47.546   3.8275 13.03023 8.314284 
1 1 1   12   24    8 o  145.752   2.5877  456.758   14.743  377.474   23.851  505.780   18.755  135.034   4.2824  156.469   2.9061 -21.43524 5.175414 
1 1 1   12   24    9 o  129.399   2.5708  356.690   12.597  319.336   22.242  374.330   15.285  124.181   4.3425  134.616   2.7529 -10.43490 5.141597 
1 1 1   12   24   10 o   98.050   2.7130  198.717   9.8109  199.423   18.675  198.448   11.530   98.096   4.6158   98.005   2.8525 0.9113312E-01 5.426084 
1 1 1   12   24   11 o  122.395   2.7565  310.571   13.262  308.420   22.413  311.729   16.452  122.000   4.4543  122.790   3.2485 -0.7907715 5.513021 
1 1 1   12   24   12 f  214.616   2.9980  956.769   26.168  938.950   40.323  969.734   34.394  212.799   4.5943  216.434   3.8529 -3.634857 5.996059 
1 1 1   12   24   13 f   79.604   3.3032  137.531   10.176  111.760   16.706  152.733   12.831   73.306   5.5254   85.903   3.6215 -12.59717 6.606463 
1 1 1   12   24   14 o   75.794   3.3225  114.467   10.155   97.164   12.823  143.569   16.631   68.435   4.5432   83.153   4.8492 -14.71749 6.644929 
1 1 1   12   24   15 o   52.519   3.6647   59.207   7.6798   45.940   11.473   69.977   10.338   46.949   5.9248   58.088   4.3148 -11.13894 7.329454 
1 1 1   12   24   16 o   39.311   4.8536   32.633   7.4012   34.034   12.309   31.839   9.2627   39.552   7.8224   39.070   5.7481 0.4816704 9.707272 
1 1 1   12   24   17 o  148.457   2.4026  456.485   14.704  437.329   20.616  476.319   20.978  145.279   3.4406  151.635   3.3543 -6.355713 4.805103 
1 1 1   12   24   18 o   72.396   3.0990  110.582   9.0686   86.081   12.895  134.556   12.756   64.275   4.8642   80.516   3.8411 -16.24079 6.198008 
1 1 1   12   24   19 o   62.636   3.2839   82.367   8.4017   76.342   12.495   87.339   11.351   60.476   5.0096   64.795   4.2473 -4.319149 6.567724 
1 1 1   12   24   20 o   45.943   4.2300   45.006   7.7673   41.607   12.359   47.225   9.9860   44.368   6.7535   47.518   5.0952 -3.150124 8.459961 
1 1 1   12   24   21 o   29.706   5.6677   19.371   6.9802   20.110   11.208   18.903   8.9215   30.162   8.5936   29.250   7.3919 0.9124947 11.33537 
1 1 1   12   24   22 o   41.248   4.9134   38.398   7.8072   26.458   11.572   48.374   10.577   34.470   8.2495   48.027   5.3398 -13.55724 9.826887 
1 1 1   12   24   23 o  131.694   2.8987  360.211   15.214  355.391   19.136  368.492   25.084  130.695   3.5500  132.693   4.5834 -1.997177 5.797391 
1 1 1   12   24   24 o   69.037   3.8961  100.169   10.753   98.566   13.585  102.858   17.595   68.498   4.8087   69.576   6.1314 -1.077843 7.792151 
1 1 1   12   24   25 o   67.743   7.1170  108.437   12.754  110.386   13.764   96.595   33.922   72.522   4.6017   62.965   13.470 9.557423 14.23405 
1 1 1   12   24   26 o   59.862   4.9176   81.776   11.315   98.764   14.755   57.525   17.630   68.409   5.2296   51.316   8.3297 17.09325 9.835286 
1 1 1   12   24   27 o   57.042   4.7923   67.759   10.664   63.608   12.949   76.507   18.797   54.732   5.7363   59.353   7.6785 -4.620800 9.584579 
1 1 1   12   24   28 o   21.340   6.7160  -3.3210   11.942  -9.2367   18.605   0.8246   15.575   20.858   9.5600   21.822   9.4353 -0.9639587 13.43199 
1 1 1   12   24   29 o   31.524   6.7350   19.506   9.1778   12.762   11.032   34.666   16.540   24.849   8.7106   38.198   10.275 -13.34984 13.46999 
1 1 1   12   24   30 o   28.510   6.5542   18.924   9.1571   23.610   11.207   9.5112   15.884   31.939   8.3965   25.080   10.066 6.858673 13.10843 
1 1 1   12   24   31 o   33.949   7.1404   25.965   10.020   23.232   11.904   32.604   18.556   31.492   8.8162   36.406   11.234 -4.914059 14.28070 
1 1 1   12   24   32 o   22.731   6.6624   2.6234   9.3654  -2.5009   10.962   16.473   18.022   17.131   7.6408   28.330   10.916 -11.19883 13.32475 
1 1 1   12   24   33 o   27.854   6.8280   11.607   9.3575   3.2731   11.001   33.420   17.797   19.403   8.1420   36.306   10.963 -16.90215 13.65610 
1 1 1   12   24   34 o   34.408   7.0038   32.026   10.582   36.491   12.313   19.414   20.694   39.371   7.8579   29.444   11.596 9.927635 14.00763 
1 1 1   12   24   35 o   23.413   6.8037   8.1294   9.5237   6.9234   11.093   11.511   18.575   20.945   8.4102   25.882   10.697 -4.937160 13.60733 
1 1 1   12   24   36 o   29.560   7.1117   22.284   10.069   24.131   11.695   16.990   19.797   31.223   8.7373   27.897   11.223 3.326180 14.22347 
1 1 1   12   24   37 f   27.885   7.7483   17.124   13.754   28.821   19.358   5.2001   19.544   32.203   11.514   23.567   10.372 8.635868 15.49663 
1 1 1   12   24   38 o   28.427   6.9142   22.023   10.705   28.205   12.514   5.1516   20.672   33.128   8.9478   23.727   10.543 9.401205 13.82837 
1 1 1   12   24   39 o   24.823   7.1925   13.502   10.851   13.823   12.507   12.526   21.824   24.097   9.1403   25.549   11.108 -1.451601 14.38497 
1 1 1   12   24   40 o   33.238   7.5770   17.133   12.324  -0.4041   14.191   70.929   24.855   18.951   8.5529   47.524   12.510 -28.57378 15.15401 
1 1 1   12   25    0 o  116.421   2.4441  280.609   16.564  280.609   16.564  280.609   16.564  116.421   3.4564  116.421   3.4564 0.000000 0.000000 
1 1 1   12   25    1 o   68.409   3.1502  100.501   8.4639   83.488   13.569  111.337   10.829   63.442   5.1858   73.375   3.5782 -9.932648 6.300429 
1 1 1   12   25    2 o   65.089   3.5830   87.835   9.5991   88.238   14.043   87.481   13.151   65.218   5.2208   64.960   4.9085 0.2577820 7.165915 
1 1 1   12   25    3 o  139.605   2.9420  401.500   16.877  381.957   22.719  425.564   25.211  135.846   4.0549  143.364   4.2637 -7.517502 5.884039 
1 1 1   12   25    4 o   64.537   3.8609   94.484   9.0027   68.619   16.073  106.308   10.867   57.385   6.7910   71.689   3.6754 -14.30401 7.721796 
1 1 1   12   25    5 o   95.111   2.6651  186.166   10.424  200.578   15.484  174.220   14.097   98.456   3.8131   91.767   3.7246 6.689728 5.330277 
1 1 1   12   25    6 o   23.664   5.8080   10.093   7.2480   15.107   9.8564   4.1886   10.695   26.796   8.1739   20.533   8.2534 6.263329 11.61605 
1 1 1   12   25    7 o  186.447   2.7743  719.723   20.896  718.905   33.056  720.268   26.967  186.288   4.3023  186.606   3.5038 -0.3184204 5.548549 
1 1 1   12   25    8 o   67.472   2.7502   98.381   7.1908   80.784   11.820  108.719   9.0602   62.421   4.5913   72.523   3.0290 -10.10268 5.500411 
1 1 1   12   25    9 o   72.623   2.6146  110.514   7.4308  104.778   12.522  113.632   9.2323   71.106   4.2696   74.140   3.0192 -3.034035 5.229258 
1 1 1   12   25   10 o  180.222   2.3318  676.613   17.184  627.283   25.450  717.949   23.296  174.099   3.5442  186.344   3.0312 -12.24590 4.663613 
1 1 1   12   25   11 o  123.335   2.6767  323.203   12.329  295.337   22.424  335.275   14.759  119.310   4.5569  127.360   2.8098 -8.049454 5.353494 
1 1 1   12   25   12 f  180.316   2.8864  672.166   20.991  681.928   33.491  665.851   26.939  181.300   4.4788  179.332   3.6421 1.968170 5.772736 
1 1 1   12   25   13 o  129.115   2.5988  343.499   13.575  354.355   21.546  336.353   17.480  130.747   3.9954  127.483   3.3245 3.263458 5.197677 
1 1 1   12   25   14 o   87.257   3.3090  157.310   11.871  172.073   17.642  145.096   16.047   90.971   4.7021   83.543   4.6571 7.428398 6.617987 
1 1 1   12   25   15 o   87.089   2.7075  158.441   9.6560  140.666   13.907  174.985   13.417   82.302   4.0970   91.875   3.5408 -9.573540 5.415023 
1 1 1   12   25   16 f  108.634   2.6675  241.552   11.741  262.366   18.730  228.080   15.069  112.386   4.0408  104.883   3.4834 7.502945 5.335008 
1 1 1   12   25   17 o   90.588   2.7273  171.285   10.140  157.234   14.647  184.214   14.051   86.963   4.0837   94.212   3.6160 -7.248535 5.454547 
1 1 1   12   25   18 o  106.015   2.5511  233.603   11.143  228.799   16.035  238.089   15.495  104.940   3.7048  107.090   3.5081 -2.150177 5.102203 
1 1 1   12   25   19 o   95.565   2.6797  190.700   10.518  175.762   15.140  204.635   14.623   91.888   3.9949   99.241   3.5726 -7.353142 5.359408 
1 1 1   12   25   20 o  178.528   2.8144  656.750   20.508  620.015   26.833  708.353   31.803  172.671   3.7677  184.385   4.1819 -11.71373 5.628875 
1 1 1   12   25   21 o  114.154   2.8869  273.898   13.201  261.929   21.116  281.576   16.913  111.932   4.5740  116.376   3.5236 -4.443802 5.773827 
1 1 1   12   25   22 o  101.836   3.6130  228.391   14.318  181.287   22.964  258.351   18.314   92.443   6.0230  111.229   3.9922 -18.78593 7.225938 
1 1 1   12   25   23 o   52.885   4.5778   60.422   9.7636   64.002   12.800   55.440   15.099   54.994   5.6432   50.776   7.2097 4.218239 9.155604 
1 1 1   12   25   24 o   42.035   5.3641   36.880   8.9043   30.438   11.171   48.103   14.745   36.917   7.5903   47.153   7.5818 -10.23587 10.72825 
1 1 1   12   25   25 o   25.847   7.8675   5.9651   10.972   6.8628   11.700  -0.5797   31.590   22.076   8.7112   29.619   13.104 -7.543629 15.73507 
1 1 1   12   25   26 o   27.894   6.6429   14.556   8.7547   9.5090   10.661   25.005   15.341   22.842   8.4858   32.947   10.223 -10.10495 13.28590 
1 1 1   12   25   27 o   38.544   6.2031   33.125   9.2782   30.536   11.445   38.088   15.847   36.735   7.7952   40.354   9.6513 -3.619240 12.40612 
1 1 1   12   25   28 o   24.382   7.1708   6.3832   11.777   6.0123   18.347   6.6431   15.359   25.015   10.507   23.749   9.7618 1.265732 14.34167 
1 1 1   12   25   29 o   60.933   4.4198   77.351   10.743   69.796   13.336   91.317   18.132   57.088   5.6639   64.777   6.7866 -7.689831 8.839560 
1 1 1   12   25   30 o   25.421   6.5768   13.469   9.1391   17.420   10.870   3.9438   16.879   27.560   8.6143   23.282   9.9404 4.277594 13.15356 
1 1 1   12   25   31 o   34.898   6.7605   29.584   9.7525   30.118   12.034   28.562   16.646   35.795   8.3109   34.002   10.665 1.792934 13.52094 
1 1 1   12   25   32 o   54.763   5.1137   65.754   11.128   62.304   13.854   72.028   18.682   53.289   6.3033   56.237   8.0542 -2.948948 10.22747 
1 1 1   12   25   33 o   35.914   7.3486   30.529   11.235   22.879   13.910   44.883   19.055   30.395   9.7745   41.433   10.976 -11.03852 14.69711 
1 1 1   12   25   34 o   32.008   7.4638   21.314   10.114   15.765   11.551   39.537   20.934   26.006   8.9246   38.011   11.966 -12.00499 14.92767 
1 1 1   12   25   35 o   20.602   8.4270   6.2158   11.376   6.2158   11.376   0.0000   0.0000   20.602   8.4270  ?   ?       ?      ? 
1 1 1   12   25   36 o   19.639   6.2773  -3.9385   9.5438  -8.5506   11.139   8.7954   18.508   14.992   7.0472   24.286   10.390 -9.294791 12.55453 
1 1 1   12   25   37 o   26.434   7.2931   16.138   10.449   16.031   11.924   16.492   21.692   25.581   9.0479   27.287   11.441 -1.705475 14.58621 
1 1 1   12   25   38 o   27.243   7.5088   17.966   11.025   15.702   12.776   24.568   21.815   25.123   9.2982   29.363   11.793 -4.239082 15.01755 
1 1 1   12   25   39 o   20.750   6.6689  -5.8732   11.074 -14.6596   12.962   17.876   21.311   14.688   7.0924   26.813   11.296 -12.12503 13.33789 
1 1 1   12   26    0 f  140.372   2.8327  408.203   23.151  408.203   23.151  408.203   23.151  140.372   4.0061  140.372   4.0061 0.000000 0.000000 
1 1 1   12   26    1 o   58.015   3.4313   66.953   8.0167   56.948   10.092   84.066   13.198   52.397   4.6697   63.633   5.0289 -11.23547 6.862662 
1 1 1   12   26    2 o   94.588   3.4380  175.895   11.349  167.948   12.836  204.368   24.296   90.099   3.4541   99.077   5.9455 -8.978027 6.876063 
1 1 1   12   26    3 o  159.320   3.4882  525.200   22.921  525.200   22.921   0.0000   0.0000  159.320   3.4882  ?   ?       ?      ? 
1 1 1   12   26    4 o  271.863   5.0280  1534.92   56.378   0.0000   0.0000  1534.92   56.378  ?   ?   271.863   5.0280      ?      ? 
1 1 1   12   26    5 o   98.244   2.8009  199.601   11.320  195.579   15.397  204.331   16.700   97.182   3.8414   99.306   4.0772 -2.124161 5.601819 
1 1 1   12   26    6 o  136.505   2.6921  389.746   14.951  358.360   22.543  414.390   19.975  131.494   4.1566  141.514   3.4224 -10.02005 5.384264 
1 1 1   12   26    7 o   74.597   2.6631  115.220   8.1910  111.320   11.514  119.216   11.655   73.315   3.8077   75.878   3.7242 -2.562683 5.326156 
1 1 1   12   26    8 o  145.019   2.2532  436.859   13.282  423.658   20.439  446.508   17.474  143.074   3.4636  146.963   2.8829 -3.888412 4.506417 
1 1 1   12   26    9 o  278.441   2.6011  1610.53   29.209  1581.53   46.227  1629.80   37.685  276.221   4.0576  280.660   3.2555 -4.439423 5.202209 
1 1 1   12   26   10 o  140.322   2.3589  409.698   13.581  372.259   19.564  444.515   18.867  134.071   3.5380  146.574   3.1208 -12.50375 4.717745 
1 1 1   12   26   11 o  181.936   2.3516  681.311   17.373  708.644   27.293  662.694   22.525  184.924   3.5785  178.947   3.0520 5.978012 4.703215 
1 1 1   12   26   12 o   69.605   3.4248  107.752   9.0421   80.591   14.973  123.343   11.344   62.075   5.8483   77.134   3.5658 -15.05933 6.849675 
1 1 1   12   26   13 o  111.109   2.7149  258.231   12.070  247.663   19.386  264.919   15.423  109.146   4.3065  113.071   3.3072 -3.925217 5.429850 
1 1 1   12   26   14 f   46.495   5.2120   48.012   9.2870   39.855   14.733   53.391   11.963   42.499   8.6983   50.492   5.7445 -7.993309 10.42402 
1 1 1   12   26   15 o   40.094   5.2484   48.917   8.1174   4.5354   15.083   67.014   9.6312   23.428   9.6569   56.759   4.1141 -33.33134 10.49673 
1 1 1   12   26   16 o   24.330   5.6826   12.274   6.4114   10.128   11.475   13.248   7.7308   23.943   8.8211   24.716   7.1663 -0.7731857 11.36519 
1 1 1   12   26   17 o  111.364   2.5389  257.676   11.660  263.351   16.590  252.135   16.392  112.580   3.5730  110.148   3.6081 2.431580 5.077837 
1 1 1   12   26   18 o   85.420   2.8513  151.181   9.9690  157.706   15.188  146.242   13.214   86.990   4.2332   83.850   3.8208 3.139687 5.702543 
1 1 1   12   26   19 o  108.819   2.5923  246.681   11.569  213.992   16.173  280.929   16.554  101.373   3.8682  116.265   3.4522 -14.89218 5.184680 
1 1 1   12   26   20 o   83.581   2.8429  147.111   9.7118  128.480   14.012  164.334   13.473   78.360   4.3356   88.801   3.6785 -10.44128 5.685838 
1 1 1   12   26   21 o   24.514   5.6752   12.695   6.5238   12.401   10.439   12.884   8.3569   24.645   8.4824   24.383   7.5419 0.2627487 11.35040 
1 1 1   12   26   22 o   39.964   5.1833   39.858   7.7187   20.618   12.484   51.765   9.8209   30.308   9.1889   49.619   4.7988 -19.31117 10.36654 
1 1 1   12   26   23 o   27.284   6.1265   16.242   8.1816   22.173   10.806   8.2719   12.525   31.326   8.2494   23.242   9.0600 8.084234 12.25301 
1 1 1   12   26   24 o   90.619   2.8023  172.048   10.442  167.298   15.244  176.249   14.333   89.382   4.1350   91.856   3.7832 -2.473869 5.604544 
1 1 1   12   26   25 o   61.342   4.3313   79.746   10.900   71.686   14.555   90.038   16.447   57.860   6.0992   64.824   6.1515 -6.964241 8.662645 
1 1 1   12   26   26 o   56.836   9.0166   62.156   12.020   58.838   12.479  104.874   44.771   52.505   5.7623   61.167   17.088 -8.661911 18.03324 
1 1 1   12   26   27 o   71.811   3.8173  107.487   10.978  100.166   13.766  120.278   18.196   68.754   4.8544   74.868   5.8926 -6.113876 7.634647 
1 1 1   12   26   28 o   29.152   6.6513   19.453   8.8889   20.233   10.936   17.934   15.259   29.593   8.5069   28.711   10.227 0.8821392 13.30252 
1 1 1   12   26   29 o   22.760   6.8538   2.9752   11.692  -7.1972   18.221   10.097   15.245   20.744   9.4906   24.776   9.8907 -4.031366 13.70753 
1 1 1   12   26   30 o   30.102   6.9354   18.364   9.4431   12.241   11.316   32.411   17.139   24.221   8.7845   35.984   10.735 -11.76304 13.87088 
1 1 1   12   26   31 o   38.824   6.3242   38.104   9.9465   44.052   12.406   27.400   16.642   44.564   6.7496   33.084   10.697 11.47997 12.64837 
1 1 1   12   26   32 o   59.506   4.6244   77.710   10.867   74.669   13.460   83.403   18.416   58.468   5.5814   60.544   7.3748 -2.076218 9.248798 
1 1 1   12   26   33 o   22.655   6.5921   7.3437   10.203   12.806   12.271  -4.8957   18.369   24.439   9.0990   20.871   9.5411 3.568605 13.18430 
1 1 1   12   26   34 o   36.955   6.8112   36.277   10.213   38.968   12.230   30.078   18.564   40.581   7.5857   33.330   11.315 7.250095 13.62244 
1 1 1   12   26   35 o   20.722   6.2164   4.5732   9.5115   9.9853   11.492  -7.1963   16.947   22.295   8.6819   19.149   8.8993 3.145977 12.43271 
1 1 1   12   26   36 o   40.352   8.3412   29.576   11.361   20.241   12.229   88.470   30.715   28.083   9.1754   52.622   13.933 -24.53879 16.68245 
1 1 1   12   26   37 o   21.568   6.3730   6.3775   10.441   14.795   12.192 -16.7820   20.223   24.564   9.0846   18.572   8.9403 5.992716 12.74591 
1 1 1   12   26   38 o   30.363   8.4941   28.020   15.782   33.052   23.064   23.589   21.642   32.011   12.345   28.715   11.670 3.295937 16.98829 
1 1 1   12   27    0 o  136.488   2.2183  385.373   17.639  385.373   17.639  385.373   17.639  136.488   3.1372  136.488   3.1372 0.000000 0.000000 
1 1 1   12   27    1 o  112.879   2.2957  263.619   10.687  257.737   15.054  269.595   15.173  111.607   3.2704  114.151   3.2228 -2.544266 4.591485 
1 1 1   12   27    2 o  135.277   2.2080  378.579   12.318  383.412   17.407  373.730   17.435  136.145   3.0999  134.409   3.1451 1.736038 4.415987 
1 1 1   12   27    3 f   71.062   3.3590  105.029   9.7703   88.836   13.603  122.284   14.042   65.365   5.0457   76.760   4.4354 -11.39567 6.718033 
1 1 1   12   27    4 o  107.124   2.8627  236.880   11.821  240.955   20.902  234.964   14.334  107.695   4.7056  106.552   3.2616 1.143326 5.725456 
1 1 1   12   27    5 o   44.575   4.3610   40.338   7.3082   44.441   13.757   38.725   8.6261   45.996   7.2515   43.155   4.8464 2.840668 8.721924 
1 1 1   12   27    6 o   86.691   2.5971  154.874   9.2565  144.774   12.496  167.156   13.780   83.583   3.6247   89.800   3.7205 -6.216888 5.194280 
1 1 1   12   27    7 o   81.657   2.5943  137.253   8.6696  115.038   11.775  163.552   12.812   74.472   3.8335   88.841   3.4965 -14.36850 5.188589 
1 1 1   12   27    8 o   85.432   2.6245  152.903   9.1529  133.222   13.287  170.674   12.626   80.105   4.0217   90.759   3.3730 -10.65337 5.248939 
1 1 1   12   27    9 o   84.884   2.2984  150.482   7.8537  143.406   12.390  155.235   10.155   83.157   3.6124   86.611   2.8426 -3.454132 4.596723 
1 1 1   12   27   10 o  109.104   2.5232  246.749   11.330  225.213   15.799  269.546   16.255  104.187   3.6767  114.021   3.4566 -9.834030 5.046412 
1 1 1   12   27   11 o  128.880   3.3465  323.950   15.614  302.031   17.902  393.628   31.918  120.646   3.5976  137.115   5.6439 -16.46821 6.693040 
1 1 1   12   27   12 o   40.554   4.4649   35.158   7.1903   42.800   10.389   28.130   9.9620   45.198   5.5728   35.911   6.9774 9.287231 8.929704 
1 1 1   12   27   13 o   81.362   2.9385  139.912   9.7077  157.155   13.217  119.714   14.305   86.970   3.6846   75.753   4.5785 11.21712 5.876982 
1 1 1   12   27   14 f   96.933   3.1982  196.826   12.735  180.041   18.235  212.807   17.793   92.821   4.7631  101.045   4.2693 -8.224060 6.396420 
1 1 1   12   27   15 o  212.770   3.0491  938.655   24.734  957.767   44.637  930.187   29.712  213.885   5.0600  211.654   3.4036 2.231415 6.098175 
1 1 1   12   27   16 o  127.380   2.9792  338.217   15.649  331.190   22.132  345.244   22.131  126.042   4.2574  128.717   4.1686 -2.675201 5.958426 
1 1 1   12   27   17 o  158.557   2.4536  523.043   16.014  527.661   22.027  517.866   23.323  159.344   3.3517  157.771   3.5843 1.572876 4.907221 
1 1 1   12   27   18 o   47.863   3.9054   49.405   7.4733   43.457   11.677   53.532   9.7263   45.210   6.2622   50.516   4.6682 -5.306160 7.810767 
1 1 1   12   27   19 o   76.993   2.8633  124.406   9.0489  116.682   13.183  131.287   12.443   74.663   4.2811   79.322   3.8033 -4.658607 5.726500 
1 1 1   12   27   20 o   47.047   4.0429   49.158   7.4505   35.730   11.308   59.461   9.9043   40.853   6.7109   53.241   4.5104 -12.38711 8.085788 
1 1 1   12   27   21 o   73.077   3.0565  112.306   9.1657  106.769   13.447  117.111   12.527   71.320   4.5713   74.833   4.0586 -3.513336 6.113004 
1 1 1   12   27   22 o   44.832   4.1688   42.656   7.5370   42.980   11.990   42.445   9.6911   44.834   6.4842   44.831   5.2412 0.3025055E-02 8.337554 
1 1 1   12   27   23 o   31.058   5.7457   21.931   7.3609   21.963   11.545   21.909   9.5548   30.983   8.6851   31.133   7.5246 -0.1497841 11.49133 
1 1 1   12   27   24 o   61.542   3.7733   83.150   9.1745   68.387   14.390   93.262   11.909   56.481   6.1772   66.603   4.3352 -10.12283 7.546638 
1 1 1   12   27   25 o   19.819   5.3510   3.1798   6.5810   13.457   10.251  -4.0243   8.5831   25.018   8.4088   14.619   6.6199 10.39914 10.70191 
1 1 1   12   27   26 o   47.097   4.9878   47.695   9.4848   44.842   12.090   52.261   15.295   45.515   6.4403   48.679   7.6182 -3.163677 9.975655 
1 1 1   12   27   27 o   36.666   8.3913   28.902   10.640   27.862   11.253   37.672   32.670   34.718   8.0201   38.614   14.742 -3.895046 16.78260 
1 1 1   12   27   28 o   37.250   6.1317   30.031   9.0869   21.320   11.254   46.350   15.403   30.074   8.6252   44.427   8.7176 -14.35326 12.26332 
1 1 1   12   27   29 o   47.049   6.7339   53.183   12.569   55.156   18.752   51.573   16.937   47.610   9.8736   46.489   9.1592 1.120918 13.46775 
1 1 1   12   27   30 o   48.126   5.1536   50.573   10.037   44.139   12.773   60.959   16.229   44.423   6.9717   51.830   7.5918 -7.407856 10.30727 
1 1 1   12   27   31 o   24.638   6.2302   6.2086   8.6887  -4.6477   10.605   28.378   15.154   15.902   7.2620   33.373   10.125 -17.47092 12.46037 
1 1 1   12   27   32 o   24.223   6.6419   11.847   9.4501   14.092   11.817   7.8630   15.740   25.010   8.9900   23.435   9.7795 1.574883 13.28377 
1 1 1   12   27   33 o   25.944   6.5838   15.428   10.257   24.423   12.486  -3.2389   17.987   31.084   9.1348   20.804   9.4837 10.27975 13.16759 
1 1 1   12   27   34 o   23.833   6.6974   8.0695   9.4123   1.8093   11.311   22.165   16.972   18.479   8.0154   29.187   10.732 -10.70742 13.39487 
1 1 1   12   27   35 o   46.964   6.0837   56.259   10.610   59.507   13.003   49.788   18.353   51.236   6.1533   42.692   10.497 8.544136 12.16737 
1 1 1   12   27   36 o   25.225   8.2968   5.3765   10.997   3.3674   11.384   33.417   42.530   18.820   8.1022   31.629   14.481 -12.80898 16.59357 
1 1 1   12   27   37 o   68.094   4.9021  100.848   12.928   85.520   15.415  137.185   23.735   61.025   6.1245   75.164   7.6561 -14.13896 9.804298 
1 1 1   12   28    0 o   67.785   2.6866   95.939   10.546   95.939   10.546   95.939   10.546   67.785   3.7994   67.785   3.7994 0.000000 0.000000 
1 1 1   12   28    1 o   29.910   4.6382   19.156   5.7348   25.555   8.2964   13.300   7.9361   34.951   5.7552   24.869   7.2753 10.08144 9.276437 
1 1 1   12   28    2 o   79.276   2.5021  130.247   8.1704  139.669   11.702  121.286   11.413   82.082   3.4565   76.470   3.6185 5.611465 5.004145 
1 1 1   12   28    3 o   49.167   4.3452   49.513   8.6739   57.381   13.834   44.417   11.134   52.274   6.4165   46.060   5.8610 6.214214 8.690386 
1 1 1   12   28    4 o  146.574   3.9258  446.125   23.733   0.0000   0.0000  446.125   23.733  ?   ?   146.574   3.9258      ?      ? 
1 1 1   12   28    5 o   56.557   3.4341   70.879   7.4877   45.528   11.144   91.741   10.110   46.625   5.7950   66.489   3.6865 -19.86382 6.868264 
1 1 1   12   28    6 o   18.770   5.0114   5.0570   5.2568   7.8523   8.2853   3.1736   6.8010   20.878   7.5252   16.661   6.6203 4.217182 10.02285 
1 1 1   12   28    7 o   76.935   2.6872  122.804   8.5165  125.533   12.406  120.372   11.712   77.732   3.8695   76.137   3.7298 1.594734 5.374428 
1 1 1   12   28    8 o   53.626   3.2617   57.750   6.9959   82.420   11.009   41.040   9.0605   62.925   4.2419   44.328   4.9558 18.59695 6.523301 
1 1 1   12   28    9 o   52.178   3.9874   64.111   7.3258   33.410   11.035   88.302   9.7957   39.156   7.0943   65.200   3.6427 -26.04422 7.974897 
1 1 1   12   28   10 o  102.447   2.4609  216.249   10.339  233.396   15.669  203.029   13.758  105.994   3.5843   98.900   3.3729 7.094185 4.921795 
1 1 1   12   28   11 o   67.859   3.9564   96.500   11.034   94.184   14.914   99.300   16.401   67.005   5.3965   68.713   5.7872 -1.708099 7.912893 
1 1 1   12   28   12 o   37.493   5.7669   31.230   8.6706   28.368   12.241   34.111   12.283   35.663   8.4517   39.323   7.8483 -3.659721 11.53370 
1 1 1   12   28   13 o   34.665   8.7460   22.387   9.9119   22.851   10.218   14.990   40.824   32.092   7.7966   37.238   15.658 -5.146709 17.49201 
1 1 1   12   28   14 o   97.036   3.1376  188.234   11.871  172.453   14.341  222.595   21.161   91.012   3.8204  103.059   4.9782 -12.04761 6.275190 
1 1 1   12   28   15 o   41.782   6.2288   43.708   8.0001   30.477   19.672   46.330   8.7569   36.526   11.611   47.038   4.5138 -10.51117 12.45753 
1 1 1   12   28   16 o   48.346   5.3242   62.062   8.4200   30.029   15.067   76.609   10.153   36.145   9.8416   60.547   4.0659 -24.40252 10.64843 
1 1 1   12   28   17 o   70.136   3.4567   99.410   9.3045  114.540   17.027   92.968   11.110   73.577   5.6110   66.695   4.0388 6.881477 6.913413 
1 1 1   12   28   18 o   61.209   3.1504   78.877   7.8512   76.498   12.002   80.656   10.380   60.311   4.8249   62.106   4.0524 -1.795437 6.300898 
1 1 1   12   28   19 o   37.924   4.4484   29.711   6.6631   39.831   10.753   23.403   8.4895   43.284   6.0231   32.565   6.5478 10.71912 8.896714 
1 1 1   12   28   20 f   94.945   2.8161  187.021   10.967  162.013   14.859  216.948   16.255   87.990   4.0945  101.900   3.8675 -13.91048 5.632271 
1 1 1   12   28   21 o   51.517   3.7318   56.931   7.8259   49.748   11.502   63.121   10.678   48.318   5.7718   54.716   4.7319 -6.398052 7.463543 
1 1 1   12   28   22 o   24.848   5.5837   12.174   7.4605   22.244   10.074  -0.0541   11.102   31.279   7.8278   18.417   7.9645 12.86247 11.16731 
1 1 1   12   28   23 o   35.752   5.7094   28.561   8.2693   21.118   11.024   38.136   12.504   30.341   8.4806   41.162   7.6466 -10.82108 11.41887 
1 1 1   12   28   24 f   15.847   4.9830 -12.1442   7.6210   5.7550   10.828 -29.7174   10.729   20.741   8.3159   10.952   5.4927 9.788219 9.966097 
1 1 1   12   28   25 o   76.521   3.6360  118.185   11.088  100.830   13.692  151.262   18.902   68.937   4.8154   84.105   5.4491 -15.16801 7.271911 
1 1 1   12   28   26 o   37.434   5.7715   33.025   8.5421   35.046   11.081   30.065   13.411   39.366   7.0850   35.502   9.1128 3.864388 11.54296 
1 1 1   12   28   27 o   73.705   3.6945  114.459   11.009  106.130   14.036  127.772   17.745   70.502   4.8270   76.908   5.5943 -6.405914 7.388912 
1 1 1   12   28   28 o   32.217   7.6242   25.889   10.319   27.661   11.004   12.978   29.700   34.328   7.9315   30.105   13.023 4.223055 15.24839 
1 1 1   12   28   29 o   31.431   6.6746   23.007   9.0497   18.778   11.215   30.902   15.322   27.970   8.7508   34.892   10.081 -6.922689 13.34916 
1 1 1   12   28   30 o   16.900   5.6916 -16.7244   11.284 -34.5565   18.614  -6.3647   14.188   15.767   7.7946   18.033   8.2958 -2.266035 11.38317 
1 1 1   12   28   31 o   29.378   6.7399   21.632   9.2493   23.016   11.479   19.070   15.617   30.585   8.6908   28.170   10.304 2.414913 13.47979 
1 1 1   12   28   32 o   26.880   6.7710   15.588   9.3530   9.4859   11.696   26.414   15.578   22.183   8.7236   31.577   10.358 -9.394295 13.54202 
1 1 1   12   28   33 o   24.192   6.7239   12.074   9.3226   11.146   11.271   14.085   16.587   22.809   8.6709   25.576   10.279 -2.767359 13.44780 
1 1 1   12   28   34 o   37.858   7.0080   37.785   10.904   33.684   14.046   44.006   17.300   35.709   9.4060   40.007   10.391 -4.298176 14.01598 
1 1 1   12   28   35 o   36.054   7.9159   38.297   11.433   38.324   12.288   38.128   31.182   39.260   7.8630   32.849   13.741 6.410583 15.83173 
1 1 1   12   29    0 o  105.031   2.3036  228.823   14.082  228.823   14.082  228.823   14.082  105.031   3.2578  105.031   3.2578 0.000000 0.000000 
1 1 1   12   29    1 o   44.777   3.4032   41.971   6.1849   52.095   8.9624   32.765   8.5461   49.997   4.3462   39.557   5.2381 10.43964 6.806416 
1 1 1   12   29    2 o   57.758   2.9296   69.532   6.9328   80.167   9.9540   59.512   9.6614   62.085   3.8873   53.431   4.3841 8.654186 5.859288 
1 1 1   12   29    3 o   64.260   3.7273   85.746   9.7336   90.868   15.300   82.264   12.616   65.785   5.6389   62.735   4.8758 3.050781 7.454559 
1 1 1   12   29    4 o   50.627   3.4398   55.321   6.9356   44.501   10.586   63.457   9.1802   46.041   5.5748   55.213   4.0313 -9.171429 6.879647 
1 1 1   12   29    5 o   21.225   5.2151   7.9984   5.4389   11.846   9.1063   5.8647   6.7813   23.982   7.9218   18.468   6.7847 5.513954 10.43014 
1 1 1   12   29    6 o   98.998   2.5037  203.685   10.207  189.410   14.344  218.329   14.529   95.461   3.6431  102.535   3.4355 -7.073303 5.007479 
1 1 1   12   29    7 o   85.808   2.5843  152.368   9.1241  163.301   13.483  143.132   12.393   88.629   3.6884   82.987   3.6207 5.641357 5.168550 
1 1 1   12   29    8 o   88.469   2.4604  162.785   8.9601  151.363   12.687  174.149   12.655   85.346   3.6043   91.592   3.3501 -6.246117 4.920808 
1 1 1   12   29    9 o   53.743   3.2258   61.750   6.9748   50.455   10.397   70.994   9.4054   49.077   5.1362   58.408   3.9043 -9.330528 6.451695 
1 1 1   12   29   10 o   25.722   5.1339   14.636   5.5888   13.033   9.3087   15.539   6.9885   24.857   7.9963   26.587   6.4410 -1.729082 10.26777 
1 1 1   12   29   11 o   32.146   5.5446   21.621   7.4512   13.248   9.6464   34.007   11.732   25.049   8.1476   39.242   7.5225 -14.19349 11.08921 
1 1 1   12   29   12 o   50.867   3.6283   59.550   6.8531   33.118   10.274   80.739   9.1986   39.471   6.3109   62.263   3.5820 -22.79218 7.256623 
1 1 1   12   29   13 o   30.736   4.8733   22.661   6.4658   8.6716   10.044   32.560   8.4491   22.165   8.2362   39.306   5.2117 -17.14158 9.746651 
1 1 1   12   29   14 o  115.097   2.4067  276.114   11.409  267.733   16.410  283.957   15.874  113.370   3.5094  116.824   3.2944 -3.453850 4.813461 
1 1 1   12   29   15 o   40.580   5.0449   36.574   8.0917   40.448   10.838   31.695   12.163   43.624   6.0238   37.535   8.0944 6.089054 10.08983 
1 1 1   12   29   16 o   31.195   5.7957   20.373   8.1047   9.4161   10.743   34.848   12.348   22.922   8.5177   39.467   7.8619 -16.54442 11.59139 
1 1 1   12   29   17 o   57.794   4.4602   71.736   10.443   68.112   16.111   74.362   13.714   56.328   6.9348   59.260   5.6108 -2.931644 8.920364 
1 1 1   12   29   18 o   19.190   5.5681   4.5173   6.0949  -4.9466   15.009   6.3860   6.6695   19.727   8.8593   18.654   6.7474 1.072912 11.13612 
1 1 1   12   29   19 o   93.791   2.6571  184.863   10.208  175.424   15.114  192.778   13.841   91.489   4.0054   96.093   3.4924 -4.603439 5.314158 
1 1 1   12   29   20 o   23.383   5.5033   11.593   6.1228   10.860   9.9409   12.041   7.7719   23.298   8.2592   23.469   7.2754 -0.1703148 11.00663 
1 1 1   12   29   21 o   39.497   4.5202   31.386   6.9337   45.883   11.899   23.933   8.5320   46.198   6.2448   32.796   6.5370 13.40164 9.040441 
1 1 1   12   29   22 o   46.319   4.9706   47.046   9.1510   37.714   12.459   57.978   13.484   40.819   7.6825   51.820   6.3092 -11.00123 9.941151 
1 1 1   12   29   23 o   22.120   4.4854   7.1006   6.5159 -19.2171   10.757   22.355   8.1894   12.638   6.1825   31.602   6.5001 -18.96407 8.970740 
1 1 1   12   29   24 o   15.046   4.7982  -3.2511   6.2113  -6.0272   10.082  -1.5526   7.8857   15.236   7.0033   14.856   6.5609 0.3803968 9.596407 
1 1 1   12   29   25 o   15.701   4.8398  -2.9754   6.4626 -13.5219   10.078   4.3909   8.4223   13.141   6.3223   18.260   7.3297 -5.119078 9.679685 
1 1 1   12   29   26 o   17.742   5.2536   2.5563   6.4189   1.7525   9.8223   3.1554   8.4801   17.903   7.6117   17.581   7.2432 0.3218365 10.50724 
1 1 1   12   29   27 o   33.634   5.8762   25.347   8.3363   15.320   10.764   40.370   13.177   25.787   8.6169   41.480   7.9918 -15.69330 11.75241 
1 1 1   12   29   28 o   21.599   5.9874   4.3136   8.1274  -3.6849   10.304   17.485   13.222   15.977   7.2424   27.222   9.5365 -11.24431 11.97487 
1 1 1   12   29   29 o   20.398   6.6125  -0.3484   9.9606   3.1608   10.641 -25.2001   28.317   18.896   7.9724   21.901   10.552 -3.004658 13.22510 
1 1 1   12   29   30 o   21.755   5.7924   6.6452   8.6340   18.020   10.794 -13.5616   14.387   27.203   8.5958   16.308   7.7666 10.89447 11.58485 
1 1 1   12   29   31 o   18.265   6.1912 -13.2017   11.803 -14.1870   22.490 -12.8272   13.866   20.542   9.7621   15.989   7.6173 4.552999 12.38231 
1 1 1   12   29   32 o   55.267   9.1203   82.995   13.274   80.807   13.931  104.566   43.736   60.285   5.6029   50.249   17.359 10.03608 18.24068 
1 1 1   12   29   33 o   21.723   7.0565   2.5018   11.173   4.0172   12.012  -7.2202   30.427   19.499   8.3570   23.946   11.373 -4.447083 14.11303 
1 1 1   12   29   34 o   47.493   8.0927   66.884   13.126   66.883   14.383   66.890   32.112   53.662   6.4985   41.323   14.823 12.33953 16.18532 
1 1 1   12   30    0 o  106.561   2.3077  235.588   14.313  235.588   14.313  235.588   14.313  106.561   3.2636  106.561   3.2636 0.000000 0.000000 
1 1 1   12   30    1 o   46.083   3.4400   45.561   6.2692   30.882   8.8481   60.359   8.8840   38.330   5.5969   53.836   4.0010 -15.50613 6.879951 
1 1 1   12   30    2 o   83.266   2.4638  144.060   8.4591  139.903   11.924  148.272   12.003   82.049   3.5235   84.482   3.4447 -2.432732 4.927548 
1 1 1   12   30    3 f   87.767   3.2968  163.150   11.739  146.539   17.708  176.174   15.680   83.602   5.1355   91.932   4.1354 -8.330223 6.593506 
1 1 1   12   30    4 o   41.936   3.9901   39.394   6.3435   28.553   9.6850   47.538   8.3947   36.141   6.7454   47.731   4.2643 -11.58958 7.980241 
1 1 1   12   30    5 o  143.494   2.4682  427.088   14.585  409.271   19.960  447.499   21.364  140.305   3.4493  146.683   3.5312 -6.377869 4.936317 
1 1 1   12   30    6 o   83.189   2.5752  144.943   8.7684  135.548   12.963  152.868   11.905   80.631   3.8979   85.747   3.3663 -5.115509 5.150324 
1 1 1   12   30    7 o  167.165   2.6639  576.146   18.098  547.359   23.420  618.820   28.515  162.161   3.5017  172.170   4.0155 -10.00949 5.327868 
1 1 1   12   30    8 o   40.508   3.7981   35.608   6.1140   30.089   9.5625   39.424   7.9517   37.633   6.1607   43.383   4.4439 -5.750061 7.596268 
1 1 1   12   30    9 o   35.333   4.5273   29.851   6.0160   17.714   9.5579   37.815   7.7420   28.178   7.9036   42.488   4.4180 -14.30926 9.054575 
1 1 1   12   30   10 o   77.924   3.2951  119.310   9.9135  105.994   11.815  150.976   18.221   71.222   4.0222   84.625   5.2204 -13.40240 6.590223 
1 1 1   12   30   11 o   61.365   3.5536   76.259   8.5256   70.339   10.341   88.824   15.065   57.952   4.3263   64.777   5.6388 -6.824600 7.107245 
1 1 1   12   30   12 o   71.086   3.1740  101.036   8.9468   89.301   10.984  124.171   15.422   65.345   4.0755   76.827   4.8670 -11.48112 6.348056 
1 1 1   12   30   13 o   56.557   6.9340   82.043   10.062   85.561   10.814   59.344   27.469   63.954   4.0998   49.161   13.248 14.79276 13.86800 
1 1 1   12   30   14 o   63.103   3.4273   88.531   8.1977   70.103   13.845   98.480   10.173   57.476   5.8402   68.729   3.5887 -11.25300 6.854648 
1 1 1   12   30   15 o   42.181   4.2689   41.872   6.4723   28.548   10.726   49.500   8.1164   35.721   7.5185   48.642   4.0457 -12.92122 8.537826 
1 1 1   12   30   16 o   33.591   4.6548   24.724   5.9752   24.561   10.321   24.807   7.3282   32.948   7.7285   34.233   5.1902 -1.285027 9.309613 
1 1 1   12   30   17 o   73.513   3.0084  118.451   8.6775   81.039   12.699  151.216   11.885   61.899   4.9744   85.127   3.3850 -23.22844 6.016853 
1 1 1   12   30   18 o   74.859   5.7894  124.634   15.158  125.724   17.449  121.279   30.607   76.875   5.5031   72.843   10.187 4.031555 11.57870 
1 1 1   12   30   19 o   22.711   6.0916   6.7795   9.0426 -10.1404   14.882   16.683   11.385   18.063   8.3754   27.360   8.8478 -9.297674 12.18321 
1 1 1   12   30   20 o   92.607   2.7945  180.459   10.507  141.415   14.519  223.389   15.224   81.916   4.2974  103.298   3.5734 -21.38259 5.588941 
1 1 1   12   30   21 o   39.684   4.7410   38.552   6.9541   20.939   10.727   51.318   9.1330   30.093   8.3494   49.276   4.4938 -19.18273 9.481904 
1 1 1   12   30   22 o   56.591   3.5611   70.871   7.9799   53.864   12.005   84.333   10.681   49.957   5.8264   63.225   4.0960 -13.26805 7.122108 
1 1 1   12   30   23 o   28.840   5.5136   20.510   6.9108   12.345   11.697   24.889   8.5657   24.445   8.9212   33.236   6.4815 -8.791006 11.02713 
1 1 1   12   30   24 o   67.140   3.3064   97.602   8.9903   79.515   13.002  114.174   12.445   60.834   5.1819   73.447   4.1083 -12.61306 6.612861 
1 1 1   12   30   25 o   46.808   4.0839   47.608   7.6657   48.266   12.380   47.199   9.7622   46.777   6.4170   46.840   5.0532 -0.6293488E-01 8.167800 
1 1 1   12   30   26 o   59.863   3.5503   79.897   8.4468   63.423   12.812   92.563   11.234   53.786   5.7755   65.941   4.1306 -12.15487 7.100583 
1 1 1   12   30   27 o   49.784   4.1480   54.719   8.2156   53.403   13.375   55.517   10.411   48.871   6.6357   50.696   4.9791 -1.825859 8.296003 
1 1 1   12   30   28 o   40.749   5.0370   40.115   7.8971   24.662   11.461   54.084   10.897   31.699   8.5639   49.800   5.3052 -18.10153 10.07396 
1 1 1   12   30   29 o   50.407   7.7158   73.064   12.303   76.014   13.488   58.441   30.025   58.668   5.5740   42.147   14.390 16.52079 15.43162 
1 1 1   12   30   30 o   28.839   7.7409   21.149   11.534   22.840   12.584   12.264   28.840   29.835   9.2590   27.843   12.408 1.991833 15.48181 
1 1 1   12   30   31 o   30.352   9.1724   24.511   20.605   31.583   28.408   16.661   29.930   32.188   13.259   28.516   12.678 3.672012 18.34476 
1 1 1   12   30   32 o   26.344   8.3160   11.922   18.807   19.758   23.423  -2.2986   31.553   27.882   11.800   24.805   11.721 3.077456 16.63194 
1 1 1   12   30   33 o   25.002   8.1202   6.5588   18.833   8.4430   23.794   3.3985   30.815   24.718   11.123   25.287   11.834 -0.5686550 16.24037 
1 1 1   12   31    0 o   63.069   2.7645   83.472   10.080   83.472   10.080   83.472   10.080   63.069   3.9096   63.069   3.9096 0.000000 0.000000 
1 1 1   12   31    1 o   42.900   3.3963   38.677   6.0019   38.471   8.6937   38.864   8.2963   42.770   4.9283   43.030   4.6746 -0.2599907 6.792647 
1 1 1   12   31    2 o   34.625   4.0614   25.574   5.6146   31.077   8.2956   20.922   7.6270   38.392   5.2389   30.858   6.2076 7.533499 8.122896 
1 1 1   12   31    3 o   46.527   4.4440   45.890   8.3134   46.986   13.386   45.201   10.607   46.819   6.9322   46.235   5.5623 0.5845070 8.887908 
1 1 1   12   31    4 o   66.490   2.9056   89.933   7.8074  104.933   12.670   80.752   9.9130   70.785   4.3399   62.194   3.8645 8.590782 5.811112 
1 1 1   12   31    5 o   43.143   3.4329   38.948   6.0635   40.651   9.2274   37.654   8.0440   43.927   5.0931   42.359   4.6042 1.568054 6.865737 
1 1 1   12   31    6 o   30.517   4.7008   20.418   5.6737   21.866   8.9042   19.429   7.3617   31.335   7.0592   29.700   6.2096 1.634762 9.401654 
1 1 1   12   31    7 o   39.255   4.4961   37.918   6.4769   13.006   9.3881   60.546   8.9473   24.696   8.0380   53.814   4.0312 -29.11780 8.992172 
1 1 1   12   31    8 o   48.025   3.4629   50.855   6.5168   35.763   9.7283   63.140   8.7772   41.069   5.7433   54.982   3.8705 -13.91352 6.925791 
1 1 1   12   31    9 o   84.418   2.8011  153.388   9.4397  125.234   14.406  174.575   12.497   77.255   4.5210   91.580   3.3085 -14.32437 5.602283 
1 1 1   12   31   10 o   66.296   3.6327   88.207   9.6468   74.852   12.015  112.437   16.183   59.645   4.8841   72.947   5.3788 -13.30243 7.265378 
1 1 1   12   31   11 o   17.428   5.3274  -0.6204   7.0693  -3.0341   10.024   1.7682   9.9714   16.443   7.3222   18.412   7.7402 -1.968872 10.65484 
1 1 1   12   31   12 o   30.907   6.0885   21.434   8.0371   18.692   10.786   24.857   12.051   28.832   8.4952   32.983   8.7241 -4.151272 12.17700 
1 1 1   12   31   13 o   59.913   5.3182   58.149   9.5840   50.481   10.232  112.968   27.359   48.850   5.0786   70.977   9.3457 -22.12724 10.63649 
1 1 1   12   31   14 o   42.140   5.6080   42.280   9.3231   20.822   13.430   62.239   12.953   30.282   9.5903   53.998   5.8158 -23.71640 11.21598 
1 1 1   12   31   15 o   35.859   5.3180   29.856   7.8390   41.989   10.855   16.633   11.332   44.318   5.9388   27.399   8.8235 16.91904 10.63593 
1 1 1   12   31   16 o   55.539   3.5878   66.487   7.5940   62.367   13.380   68.445   9.2235   53.942   6.0142   57.136   3.9139 -3.194679 7.175615 
1 1 1   12   31   17 o   24.931   4.6132   15.283   5.6267   0.5305   10.192   21.751   6.7485   17.870   7.6791   31.993   5.1143 -14.12328 9.226324 
1 1 1   12   31   18 o   48.163   3.5368   49.085   6.8206   50.064   11.095   48.490   8.6479   48.382   5.5598   47.944   4.3733 0.4385719 7.073688 
1 1 1   12   31   19 o   47.618   4.9857   53.615   7.8698   43.739   15.567   57.006   9.1213   43.251   9.0185   51.986   4.2541 -8.734638 9.971478 
1 1 1   12   31   20 o   46.190   5.6566   49.057   10.290   45.306   15.867   51.780   13.517   43.795   9.0821   48.585   6.7456 -4.789238 11.31312 
1 1 1   12   31   21 o   40.961   7.9912   28.937   10.158   23.351   10.834   69.539   29.209   31.511   8.2420   50.411   13.693 -18.90021 15.98238 
1 1 1   12   31   22 o   21.897   5.4803   9.8521   5.9427   9.9308   10.407   9.8140   7.2389   22.513   8.3800   21.281   7.0647 1.231844 10.96052 
1 1 1   12   31   23 o   30.594   5.4941   22.921   6.7723   18.135   11.989   25.164   8.2071   27.755   9.0859   33.433   6.1794 -5.678242 10.98813 
1 1 1   12   31   24 o   45.745   4.0061   45.884   7.4108   45.015   11.590   46.485   9.6386   45.106   6.2299   46.385   5.0382 -1.278950 8.012200 
1 1 1   12   31   25 o   51.101   3.9495   59.418   7.9181   45.526   12.187   69.565   10.416   45.178   6.5407   57.023   4.4287 -11.84537 7.898985 
1 1 1   12   31   26 o   21.129   6.0025   7.1789   8.0092   6.0580   11.499   8.2350   11.162   20.681   8.4673   21.577   8.5104 -0.8958778 12.00505 
1 1 1   12   31   27 o   53.108   4.6352   64.261   10.023   72.072   13.833   55.627   14.543   56.984   5.8858   49.231   7.1623 7.752876 9.270448 
1 1 1   12   31   28 o   40.685   5.8166   40.455   9.4195   39.041   13.049   41.994   13.612   39.948   8.1945   41.421   8.2573 -1.473640 11.63327 
1 1 1   12   31   29 o   23.020   7.6137  -5.7495   17.848  -0.6789   22.565 -14.2235   29.170   23.053   10.552   22.988   10.979 0.6432152E-01 15.22737 
1 1 1   12   31   30 o   35.817   10.044   48.897   25.133   13.298   47.347   62.864   29.656   29.634   14.107   41.999   14.301 -12.36476 20.08782 
1 1 1   12   31   31 o   24.198   7.8614  -0.9696   19.947   18.448   22.782 -64.7482   41.289   27.263   11.592   21.133   10.622 6.130274 15.72279 
1 1 1   12   32    0 f   81.350   2.4082  137.857   11.381  137.857   11.381  137.857   11.381   81.350   3.4057   81.350   3.4057 0.000000 0.000000 
1 1 1   12   32    1 o   51.511   2.9740   55.479   6.3147   57.986   9.0988   53.150   8.7709   52.635   4.1913   50.387   4.2205 2.248035 5.948027 
1 1 1   12   32    2 o   29.235   4.5603   19.070   5.4777   13.980   8.0606   23.437   7.4666   25.175   7.3228   33.296   5.4371 -8.121460 9.120591 
1 1 1   12   32    3 o   56.211   4.8560   74.571   9.7697   51.079   16.226   87.931   12.236   47.700   8.5621   64.722   4.5839 -17.02154 9.711944 
1 1 1   12   32    4 o   94.307   2.3531  185.153   9.1526  185.218   12.887  185.087   13.001   94.328   3.3123   94.287   3.3433 0.4166412E-01 4.706291 
1 1 1   12   32    5 o   78.932   2.4898  129.608   8.0845  143.255   11.696  117.124   11.187   82.927   3.4197   74.938   3.6196 7.988960 4.979507 
1 1 1   12   32    6 o   54.540   2.9777   61.953   6.6759   66.760   9.9506   58.018   9.0026   56.440   4.2746   52.640   4.1466 3.800026 5.955341 
1 1 1   12   32    7 o  105.793   2.5973  234.617   11.272  223.047   16.570  244.584   15.379  103.276   3.8900  108.310   3.4427 -5.034027 5.194630 
1 1 1   12   32    8 o   54.816   3.0854   64.830   6.7794   52.027   10.130   75.216   9.1236   49.637   4.9482   59.995   3.6871 -10.35844 6.170880 
1 1 1   12   32    9 o   77.703   3.1535  132.255   9.4164  143.872   11.721  111.107   15.814   83.032   3.4225   72.374   5.2977 10.65768 6.307077 
1 1 1   12   32   10 o   58.226   3.7895   72.713   8.2985   73.829   9.9403   70.148   15.074   59.328   4.0623   57.123   6.3983 2.205105 7.578923 
1 1 1   12   32   11 f  127.968   3.5672  334.639   15.192  326.547   16.962  367.462   34.161  125.138   3.2864  130.798   6.3324 -5.660294 7.134391 
1 1 1   12   32   12 o   82.300   2.9384  137.468   9.3640  129.067   11.279  156.105   16.799   78.610   3.4787   85.990   4.7367 -7.380035 5.876868 
1 1 1   12   32   13 o   67.527   4.9145   82.099   9.5129   76.216   10.134  125.718   27.595   60.237   4.0790   74.817   8.9426 -14.57922 9.828972 
1 1 1   12   32   14 o   46.955   4.2541   49.258   7.7008   53.786   9.6443   41.293   12.791   50.439   4.6360   43.471   7.1344 6.968040 8.508294 
1 1 1   12   32   15 o   61.946   3.4252   77.819   8.3809   69.896   10.254   93.761   14.546   57.579   4.3178   66.314   5.3183 -8.735546 6.850395 
1 1 1   12   32   16 o   57.174   3.6855   62.791   8.2328   48.339   9.9095   94.990   14.792   47.668   5.0404   66.680   5.3784 -19.01203 7.371086 
1 1 1   12   32   17 o   77.580   3.4054  123.707   10.694  105.899   13.624  152.293   17.261   70.620   4.6776   84.541   4.9504 -13.92167 6.810731 
1 1 1   12   32   18 f   18.311   5.0490   4.7160   4.8652   7.3181   9.8576   3.8781   5.5939   20.825   8.0599   15.797   6.0833 5.028510 10.09795 
1 1 1   12   32   19 o   41.159   4.7240   39.483   6.9333   33.647   12.589   42.023   8.3065   37.864   8.2909   44.453   4.5305 -6.589443 9.448005 
1 1 1   12   32   20 o   24.885   5.2478   14.616   5.6923   10.827   10.413   16.232   6.7980   23.029   8.4154   26.741   6.2722 -3.711729 10.49565 
1 1 1   12   32   21 o   29.229   6.3853   18.694   7.7087   25.530   15.066   16.269   8.9720   32.066   10.158   26.392   7.7397 5.674545 12.77058 
1 1 1   12   32   22 o   62.651   5.6169  107.404   10.251   62.733   20.988  121.398   11.747   49.582   10.585   75.720   3.7615 -26.13853 11.23383 
1 1 1   12   32   23 o   52.090   4.3484   57.883   9.1623   45.651   11.829   76.225   14.485   45.351   6.3241   58.829   5.9700 -13.47812 8.696815 
1 1 1   12   32   24 o   31.700   6.2853   24.841   8.5813   22.560   12.272   27.024   12.004   30.207   9.1000   33.194   8.6723 -2.987251 12.57058 
1 1 1   12   32   25 o   13.632   4.6193 -12.7847   7.5058 -17.2816   10.848  -8.6552   10.396   12.832   6.2629   14.432   6.7917 -1.599664 9.238568 
1 1 1   12   32   26 o   60.066   7.2626   95.309   14.206   86.992   29.269   97.873   16.249   53.957   13.249   66.175   5.9534 -12.21788 14.52529 
1 1 1   12   32   27 o   25.217   7.5577   8.4679   11.288   23.726   24.839   4.4966   12.672   30.157   12.407   20.277   8.6339 9.879652 15.11545 
1 1 1   12   32   28 o   72.424   6.2111  132.712   15.826  121.920   30.323  136.752   18.553   66.815   11.004   78.034   5.7646 -11.21880 12.42217 
1 1 1   12   32   29 o   31.060   8.2161   20.110   11.717   52.180   26.926   12.618   13.014   38.559   13.601   23.562   9.2213 14.99765 16.43227 
1 1 1   12   32   30 o   22.508   7.5643   1.5952   11.917  -5.6556   41.983   2.2306   12.428   26.133   12.654   18.882   8.2916 7.250872 15.12857 
1 1 1   12   33    0 o   54.380   2.9440   62.583   9.2121   62.583   9.2121   62.583   9.2121   54.380   4.1634   54.380   4.1634 0.000000 0.000000 
1 1 1   12   33    1 o   50.910   3.0733   54.707   6.4134   47.867   9.0737   61.535   9.0661   47.655   4.6165   54.165   4.0582 -6.510071 6.146668 
1 1 1   12   33    2 o  136.602   2.7707  390.950   15.608  382.095   22.028  399.876   22.117  135.028   3.9554  138.176   3.8810 -3.147217 5.541399 
1 1 1   12   33    3 o   47.134   4.2996   45.329   7.2520   52.239   14.867   43.171   8.3074   48.976   7.3600   45.293   4.4470 3.683456 8.599122 
1 1 1   12   33    4 o   67.103   3.0447   96.399   8.2258  105.080   10.856   84.696   12.605   70.879   3.7137   63.328   4.8258 7.551178 6.089311 
1 1 1   12   33    5 o   46.516   3.2878   45.915   6.2600   42.434   9.2019   48.915   8.5410   44.789   4.9813   48.244   4.2924 -3.455063 6.575571 
1 1 1   12   33    6 f   50.600   3.3789   50.277   6.7826   69.557   11.707   40.537   8.3214   57.346   4.9498   43.853   4.6007 13.49292 6.757759 
1 1 1   12   33    7 o   32.957   4.2765   22.854   5.6192   29.413   8.8760   18.467   7.2591   37.106   5.7998   28.808   6.2862 8.297836 8.552973 
1 1 1   12   33    8 o   58.058   2.7574   69.803   6.5570   82.125   9.8727   60.078   8.7709   62.604   3.8236   53.512   3.9740 9.092655 5.514738 
1 1 1   12   33    9 o   43.282   4.4769   42.105   7.0794   44.218   8.5898   37.629   12.500   45.767   4.5506   40.797   7.7113 4.969822 8.953855 
1 1 1   12   33   10 o   50.148   3.6500   51.964   6.9106   49.796   8.1858   57.344   12.893   48.665   4.0783   51.630   6.0546 -2.964970 7.300004 
1 1 1   12   33   11 o   52.616   4.2682   59.722   9.2346   64.066   12.958   55.239   13.164   54.668   5.7469   50.564   6.3120 4.103603 8.536326 
1 1 1   12   33   12 o   40.239   5.3452   36.466   8.6182   43.948   12.282   29.207   12.096   44.977   6.6207   35.501   8.3935 9.475525 10.69042 
1 1 1   12   33   13 o   59.397   4.5106   75.910   10.884   80.232   17.098   72.965   14.113   60.585   6.8426   58.209   5.8787 2.376511 9.021127 
1 1 1   12   33   14 f   51.770   4.4480   58.352   9.4708   53.352   13.348   63.421   13.440   49.421   6.5483   54.118   6.0214 -4.696362 8.895952 
1 1 1   12   33   15 o   44.861   4.9951   44.501   9.2400   43.559   12.893   45.496   13.249   44.382   7.0434   45.340   7.0849 -0.9577370 9.990211 
1 1 1   12   33   16 o   21.912   6.0911   7.9339   8.0578   7.2413   11.823   8.5346   11.011   21.786   8.7056   22.039   8.5216 -0.2538795 12.18219 
1 1 1   12   33   17 o   74.726   3.6408  119.812   11.214  116.350   15.534  123.579   16.205   73.619   5.1161   75.833   5.1813 -2.214424 7.281506 
1 1 1   12   33   18 o   55.007   4.4603   67.191   9.9880   75.862   13.797   57.644   14.478   59.107   5.6597   50.907   6.8953 8.200047 8.920572 
1 1 1   12   33   19 o   55.360   3.7999   63.102   8.0629   57.731   9.5926   76.030   14.883   51.975   4.4748   58.744   6.1426 -6.768532 7.599723 
1 1 1   12   33   20 o   65.812   4.0055   94.066   10.634   70.333   14.397  122.559   15.774   56.369   6.1925   75.254   5.0823 -18.88535 8.011029 
1 1 1   12   33   21 o   47.805   7.4965   57.005   12.162   56.218   13.615   60.115   27.057   50.172   6.5794   45.438   13.472 4.734066 14.99296 
1 1 1   12   33   22 o   30.811   6.7339   24.461   9.7713   16.547   15.721   29.443   12.473   27.022   10.248   34.600   8.7383 -7.577818 13.46785 
1 1 1   12   33   23 o   38.886   8.0671   40.234   12.385   44.237   26.856   39.152   13.958   37.953   13.562   39.819   8.7391 -1.865467 16.13411 
1 1 1   12   33   24 o   29.016   7.7429   7.5117   10.779   51.167   25.781  -1.7362   11.866   40.459   13.328   17.574   7.8858 22.88512 15.48572 
1 1 1   12   33   25 o   44.222   7.6407   54.918   12.338   48.980   27.362   56.434   13.822   38.813   13.709   49.631   6.7525 -10.81830 15.28137 
1 1 1   12   33   26 o   30.143   7.7429   24.658   11.647   23.007   24.501   25.140   13.238   29.467   12.241   30.820   9.4854 -1.352806 15.48580 
1 1 1   12   33   27 o   25.923   7.6287   11.669   11.456   29.056   24.407   6.7571   12.973   30.860   12.446   20.985   8.8257 9.875530 15.25742 
1 1 1   12   33   28 o   23.439   7.8330  -4.3922   19.994   0.8049   26.535 -11.2184   30.411   23.857   11.103   23.022   11.052 0.8354626 15.66610 
1 1 1   12   34    0 o   13.554   5.4946   5.1191   6.8940   5.1191   6.8940   5.1191   6.8940   13.554   7.7705   13.554   7.7705 0.000000 0.000000 
1 1 1   12   34    1 o  114.329   2.2353  272.697   10.539  265.543   14.810  280.035   14.999  112.801   3.1833  115.857   3.1389 -3.056175 4.470589 
1 1 1   12   34    2 o   53.833   3.2211   62.737   6.9412   53.255   10.665   69.706   9.1427   50.031   5.1683   57.636   3.8460 -7.604561 6.442278 
1 1 1   12   34    3 o   99.648   2.5549  210.189   10.308  194.689   15.827  221.607   13.584   96.257   3.9866  103.038   3.1964 -6.781349 5.109753 
1 1 1   12   34    4 o   29.034   5.0833   19.179   6.0535   19.954   8.3094   18.302   8.8370   29.722   6.9095   28.347   7.4579 1.375019 10.16665 
1 1 1   12   34    5 o   31.289   4.4251   23.368   5.5533   11.651   8.3142   32.807   7.4620   23.189   7.5651   39.390   4.5931 -16.20068 8.850255 
1 1 1   12   34    6 o   40.578   3.4416   34.394   5.7096   41.336   8.6615   29.059   7.5928   44.170   4.7545   36.987   4.9772 7.182858 6.883183 
1 1 1   12   34    7 o  100.189   3.0285  209.819   11.895  205.719   14.641  217.781   20.403   99.095   3.5823  101.282   4.8842 -2.186935 6.057096 
1 1 1   12   34    8 o   29.318   5.8147   17.594   8.1505   33.354   12.405   5.6241   10.811   38.031   8.1535   20.604   8.2924 17.42762 11.62946 
1 1 1   12   34    9 o   57.910   4.1261   71.654   9.8057   65.841   13.092   79.081   14.799   55.299   5.7402   60.520   5.9287 -5.220528 8.252254 
1 1 1   12   34   10 o  105.101   3.2173  233.284   13.911  251.046   20.579  218.336   18.878  108.743   4.5883  101.460   4.5112 7.283134 6.434529 
1 1 1   12   34   11 o   55.033   4.2036   65.747   9.5183   67.000   13.103   64.348   13.849   55.695   5.7043   54.370   6.1760 1.324844 8.407192 
1 1 1   12   34   12 o   51.692   6.9094   91.485   12.770  111.722   14.406   17.243   27.592   72.353   4.8273   31.030   12.948 41.32375 13.81882 
1 1 1   12   34   13 o   28.294   6.3669   19.151   9.2220   5.7667   15.276   26.826   11.568   22.902   9.6016   33.687   8.3642 -10.78443 12.73383 
1 1 1   12   34   14 o   30.574   6.3012   22.180   8.4728   25.895   12.339   18.866   11.655   32.839   8.8916   28.308   8.9307 4.530706 12.60232 
1 1 1   12   34   15 o   39.337   5.6278   35.975   9.0063   21.660   12.324   52.383   13.194   29.996   9.1377   48.677   6.5720 -18.68083 11.25563 
1 1 1   12   34   16 o   23.668   6.2237   11.460   8.2362   7.9513   12.008   14.578   11.318   21.977   8.7765   25.358   8.8266 -3.381207 12.44732 
1 1 1   12   34   17 o   50.601   4.6220   57.122   9.6379   57.817   13.422   56.382   13.848   51.009   6.3797   50.192   6.6895 0.8161545 9.243942 
1 1 1   12   34   18 o   40.995   5.7228   40.668   9.3827   51.763   12.978   28.520   13.581   48.179   6.5312   33.811   9.3992 14.36726 11.44555 
1 1 1   12   34   19 o   22.787   6.5826   7.3372   10.531 -20.4082   22.560   15.068   11.908   19.966   9.5675   25.608   9.0436 -5.641968 13.16525 
1 1 1   12   34   20 o   19.171   6.1729  -2.3163   10.016 -27.4849   23.209   3.4444   11.103   19.115   9.2914   19.226   8.1295 -0.1105747 12.34578 
1 1 1   12   34   21 f   22.512   7.1669   0.3771   10.362   14.143   25.701  -2.2947   11.323   27.959   12.105   17.065   7.6766 10.89396 14.33370 
1 1 1   12   34   22 o   44.677   7.6230   55.338   12.538   50.139   26.761   56.800   14.192   39.631   13.585   49.722   6.9206 -10.09016 15.24602 
1 1 1   12   34   23 o   53.065   7.3127   73.392   13.685   74.277   26.757   73.078   15.926   49.760   12.922   56.370   6.8499 -6.609600 14.62546 
1 1 1   12   34   24 o   37.990   7.5704   43.376   12.169   32.198   25.727   46.598   13.811   32.370   12.872   43.609   7.9724 -11.23897 15.14078 
1 1 1   12   34   25 o   52.812   7.4068   73.675   13.644   80.722   27.516   71.377   15.712   50.440   13.107   55.185   6.9030 -4.744164 14.81350 
1 1 1   12   34   26 o   21.808   7.0346   0.3769   11.694   12.998   24.497  -3.3485   13.309   25.995   11.518   17.621   8.0799 8.373774 14.06926 
1 1 1   12   35    0 o   40.068   3.6658   35.311   8.1722   35.311   8.1722   35.311   8.1722   40.068   5.1842   40.068   5.1842 0.000000 0.000000 
1 1 1   12   35    1 o  107.558   2.6808  244.637   11.779  253.308   15.790  233.758   17.688  109.884   3.4841  105.230   4.0753 4.654015 5.361638 
1 1 1   12   35    2 o   23.684   4.9773   12.694   5.2014   11.817   8.0085   13.334   6.8404   23.105   7.4152   24.264   6.6415 -1.159031 9.954664 
1 1 1   12   35    3 o   51.738   5.1164   65.164   8.0880   51.047   17.461   69.020   9.1261   46.238   9.4745   57.238   3.8657 -11.00067 10.23283 
1 1 1   12   35    4 o   36.142   4.5361   31.246   6.2582   42.080   8.4225   17.891   9.3510   44.494   4.5896   27.790   7.8256 16.70356 9.072184 
1 1 1   12   35    5 f   50.177   2.9742   53.309   6.1513   51.959   8.7788   54.611   8.6218   49.525   4.2978   50.830   4.1126 -1.304874 5.948465 
1 1 1   12   35    6 o   35.223   4.9943   26.272   6.4141   32.051   12.503   24.207   7.4723   36.908   8.4019   33.538   5.4019 3.369972 9.988606 
1 1 1   12   35    7 o  121.640   2.9850  317.409   14.764  277.574   21.810  351.108   20.060  114.177   4.6313  129.102   3.7673 -14.92508 5.970066 
1 1 1   12   35    8 o   58.138   3.8876   72.907   9.3192   71.110   12.993   74.810   13.375   57.405   5.4875   58.870   5.5083 -1.464386 7.775269 
1 1 1   12   35    9 o   53.553   4.3823   62.285   9.6468   56.717   13.049   68.996   14.325   50.924   6.2128   56.182   6.1822 -5.258404 8.764627 
1 1 1   12   35   10 o   25.685   6.1773   14.078   8.0025   20.503   11.954   8.8592   10.773   29.342   9.0108   22.029   8.4523 7.312773 12.35460 
1 1 1   12   35   11 o   72.273   3.6779  113.162   10.899  102.420   15.684  123.196   15.158   68.733   5.5324   75.813   4.8476 -7.080284 7.355737 
1 1 1   12   35   12 o   31.162   7.7685   23.854   11.709   24.930   13.474   20.535   23.662   31.796   9.5253   30.528   12.275 1.267336 15.53693 
1 1 1   12   35   13 o   27.073   7.0891   13.896   9.5853   25.620   18.480   9.5813   11.211   31.752   11.260   22.394   8.6154 9.358641 14.17827 
1 1 1   12   35   14 o   56.807   4.4346   71.311   10.360   74.750   15.367   68.445   14.027   57.957   6.4285   55.657   6.1106 2.300732 8.869294 
1 1 1   12   35   15 o   18.508   6.1380  -8.7652   9.4107  -0.3515   20.175 -11.1048   10.639   22.924   10.285   14.092   6.7021 8.831880 12.27591 
1 1 1   12   35   16 o   21.691   6.7365  -3.2538   9.5860   17.428   21.020  -8.6842   10.771   28.561   11.539   14.821   6.9552 13.73977 13.47297 
1 1 1   12   35   17 o   27.332   7.2852   13.496   9.7003   28.733   20.483   9.0910   11.014   32.756   11.828   21.908   8.5081 10.84773 14.57040 
1 1 1   12   35   18 o   50.110   7.2216   60.937   13.070   72.662   25.662   56.830   15.187   50.657   12.386   49.563   7.4294 1.093857 14.44315 
1 1 1   12   35   19 o   25.214   6.9073   14.350   10.590  -4.9435   22.988   19.547   11.931   22.513   10.429   27.915   9.0604 -5.402241 13.81468 
1 1 1   12   35   20 o   21.603   7.2351 -12.6549   17.276  -5.5631   22.557 -22.7180   26.870   22.140   10.282   21.066   10.182 1.074001 14.47024 
1 1 1   12   35   21 o   30.481   9.1805   24.051   12.491   0.0000   0.0000   24.051   12.491  ?   ?    30.481   9.1805      ?      ? 
1 1 1   12   35   22 o   20.086   6.1798   0.8000   10.711 -37.4541   23.034   11.354   12.099   17.282   8.5662   22.890   8.9096 -5.608145 12.35965 
1 1 1   12   35   23 o   22.703   6.9163   8.3781   11.057  -2.1553   23.625   11.332   12.512   22.576   10.497   22.830   9.0084 -0.2537022 13.83258 
1 1 1   12   35   24 o   28.950   6.7790   24.792   11.758  -9.6095   24.437   35.155   13.413   21.384   10.166   36.516   8.9704 -15.13277 13.55801 
1 1 1   12   36    0 o   30.248   5.3606   22.733   8.1811   22.733   8.1811   22.733   8.1811   30.248   7.5810   30.248   7.5810 0.000000 0.000000 
1 1 1   12   36    1 o   16.160   4.5939   2.0009   4.9223   6.8952   7.2181  -2.2539   6.7299   19.030   6.9985   13.290   5.9528 5.740510 9.187742 
1 1 1   12   36    2 o   46.312   3.2119   46.069   6.0419   36.924   8.4987   55.415   8.5912   41.480   4.9677   51.143   4.0729 -9.663681 6.423844 
1 1 1   12   36    3 o   47.773   3.4518   49.149   6.5951   47.966   10.626   49.891   8.4110   47.069   5.4737   48.477   4.2067 -1.408585 6.903507 
1 1 1   12   36    4 o   91.450   2.2472  175.833   8.4433  181.074   11.555  169.829   12.368   92.993   3.0126   89.906   3.3353 3.087357 4.494494 
1 1 1   12   36    5 o   50.499   4.0071   58.597   7.3582   48.117   13.382   63.138   8.8095   46.383   6.9951   54.615   3.9108 -8.232376 8.014104 
1 1 1   12   36    6 o   85.821   2.9276  151.839   9.6608  169.640   17.490  144.023   11.589   88.917   4.7693   82.725   3.3966 6.191483 5.855136 
1 1 1   12   36    7 o   55.734   4.4103   68.658   10.133   66.313   14.311   71.014   14.350   54.717   6.3416   56.751   6.1308 -2.034348 8.820600 
1 1 1   12   36    8 o   85.103   4.8003  176.815   14.886  207.931   18.537  120.301   24.982   98.499   4.5629   71.707   8.4469 26.79167 9.600550 
1 1 1   12   36    9 o   25.601   6.2850   15.027   8.2763   10.890   12.162   18.595   11.295   23.412   8.9812   27.791   8.7945 -4.379683 12.56999 
1 1 1   12   36   10 o   36.925   6.6803   30.487   9.7122   46.660   17.584   23.387   11.651   42.910   10.103   30.941   8.7428 11.96967 13.36050 
1 1 1   12   36   11 o   42.766   6.3491   47.540   10.341   34.753   18.104   53.733   12.599   36.269   11.081   49.264   6.2009 -12.99429 12.69810 
1 1 1   12   36   12 o   40.028   8.8183   44.892   15.929   44.722   20.232   45.169   25.835   40.718   11.527   39.338   13.348 1.379589 17.63651 
1 1 1   12   36   13 o   47.518   6.7668   57.681   11.612   51.270   21.930   60.178   13.689   43.119   11.929   51.917   6.3928 -8.798428 13.53368 
1 1 1   12   36   14 o   67.944   5.0113  104.308   12.875  107.840   23.368  102.769   15.428   67.433   8.4020   68.455   5.4643 -1.021767 10.02259 
1 1 1   12   36   15 o   17.034   5.7107  -9.4465   9.4170 -10.1365   18.237  -9.1956   10.996   19.312   9.0586   14.755   6.9562 4.557464 11.42134 
1 1 1   12   36   16 o   22.325   6.7989   6.0770   10.266   5.2033   20.476   6.3704   11.865   23.921   10.568   20.729   8.5569 3.192482 13.59782 
1 1 1   12   36   17 o   34.032   7.5903   27.091   10.921   46.117   21.171   20.192   12.749   39.868   11.939   28.196   9.3760 11.67207 15.18069 
1 1 1   12   36   18 o   28.826   7.5828   20.503   10.784   23.345   23.144   19.715   12.187   29.805   12.085   27.847   9.1629 1.957991 15.16558 
1 1 1   12   36   19 o   23.534   7.2339   5.3578   10.533   20.115   23.904   1.8025   11.733   28.498   11.982   18.571   8.1080 9.926619 14.46782 
1 1 1   12   36   20 o   37.590   9.1104   47.437   18.518   62.898   24.947   28.464   27.635   44.455   12.869   30.726   12.900 13.72899 18.22087 
1 1 1   12   36   21 o   26.583   9.3974   18.521   12.861   0.0000   0.0000   18.521   12.861  ?   ?    26.583   9.3974      ?      ? 
1 1 1   12   36   22 o   26.174   7.5309   7.9588   10.642   40.229   24.197   0.2195   11.850   34.502   12.791   17.847   7.9532 16.65567 15.06178 
1 1 1   12   37    0 o   36.972   5.8091   33.411   10.949   33.411   10.949   33.411   10.949   36.972   8.2153   36.972   8.2153 0.000000 0.000000 
1 1 1   12   37    1 f   40.741   4.3172   32.665   6.7376   48.583   12.773   26.528   7.9306   46.613   6.6440   34.868   5.5145 11.74457 8.634389 
1 1 1   12   37    2 f   50.525   3.6643   53.394   7.2411   61.617   12.741   49.471   8.8005   52.968   5.8322   48.083   4.4376 4.884892 7.328523 
1 1 1   12   37    3 o   56.039   3.5569   65.993   7.7331   73.643   13.740   62.446   9.3556   57.953   5.7483   54.125   4.1909 3.827354 7.113807 
1 1 1   12   37    4 o   24.067   4.9971   14.581   5.8789   2.5759   10.897   19.509   6.9821   18.819   8.0096   29.315   5.9774 -10.49655 9.994125 
1 1 1   12   37    5 o   29.085   7.0841   21.311   11.213   28.498   13.452   4.9454   20.298   33.792   9.3403   24.379   10.653 9.412971 14.16815 
1 1 1   12   37    6 o   93.557   3.8055  191.836   13.820  187.050   23.704  194.300   17.010   91.780   6.2620   95.335   4.3261 -3.555481 7.611029 
1 1 1   12   37    7 o   22.500   6.3873   8.7328   8.9812   6.0432   14.569   10.382   11.406   22.199   9.3453   22.802   8.7096 -0.6023216 12.77467 
1 1 1   12   37    8 o   49.353   5.2951   53.402   10.285   65.115   17.980   47.706   12.539   52.617   8.2851   46.089   6.5962 6.528667 10.59020 
1 1 1   12   37    9 o   49.415   5.8300   57.137   11.175   61.738   18.576   54.528   13.989   49.830   9.3830   49.000   6.9221 0.8303947 11.66000 
1 1 1   12   37   10 o   26.672   6.1536   4.4427   8.9105   40.097   16.799  -9.5156   10.511   39.054   10.286   14.291   6.7568 24.76294 12.30711 
1 1 1   12   37   11 o   30.795   6.3923   25.995   10.003   6.1885   17.421   35.738   12.219   23.160   9.9964   38.431   7.9699 -15.27195 12.78463 
1 1 1   12   37   12 o   26.424   11.451   11.480   23.044   0.0000   0.0000   11.480   23.044  ?   ?    26.424   11.451      ?      ? 
1 1 1   12   37   13 o   27.009   6.9192   18.461   10.102   8.4760   19.470   22.140   11.818   24.474   10.566   29.544   8.9365 -5.070063 13.83834 
1 1 1   12   37   14 o   35.097   7.2648   31.646   10.473   37.733   19.494   29.176   12.418   36.270   11.561   33.924   8.8002 2.345997 14.52963 
1 1 1   12   37   15 o   38.169   6.8810   30.718   11.183   69.579   20.519   14.296   13.339   51.507   10.019   24.832   9.4344 26.67474 13.76207 
1 1 1   12   37   16 o   26.945   6.8841   19.221   10.136   6.9388   20.379   23.258   11.683   23.905   10.553   29.985   8.8432 -6.079973 13.76817 
1 1 1   12   37   17 o   20.314   6.3059   2.0328   10.717 -21.2010   21.196   10.013   12.422   18.392   8.9260   22.235   8.9099 -3.842693 12.61190 
1 1 1   12   37   18 o   24.193   7.2442   9.1009   10.465   22.243   22.746   5.5725   11.786   28.471   11.808   19.914   8.3956 8.557095 14.48845 
1 1 1   12   37   19 o   29.776   7.9714   20.864   11.699   41.756   24.422   14.641   13.328   35.056   12.876   24.496   9.4009 10.56011 15.94274 
1 1 1   12   38    2 o   20.041   8.3261   5.3017   11.338   5.3017   11.338   0.0000   0.0000   20.041   8.3261  ?   ?       ?      ? 
1 1 1   12   38    3 o   50.433   7.3060   88.836   15.482  111.100   17.841   20.966   31.151   70.403   6.1443   30.462   13.257 39.94154 14.61195 
1 1 1   12   38    4 o   35.217   14.050   39.099   30.743   0.0000   0.0000   39.099   30.743  ?   ?    35.217   14.050      ?      ? 
1 1 1   12   38    5 o   35.248   7.2057   39.324   13.702   51.123   15.396  -5.5895   30.039   45.650   8.4898   24.846   11.645 20.80366 14.41148 
1 1 1   12   38    6 o   23.923   7.6757   2.7756   11.860   0.7905   12.831   14.419   31.075   19.041   8.3912   28.806   12.855 -9.764233 15.35138 
1 1 1   12   38    7 o   42.875   8.9442   51.852   15.182   48.730   17.180   62.986   32.442   43.278   9.8465   42.472   14.935 0.8060913 17.88845 
1 1 1   12   38    8 o   25.713   7.7875   11.919   13.911   16.415   15.415  -7.8094   32.292   26.371   10.113   25.056   11.845 1.314714 15.57496 
1 1 1   12   38    9 o   37.354   7.4015   44.770   15.489   62.458   18.046  -4.7159   30.184   49.833   9.1158   24.875   11.663 24.95865 14.80306 
1 1 1   12   38   10 o   44.698   6.3403   52.066   10.742   43.665   18.427   56.390   13.221   39.625   10.923   49.772   6.4403 -10.14711 12.68068 
1 1 1   12   38   11 o   42.483   6.5789   45.522   10.711   48.260   19.149   44.275   12.922   41.468   11.011   43.497   7.2027 -2.028522 13.15772 
1 1 1   12   38   12 o   48.593   7.0657   55.282   14.161   0.0000   0.0000   55.282   14.161  ?   ?    48.593   7.0657      ?      ? 
1 1 1   12   38   13 f   28.906   6.6603   23.671   10.292   6.1503   18.904   31.052   12.269   23.048   10.169   34.764   8.6036 -11.71652 13.32065 
1 1 1   12   38   14 o   23.871   6.5953   12.987   10.115  -3.9392   19.753   19.002   11.775   20.750   9.6315   26.991   9.0125 -6.240980 13.19055 
1 1 1   12   38   15 f   16.108   5.4365 -10.9254   9.7895 -31.5666   19.488  -3.9593   11.322   16.045   7.9397   16.171   7.4286 -0.1261463 10.87305 
1 1 1   12   38   16 f   21.584   6.6572   6.1045   10.241   5.2709   19.972   6.4019   11.929   22.896   10.255   20.273   8.4912 2.622828 13.31432 
1 1 1   12   39   12 o   47.679   16.146   95.713   37.798   0.0000   0.0000   95.713   37.798  ?   ?    47.679   16.146      ?      ? 
1 1 1   13    0    1 o  130.918   2.9004  354.577   22.099  354.577   22.099  354.577   22.099  130.918   4.1018  130.918   4.1018 0.000000 0.000000 
1 1 1   13    0    2 o  249.880   3.3292  1289.40   48.485  1289.40   48.485  1289.40   48.485  249.880   4.7082  249.880   4.7082 0.000000 0.000000 
1 1 1   13    0    3 o   59.403   3.7924   74.562   12.894   74.562   12.894   74.562   12.894   59.403   5.3633   59.403   5.3633 0.000000 0.000000 
1 1 1   13    0    4 o  248.406   3.3157  1274.24   48.003  1274.24   48.003  1274.24   48.003  248.406   4.6891  248.406   4.6891 0.000000 0.000000 
1 1 1   13    0    5 o  299.490   2.5799  1850.86   45.053  1850.86   45.053  1850.86   45.053  299.490   3.6485  299.490   3.6485 0.000000 0.000000 
1 1 1   13    0    6 o  105.624   2.0719  230.630   12.742  230.630   12.742  230.630   12.742  105.624   2.9301  105.624   2.9301 0.000000 0.000000 
1 1 1   13    0    7 f  399.366   3.0924  3291.26   72.015  3291.26   72.015  3291.26   72.015  399.366   4.3733  399.366   4.3733 0.000000 0.000000 
1 1 1   13    0    8 f  174.916   2.1007  631.581   21.419  631.581   21.419  631.581   21.419  174.916   2.9709  174.916   2.9709 0.000000 0.000000 
1 1 1   13    0    9 o  885.518   6.0471 16194.07  312.273 16194.07  312.273 16194.07  312.273  885.518   8.5519  885.518   8.5519 0.000000 0.000000 
1 1 1   13    0   10 o  413.474   3.1747  3528.03   76.544  3528.03   76.544  3528.03   76.544  413.474   4.4896  413.474   4.4896 0.000000 0.000000 
1 1 1   13    0   11 o  559.132   4.6530  6454.95  151.702  6454.95  151.702  6454.95  151.702  559.132   6.5803  559.132   6.5803 0.000000 0.000000 
1 1 1   13    0   12 o  202.855   3.1242  850.163   36.926  850.163   36.926  850.163   36.926  202.855   4.4183  202.855   4.4183 0.000000 0.000000 
1 1 1   13    0   14 f  190.108   2.7407  746.523   30.362  746.523   30.362  746.523   30.362  190.108   3.8759  190.108   3.8759 0.000000 0.000000 
1 1 1   13    0   15 o  451.125   3.4410  4201.19   90.522  4201.19   90.522  4201.19   90.522  451.125   4.8664  451.125   4.8664 0.000000 0.000000 
1 1 1   13    0   16 o  412.062   3.2223  3505.09   77.428  3505.09   77.428  3505.09   77.428  412.062   4.5571  412.062   4.5571 0.000000 0.000000 
1 1 1   13    0   17 o  365.514   3.5125  2758.94   74.856  2758.94   74.856  2758.94   74.856  365.514   4.9675  365.514   4.9675 0.000000 0.000000 
1 1 1   13    0   18 o  329.906   2.8256  2246.85   54.355  2246.85   54.355  2246.85   54.355  329.906   3.9960  329.906   3.9960 0.000000 0.000000 
1 1 1   13    0   19 o  277.189   3.1200  1587.01   50.415  1587.01   50.415  1587.01   50.415  277.189   4.4123  277.189   4.4123 0.000000 0.000000 
1 1 1   13    0   20 o  242.887   3.5440  1219.75   50.160  1219.75   50.160  1219.75   50.160  242.887   5.0119  242.887   5.0119 0.000000 0.000000 
1 1 1   13    0   21 o   11.575   5.5527  -5.9770   11.239  -5.9770   11.239  -5.9770   11.239   11.575   7.8527   11.575   7.8527 0.000000 0.000000 
1 1 1   13    0   22 o   27.189   7.2525   20.669   10.771   20.669   10.771   20.669   10.771   27.189   10.257   27.189   10.257 0.000000 0.000000 
1 1 1   13    0   23 o  154.989   2.4781  496.521   22.376  496.521   22.376  496.521   22.376  154.989   3.5045  154.989   3.5045 0.000000 0.000000 
1 1 1   13    0   24 o  227.357   2.8074  1068.08   37.205  1068.08   37.205  1068.08   37.205  227.357   3.9703  227.357   3.9703 0.000000 0.000000 
1 1 1   13    0   25 o   72.439   4.0314  110.463   16.791  110.463   16.791  110.463   16.791   72.439   5.7012   72.439   5.7012 0.000000 0.000000 
1 1 1   13    0   26 o   29.854   7.1895   23.922   11.228   23.922   11.228   23.922   11.228   29.854   10.168   29.854   10.168 0.000000 0.000000 
1 1 1   13    0   27 o   86.328   4.4264  156.577   22.019  156.577   22.019  156.577   22.019   86.328   6.2599   86.328   6.2599 0.000000 0.000000 
1 1 1   13    0   28 o   91.915   4.1619  176.861   22.103  176.861   22.103  176.861   22.103   91.915   5.8858   91.915   5.8858 0.000000 0.000000 
1 1 1   13    0   29 o   82.859   4.5657  144.678   21.758  144.678   21.758  144.678   21.758   82.859   6.4569   82.859   6.4569 0.000000 0.000000 
1 1 1   13    0   30 o   81.498   4.7308  140.333   22.140  140.333   22.140  140.333   22.140   81.498   6.6904   81.498   6.6904 0.000000 0.000000 
1 1 1   13    0   31 o   99.749   5.2679  209.951   30.257  209.951   30.257  209.951   30.257   99.749   7.4499   99.749   7.4499 0.000000 0.000000 
1 1 1   13    0   32 o  191.569   3.1141  760.109   34.755  760.109   34.755  760.109   34.755  191.569   4.4040  191.569   4.4040 0.000000 0.000000 
1 1 1   13    0   33 o   19.590   8.7906   3.3334   21.810   3.3334   21.810   3.3334   21.810   19.590   12.432   19.590   12.432 0.000000 0.000000 
1 1 1   13    0   34 o  107.489   6.6189  247.979   40.774  247.979   40.774  247.979   40.774  107.489   9.3605  107.489   9.3605 0.000000 0.000000 
1 1 1   13    0   35 o  135.956   4.8608  388.748   38.322  388.748   38.322  388.748   38.322  135.956   6.8742  135.956   6.8742 0.000000 0.000000 
1 1 1   13    0   36 o  109.763   4.6660  254.305   29.626  254.305   29.626  254.305   29.626  109.763   6.5987  109.763   6.5987 0.000000 0.000000 
1 1 1   13    0   37 o   23.749   9.6334   16.564   21.211   16.564   21.211   16.564   21.211   23.749   13.624   23.749   13.624 0.000000 0.000000 
1 1 1   13    0   38 f   28.691   10.484   27.290   22.559   27.290   22.559   27.290   22.559   28.691   14.827   28.691   14.827 0.000000 0.000000 
1 1 1   13    0   39 o   23.138   10.145   11.194   27.317   11.194   27.317   11.194   27.317   23.138   14.348   23.138   14.348 0.000000 0.000000 
1 1 1   13    0   40 o   17.625   8.2827  -3.6458   22.744  -3.6458   22.744  -3.6458   22.744   17.625   11.714   17.625   11.714 0.000000 0.000000 
1 1 1   13    0   41 o   14.390   7.0742 -16.2527   21.016 -16.2527   21.016 -16.2527   21.016   14.390   10.004   14.390   10.004 0.000000 0.000000 
1 1 1   13    0   42 o   22.808   10.474   5.5467   33.322   5.5467   33.322   5.5467   33.322   22.808   14.812   22.808   14.812 0.000000 0.000000 
1 1 1   13    0   43 o   50.219   9.1942   66.134   23.275   66.134   23.275   66.134   23.275   50.219   13.003   50.219   13.003 0.000000 0.000000 
1 1 1   13    0   44 o   40.145   10.113   48.356   21.594   48.356   21.594   48.356   21.594   40.145   14.302   40.145   14.302 0.000000 0.000000 
1 1 1   13    0   45 o   26.114   10.066   25.153   21.748   25.153   21.748   25.153   21.748   26.114   14.235   26.114   14.235 0.000000 0.000000 
1 1 1   13    0   46 o   53.921   10.728   82.984   29.211   82.984   29.211   82.984   29.211   53.921   15.172   53.921   15.172 0.000000 0.000000 
1 1 1   13    0   47 o   21.355   9.8289   9.7088   29.566   9.7088   29.566   9.7088   29.566   21.355   13.900   21.355   13.900 0.000000 0.000000 
1 1 1   13    1    0 o  129.959   2.9314  349.437   22.170  349.437   22.170  349.437   22.170  129.959   4.1456  129.959   4.1456 0.000000 0.000000 
1 1 1   13    1    1 o  165.444   2.9312  564.709   20.001  570.907   28.367  558.581   28.205  166.347   4.1346  164.541   4.1561 1.805908 5.862434 
1 1 1   13    1    2 o  132.090   2.8997  359.967   15.797  356.362   22.285  363.609   22.398  131.425   4.1111  132.755   4.0906 -1.329910 5.799499 
1 1 1   13    1    3 o  497.376   5.1655  5108.81  105.962  5095.38  149.328  5122.44  150.384  496.720   7.2890  498.033   7.3211 -1.313782 10.33091 
1 1 1   13    1    4 o  132.767   2.8888  363.513   15.815  373.464   22.633  354.015   22.109  134.542   4.0786  130.992   4.0923 3.550369 5.777676 
1 1 1   13    1    5 o  416.189   3.4397  3573.03   58.391  3583.83   89.542  3565.03   77.021  416.716   5.2098  415.662   4.4927 1.053894 6.879370 
1 1 1   13    1    6 o  535.211   3.8736  5912.04   85.500  5946.52  121.917  5878.67  119.937  536.744   5.5072  533.678   5.4489 3.065796 7.747250 
1 1 1   13    1    7 o  780.698   5.3863 12591.71  173.433 12576.59  244.769 12606.96  245.777  780.229   7.6062  781.167   7.6284 -0.9373169 10.77250 
1 1 1   13    1    8 f  345.105   2.8021  2456.68   39.876  2484.42   57.097  2430.27   55.715  347.005   3.9894  343.205   3.9360 3.800140 5.604225 
1 1 1   13    1    9 o  365.411   2.9181  2754.83   43.974  2737.98   61.692  2772.23   62.698  364.276   4.1061  366.545   4.1473 -2.269073 5.836115 
1 1 1   13    1   10 o  269.945   2.4415  1503.32   27.183  1509.22   38.554  1497.49   38.333  270.472   3.4560  269.418   3.4497 1.053345 4.883080 
1 1 1   13    1   11 o  425.147   3.2450  3724.69   56.808  3825.55   83.164  3636.46   77.784  430.528   4.6835  419.767   4.4928 10.76120 6.489980 
1 1 1   13    1   12 o  241.444   3.0354  1200.51   29.576  1215.69   47.099  1190.62   38.002  242.682   4.7055  240.206   3.8359 2.476929 6.070891 
1 1 1   13    1   13 o  466.247   4.0458  4489.79   77.799  4514.35  110.426  4465.58  109.628  467.513   5.7268  464.982   5.7164 2.531158 8.091539 
1 1 1   13    1   14 o  347.331   2.8686  2489.92   41.094  2488.27   58.108  2491.57   58.124  347.216   4.0576  347.446   4.0561 -0.2299805 5.737243 
1 1 1   13    1   15 o  209.044   2.3338  901.739   20.121  901.955   28.579  901.527   28.334  209.068   3.3143  209.020   3.2867 0.4852295E-01 4.667653 
1 1 1   13    1   16 o  282.383   2.5989  1644.96   30.257  1674.47   43.534  1617.37   42.083  284.830   3.7057  279.935   3.6449 4.894775 5.197863 
1 1 1   13    1   17 o   87.870   2.8375  159.482   10.274  167.446   14.547  151.554   14.514   90.063   3.9162   85.678   4.1072 4.384865 5.674976 
1 1 1   13    1   18 o  292.032   2.6827  1758.96   32.288  1803.79   46.761  1718.11   44.638  295.581   3.8356  288.484   3.7517 7.097778 5.365354 
1 1 1   13    1   19 o  138.857   2.4545  397.967   14.056  391.108   19.736  405.027   20.023  137.643   3.4764  140.071   3.4659 -2.428406 4.908976 
1 1 1   13    1   20 o  178.248   2.7012  649.680   19.342  628.523   24.518  684.547   31.475  174.472   3.4071  182.025   4.1924 -7.552505 5.402315 
1 1 1   13    1   21 o   80.487   4.1292  126.690   12.687  153.693   23.705  115.849   15.019   86.120   6.6736   74.854   4.8647 11.26565 8.258491 
1 1 1   13    1   22 o   94.440   2.7894  184.209   10.864  182.065   15.212  186.440   15.520   93.880   3.9286   95.000   3.9610 -1.119987 5.578851 
1 1 1   13    1   23 o   29.207   5.9388   17.619   7.7860   24.680   11.302   11.241   10.742   33.783   8.1952   24.631   8.5974 9.151394 11.87755 
1 1 1   13    1   24 o  392.521   3.6315  3188.32   58.790  3200.69   83.580  3176.21   82.710  393.270   5.1529  391.773   5.1187 1.497314 7.263095 
1 1 1   13    1   25 o   98.404   3.4086  199.264   13.766  211.117   20.732  189.918   18.409  100.996   4.9771   95.813   4.6585 5.183098 6.817102 
1 1 1   13    1   26 o  157.266   2.6131  509.558   16.887  528.272   25.161  494.219   22.779  159.874   3.8158  154.657   3.5711 5.217346 5.226180 
1 1 1   13    1   27 o   95.300   3.9875  187.118   15.608  176.353   20.945  200.562   23.407   92.248   5.5051   98.352   5.7703 -6.104439 7.975057 
1 1 1   13    1   28 o  138.035   3.3450  393.902   18.950  389.328   25.495  399.549   28.327  137.164   4.5065  138.905   4.9445 -1.740204 6.690057 
1 1 1   13    1   29 o   34.180   8.1696   23.143   13.670   23.304   18.825   22.963   19.884   34.107   11.395   34.252   11.710 -0.1447029 16.33926 
1 1 1   13    1   30 o   94.367   4.2522  185.441   16.422  157.039   22.946  215.257   23.511   86.896   6.4025  101.837   5.5976 -14.94105 8.504379 
1 1 1   13    1   31 o   31.075   10.005  -4.5054   19.940  -0.5568   21.310 -32.2860   56.524   25.857   11.108   36.292   16.645 -10.43435 20.01074 
1 1 1   13    1   32 o   74.496   5.6258  113.968   17.039  145.143   26.168   91.023   22.450   83.200   7.6257   65.791   8.2732 17.40863 11.25156 
1 1 1   13    1   33 o   95.852   4.4578  191.910   17.617  194.179   25.316  189.780   24.531   96.388   6.3680   95.315   6.2399 1.072914 8.915634 
1 1 1   13    1   34 o  110.174   5.4203  252.692   23.456  269.783   40.322  243.950   28.838  112.559   8.6855  107.788   6.4868 4.770081 10.84052 
1 1 1   13    1   35 o  118.947   4.7433  299.345   22.725  301.998   29.253  295.307   36.091  119.918   5.9144  117.975   7.4173 1.942970 9.486668 
1 1 1   13    1   36 o   86.372   4.9952  158.164   17.767  162.741   25.997  154.154   24.337   87.493   7.2042   85.252   6.9214 2.241158 9.990335 
1 1 1   13    1   37 o   42.397   8.6870   42.217   16.089   39.611   22.692   44.851   22.816   41.152   12.369   43.643   12.201 -2.491302 17.37393 
1 1 1   13    1   38 o   45.233   9.4526   48.637   18.020   52.969   31.938   46.614   21.827   46.184   14.807   44.281   11.755 1.902435 18.90526 
1 1 1   13    1   39 o   23.592   7.6152 -12.0712   16.765  -1.8670   23.406 -22.8226   24.025   25.634   11.313   21.550   10.197 4.084303 15.23040 
1 1 1   13    1   40 o   35.829   8.8486   29.744   16.304   22.959   24.832   34.885   21.616   33.544   12.842   38.114   12.177 -4.569908 17.69725 
1 1 1   13    1   41 o   35.415   8.4277   26.387   16.027   7.1725   22.225   47.203   23.133   27.218   11.505   43.612   12.318 -16.39366 16.85531 
1 1 1   13    1   42 o   32.559   10.112   9.1903   26.247   16.920   37.518   1.7810   36.732   34.224   14.721   30.893   13.868 3.330835 20.22446 
1 1 1   13    1   43 o   27.883   8.2856   7.5850   16.558  -4.6257   22.215   22.848   24.837   23.450   10.632   32.316   12.711 -8.866442 16.57118 
1 1 1   13    1   44 o   44.980   8.2231   53.830   16.014   36.537   23.444   68.958   21.927   37.116   12.715   52.844   10.431 -15.72826 16.44612 
1 1 1   13    1   45 o   20.024   6.6919 -17.1730   14.900 -30.8113   21.471  -4.5034   20.694   17.895   8.7503   22.152   10.127 -4.257336 13.38377 
1 1 1   13    1   46 o   26.459   8.2174  -4.0599   19.095   29.108   27.598 -34.5212   26.448   33.126   13.278   19.791   9.6847 13.33496 16.43485 
1 1 1   13    1   47 o   41.060   10.050   55.827   20.985   64.869   29.840   46.982   29.517   44.351   14.322   37.769   14.102 6.581253 20.09954 
1 1 1   13    1   48 o   24.022   11.700 -23.4474   37.324   0.0000   0.0000 -23.4474   37.324  ?   ?    24.022   11.700      ?      ? 
1 1 1   13    2    0 o   59.873   3.7198   75.651   12.760   75.651   12.760   75.651   12.760   59.873   5.2606   59.873   5.2606 0.000000 0.000000 
1 1 1   13    2    1 o  194.579   3.0353  781.113   24.358  773.829   34.279  788.542   34.619  193.663   4.2915  195.496   4.2935 -1.832367 6.070539 
1 1 1   13    2    2 o  259.830   3.3744  1390.19   36.107  1343.26   49.439  1443.84   52.860  255.143   4.6981  264.518   4.8451 -9.375412 6.748844 
1 1 1   13    2    3 o  442.928   4.7165  4050.61   86.162  4056.29  122.110  4044.97  121.594  443.237   6.6796  442.619   6.6607 0.6179199 9.432989 
1 1 1   13    2    4 o  265.060   3.1261  1441.18   33.248  1485.64   54.019  1414.07   42.186  268.315   4.8813  261.804   3.9068 6.511078 6.252241 
1 1 1   13    2    5 o  200.423   2.3363  826.953   19.076  839.295   29.469  818.052   25.028  201.702   3.5424  199.143   3.0471 2.559662 4.672628 
1 1 1   13    2    6 o  331.241   2.7326  2263.57   37.329  2275.00   53.182  2252.46   52.410  332.065   3.8830  330.418   3.8458 1.647491 5.465170 
1 1 1   13    2    7 o  440.866   3.3248  4010.81   60.453  3993.92   85.014  4028.08   85.981  439.929   4.6853  441.804   4.7185 -1.875153 6.649591 
1 1 1   13    2    8 o  454.409   3.4031  4261.17   63.779  4278.27   90.663  4244.43   89.737  455.309   4.8279  453.508   4.7975 1.801849 6.806266 
1 1 1   13    2    9 o  357.419   2.8697  2635.85   42.304  2635.96   59.849  2635.74   59.804  357.426   4.0598  357.411   4.0569 0.1455688E-01 5.739407 
1 1 1   13    2   10 o  372.497   2.9506  2862.71   45.325  2839.94   63.448  2886.44   64.771  370.986   4.1466  374.009   4.1988 -3.022552 5.901258 
1 1 1   13    2   11 o  397.765   3.7968  3259.60   58.441  3285.96  102.392  3246.86   71.173  398.880   6.2238  396.649   4.3505 2.230347 7.593625 
1 1 1   13    2   12 o  341.477   5.6527  2408.04   79.612   0.0000   0.0000  2408.04   79.612  ?   ?   341.477   5.6527      ?      ? 
1 1 1   13    2   13 o  281.278   2.9390  1630.85   34.046  1596.80   46.706  1669.45   49.733  278.154   4.0712  284.402   4.2398 -6.248016 5.877995 
1 1 1   13    2   14 f  202.961   2.3221  849.966   19.438  851.665   27.497  848.268   27.482  203.164   3.2815  202.758   3.2863 0.4056854 4.644182 
1 1 1   13    2   15 o  524.996   3.8540  5693.13   83.440  5657.16  116.930  5730.46  119.104  523.312   5.4175  526.680   5.4829 -3.368408 7.707925 
1 1 1   13    2   16 o  187.550   2.3461  725.869   18.148  723.611   25.547  728.169   25.784  187.256   3.3078  187.844   3.3280 -0.5880890 4.692290 
1 1 1   13    2   17 o  226.664   2.8965  1060.64   27.077  1046.34   38.123  1075.20   38.463  225.121   4.1059  228.207   4.0865 -3.085526 5.792905 
1 1 1   13    2   18 o  130.037   3.2852  345.442   17.465  377.626   26.935  322.097   22.940  135.196   4.8305  124.878   4.4539 10.31802 6.570450 
1 1 1   13    2   19 o  118.235   2.4892  288.702   12.134  295.332   17.083  281.949   17.240  119.607   3.4628  116.862   3.5768 2.745567 4.978428 
1 1 1   13    2   20 o  211.687   3.1072  918.031   24.877  906.222   29.657  946.072   45.699  209.496   3.4323  213.879   5.1806 -4.383743 6.214388 
1 1 1   13    2   21 o  218.772   2.7382  978.701   24.071  1031.69   39.145  946.480   30.524  223.450   4.2474  214.094   3.4568 9.355621 5.476344 
1 1 1   13    2   22 o   74.733   3.3704  115.255   10.348  117.786   15.405  113.174   13.968   75.472   4.9489   73.994   4.5769 1.477806 6.740874 
1 1 1   13    2   23 f  110.947   2.6499  254.215   12.123  250.508   16.921  258.124   17.377  110.117   3.7258  111.776   3.7693 -1.659187 5.299883 
1 1 1   13    2   24 o   89.218   3.3169  164.870   12.078  162.949   18.403  166.324   16.009   88.742   5.0279   89.695   4.3274 -0.9531021 6.633770 
1 1 1   13    2   25 o  122.675   2.7038  311.710   13.620  303.037   20.072  319.111   18.542  121.077   4.0194  124.274   3.6176 -3.197914 5.407663 
1 1 1   13    2   26 f  167.621   3.3431  560.153   19.564  542.515   22.190  621.715   41.456  162.058   3.3198  173.184   5.8038 -11.12581 6.686178 
1 1 1   13    2   27 o   57.326   7.6622   89.961   12.698   99.620   13.943   42.991   30.746   69.369   4.8732   45.283   14.529 24.08652 15.32432 
1 1 1   13    2   28 o   99.502   3.6628  203.848   14.429  200.680   17.971  209.596   24.206   98.482   4.4243  100.522   5.8385 -2.039482 7.325503 
1 1 1   13    2   29 o   22.014   7.0926 -17.1119   14.669  -1.8794   21.301 -30.8522   20.231   25.561   11.043   18.467   8.9031 7.093779 14.18523 
1 1 1   13    2   30 o  111.849   3.9684  259.433   18.266  263.498   26.829  255.920   24.938  112.643   5.7747  111.054   5.4446 1.588783 7.936741 
1 1 1   13    2   31 o   95.155   4.4543  188.579   17.379  188.785   23.357  188.323   26.011   95.264   5.9447   95.047   6.6351 0.2174988 8.908683 
1 1 1   13    2   32 o  119.246   4.3132  294.715   20.649  303.711   33.476  289.191   26.234  120.567   6.7320  117.924   5.3938 2.643318 8.626317 
1 1 1   13    2   33 o   32.362   8.4324   18.003   15.208   25.655   20.814   9.2394   22.273   35.389   11.981   29.335   11.869 6.053743 16.86477 
1 1 1   13    2   34 o   50.181   9.0703   58.871   18.187   51.346   32.148   62.413   22.056   47.421   14.813   52.941   10.472 -5.520252 18.14061 
1 1 1   13    2   35 o   67.794   7.7140  112.227   18.568  130.649   22.839   76.317   31.887   78.564   7.0483   57.024   13.724 21.54068 15.42793 
1 1 1   13    2   36 o   47.563   7.3355   51.621   15.074   82.360   21.506   21.935   21.135   61.905   8.4231   33.220   12.012 28.68494 14.67090 
1 1 1   13    2   37 o   45.391   7.7999   47.346   16.029   21.311   22.727   73.111   22.609   33.098   12.371   57.684   9.5031 -24.58601 15.59990 
1 1 1   13    2   38 o   46.552   8.4624   51.764   16.351   49.334   23.272   54.133   22.979   45.379   12.179   47.725   11.752 -2.346466 16.92488 
1 1 1   13    2   39 o   43.387   7.5113   37.179   16.626   1.2494   22.209   82.988   25.077   25.868   11.226   60.906   9.9828 -35.03853 15.02254 
1 1 1   13    2   40 o   64.580   6.7809   93.066   17.426  116.584   26.492   75.131   23.135   72.365   8.8760   56.795   10.254 15.56973 13.56178 
1 1 1   13    2   41 o   37.503   8.8787   33.418   16.747   21.609   23.907   44.795   23.466   32.614   12.571   42.393   12.541 -9.779598 17.75738 
1 1 1   13    2   42 o   25.366   8.2748  -8.4077   18.904 -21.0711   35.354  -3.3374   22.371   26.560   12.507   24.172   10.838 2.387461 16.54962 
1 1 1   13    2   43 o   29.807   8.5503   11.811   17.045  -3.1998   22.526   31.918   26.071   23.923   10.788   35.692   13.268 -11.76925 17.10054 
1 1 1   13    2   44 f   32.526   8.2729   24.407   15.151   38.512   21.206   9.6999   21.654   38.247   12.044   26.805   11.345 11.44228 16.54575 
1 1 1   13    2   45 o   28.269   8.2170   13.529   15.677   26.744   23.592   3.0803   20.978   32.371   12.486   24.167   10.686 8.203957 16.43390 
1 1 1   13    2   46 o   31.873   9.3456   24.335   19.484   22.537   24.108   27.720   33.084   30.649   12.366   33.096   14.016 -2.446709 18.69120 
1 1 1   13    2   47 o   53.987   10.620   97.070   24.319   96.811   30.724   97.504   39.793   56.945   13.319   51.030   16.545 5.914940 21.23981 
1 1 1   13    2   48 o   25.152   12.095 -11.9424   36.769   0.0000   0.0000 -11.9424   36.769  ?   ?    25.152   12.095      ?      ? 
1 1 1   13    3    0 o  416.305   4.5034  3578.49  109.295  3578.49  109.295  3578.49  109.295  416.305   6.3687  416.305   6.3687 0.000000 0.000000 
1 1 1   13    3    1 o  630.515   6.2972  8215.86  163.762  8214.95  231.589  8216.76  231.598  630.480   8.9060  630.549   8.9053 -0.6939697E-01 12.59450 
1 1 1   13    3    2 o  457.017   4.8279  4312.18   90.992  4282.62  127.478  4342.88  129.919  455.424   6.7866  458.610   6.8686 -3.186096 9.655859 
1 1 1   13    3    3 o  342.087   3.5766  2424.96   49.982  2337.64   75.348  2493.58   66.793  336.546   5.4282  347.627   4.6585 -11.08133 7.153166 
1 1 1   13    3    4 o  255.413   2.8962  1352.98   29.009  1323.07   49.096  1369.02   35.957  253.214   4.7010  257.612   3.3841 -4.398392 5.792406 
1 1 1   13    3    5 o  341.134   3.0021  2398.57   41.725  2417.71   64.334  2384.67   54.819  342.294   4.5569  339.975   3.9095 2.319122 6.004130 
1 1 1   13    3    6 o  731.129   5.4832 11043.59  163.642 11048.82  250.032 11039.68  216.436  731.183   8.2909  731.076   7.1780 0.1067505 10.96644 
1 1 1   13    3    7 o   56.616   2.6192   66.261   6.0957   59.870   8.6039   72.702   8.6375   53.868   3.8725   59.363   3.5278 -5.494991 5.238497 
1 1 1   13    3    8 o  299.207   2.5765  1846.89   31.794  1838.28   44.698  1855.70   45.233  298.502   3.6306  299.912   3.6567 -1.410492 5.152919 
1 1 1   13    3    9 o  171.817   2.0949  608.772   14.843  599.034   20.750  618.976   21.240  170.410   2.9523  173.223   2.9730 -2.813019 4.189834 
1 1 1   13    3   10 o  284.646   2.5085  1670.86   29.437  1646.20   40.929  1697.28   42.368  282.473   3.5131  286.820   3.5815 -4.346863 5.016904 
1 1 1   13    3   11 o  442.965   4.1165  4038.00   70.317  4091.00  124.177  4012.98   85.313  444.993   6.7658  440.937   4.6911 4.056030 8.233022 
1 1 1   13    3   12 o  270.718   2.8535  1511.83   31.849  1534.82   45.804  1490.30   44.314  272.709   4.0723  268.728   3.9982 3.980743 5.706955 
1 1 1   13    3   13 o  156.121   2.5497  503.390   16.403  518.537   22.966  487.616   23.437  158.523   3.5126  153.719   3.6967 4.804214 5.099392 
1 1 1   13    3   14 o  229.925   2.5923  1089.71   24.291  1082.83   31.932  1099.16   37.422  229.077   3.3797  230.773   3.9316 -1.696243 5.184641 
1 1 1   13    3   15 o  122.489   2.9623  309.414   14.957  322.573   21.538  297.155   20.788  125.003   4.1775  119.976   4.2010 5.026718 5.924521 
1 1 1   13    3   16 o  352.373   2.9151  2563.00   42.361  2584.42   60.484  2542.37   59.349  353.816   4.1447  350.930   4.1004 2.885620 5.830245 
1 1 1   13    3   17 o  112.016   2.5537  259.002   11.796  259.210   16.547  258.788   16.821  112.062   3.5801  111.969   3.6425 0.9307098E-01 5.107348 
1 1 1   13    3   18 o  228.339   2.4472  1075.90   23.042  1093.31   32.993  1059.31   32.196  230.141   3.4758  226.536   3.4458 3.604553 4.894390 
1 1 1   13    3   19 o  105.220   2.6148  228.746   11.340  235.905   15.941  221.411   16.136  106.891   3.6159  103.549   3.7782 3.341286 5.229676 
1 1 1   13    3   20 o   95.309   3.8249  189.285   13.216  190.803   15.414  185.072   25.679   96.109   3.8885   94.509   6.5877 1.600105 7.649761 
1 1 1   13    3   21 o  126.820   2.9178  335.485   14.940  315.596   23.284  349.404   19.478  123.567   4.5686  130.072   3.6307 -6.504494 5.835630 
1 1 1   13    3   22 o  173.634   2.6017  620.398   18.438  638.238   28.362  607.340   24.265  175.771   3.9123  171.498   3.4305 4.273087 5.203324 
1 1 1   13    3   23 o  186.035   3.5066  709.799   25.948  693.177   32.458  739.232   43.192  183.118   4.2976  188.952   5.5423 -5.834442 7.013271 
1 1 1   13    3   24 o  219.826   3.4280  1015.87   29.654  943.516   49.096  1057.42   37.207  213.452   5.5768  226.200   3.9881 -12.74805 6.856041 
1 1 1   13    3   25 o  158.160   4.4620  517.396   29.107   0.0000   0.0000  517.396   29.107  ?   ?   158.160   4.4620      ?      ? 
1 1 1   13    3   26 o  120.145   3.7510  283.846   15.446  272.616   17.356  326.608   33.868  114.857   3.6638  125.432   6.5466 -10.57551 7.502079 
1 1 1   13    3   27 o   58.322   4.8350   63.429   10.752   53.142   12.615   90.753   20.560   50.612   6.0432   66.031   7.5492 -15.41882 9.670084 
1 1 1   13    3   28 o  251.556   3.3755  1314.46   34.149  1330.01   43.832  1290.45   54.473  253.569   4.1911  249.543   5.2926 4.025681 6.751088 
1 1 1   13    3   29 o   36.341   8.4367   26.902   14.676   30.248   20.519   23.398   21.000   37.893   11.834   34.788   12.028 3.105217 16.87335 
1 1 1   13    3   30 o   77.951   5.6609  128.879   17.754  136.763   23.157  117.638   27.652   81.019   6.9301   74.884   8.9531 6.134087 11.32183 
1 1 1   13    3   31 o   67.750   5.6130   97.771   15.337  119.197   21.488   75.520   21.898   75.575   6.8938   59.925   8.8601 15.64992 11.22609 
1 1 1   13    3   32 o   76.958   9.2834  180.108   21.661   58.262   44.984  216.891   24.715   51.876   17.614  102.041   5.8726 -50.16521 18.56678 
1 1 1   13    3   33 o   54.213   8.8111   65.252   18.698   69.865   31.253   62.680   23.334   55.327   13.755   53.100   11.016 2.227634 17.62213 
1 1 1   13    3   34 o   82.589   4.9983  145.077   16.835  122.556   24.080  166.610   23.546   76.103   7.6716   89.076   6.4091 -12.97292 9.996519 
1 1 1   13    3   35 o   71.572   8.2214  138.069   20.540  190.447   26.206   54.647   33.073   94.951   6.6918   48.192   15.019 46.75890 16.44277 
1 1 1   13    3   36 f   55.192   6.9570   67.624   15.400   58.914   21.799   76.303   21.760   50.924   10.718   59.460   8.8729 -8.536140 13.91394 
1 1 1   13    3   37 o   36.491   8.6849   29.891   15.461   30.120   21.580   29.649   22.163   36.559   12.201   36.423   12.363 0.1357918 17.36975 
1 1 1   13    3   38 o   27.017   8.1039   3.8391   15.978  -4.6949   22.671   12.260   22.521   24.575   10.973   29.458   11.929 -4.883827 16.20786 
1 1 1   13    3   39 o   27.643   8.0419   8.5750   14.850   13.535   21.286   3.8713   20.728   29.391   11.702   25.895   11.035 3.495747 16.08384 
1 1 1   13    3   40 o   34.071   8.9481   24.595   16.865   31.380   24.596   18.574   23.171   36.676   12.992   31.467   12.307 5.208206 17.89614 
1 1 1   13    3   41 o   33.560   9.4021   17.993   19.157   37.867   31.469   6.2902   24.148   39.414   14.592   27.706   11.861 11.70819 18.80413 
1 1 1   13    3   42 o   21.486   7.0225 -17.8332   15.379   2.2940   21.832 -37.6571   21.667   25.359   11.066   17.613   8.6489 7.746223 14.04502 
1 1 1   13    3   43 o   23.919   7.9023 -14.1118   18.318 -20.1575   22.887  -3.3347   30.557   20.671   9.8306   27.167   12.375 -6.495712 15.80464 
1 1 1   13    3   44 o   23.689   7.3377  -2.9988   14.629 -20.3885   20.559   14.838   20.821   19.192   9.1797   28.186   11.450 -8.994028 14.67550 
1 1 1   13    3   45 o   38.143   9.6438   43.308   19.743   31.888   33.356   49.466   24.494   34.625   14.325   41.662   12.916 -7.036591 19.28761 
1 1 1   13    3   46 o   26.779   8.1378   6.8511   16.986  -9.5008   23.509   24.714   24.571   22.197   10.371   31.361   12.544 -9.164051 16.27568 
1 1 1   13    3   47 o   30.217   9.7846   14.902   28.210 -11.9645   49.561   27.779   34.311   28.371   13.741   32.063   13.934 -3.691427 19.56915 
1 1 1   13    3   48 o   35.505   10.605   48.694   28.702   22.229   48.028   63.397   35.798   31.000   14.591   40.009   15.394 -9.009138 21.21072 
1 1 1   13    4    0 o  132.472   2.8712  362.996   22.138  362.996   22.138  362.996   22.138  132.472   4.0605  132.472   4.0605 0.000000 0.000000 
1 1 1   13    4    1 o  324.767   3.8035  2176.69   50.943  2190.35   72.573  2163.42   71.527  325.771   5.4013  323.764   5.3564 2.007050 7.606928 
1 1 1   13    4    2 o  291.126   3.5698  1749.08   42.864  1752.32   60.742  1745.88   60.496  291.394   5.0541  290.859   5.0429 0.5351257 7.139605 
1 1 1   13    4    3 o  169.118   2.6796  589.012   18.337  595.445   28.951  584.703   23.697  169.881   4.1320  168.355   3.4127 1.525970 5.359111 
1 1 1   13    4    4 o  381.458   3.6573  3006.87   54.404  2991.79   93.567  3014.57   66.869  380.684   5.9593  382.232   4.2416 -1.548004 7.314658 
1 1 1   13    4    5 o  409.981   3.4035  3464.08   56.816  3497.95   87.844  3439.72   74.495  411.678   5.1736  408.283   4.4239 3.395020 6.807088 
1 1 1   13    4    6 o  588.733   4.5277  7160.25  108.946  7132.95  165.424  7181.15  144.779  587.690   6.8247  589.776   5.9518 -2.085815 9.055461 
1 1 1   13    4    7 o  259.541   2.3913  1389.54   25.596  1399.58   36.434  1379.74   35.967  260.467   3.3915  258.615   3.3719 1.852600 4.782506 
1 1 1   13    4    8 o  285.862   2.5115  1684.90   29.597  1715.69   42.656  1656.31   41.100  288.378   3.5863  283.346   3.5169 5.032074 5.022977 
1 1 1   13    4    9 o  304.944   2.6012  1918.27   32.711  1901.78   45.794  1935.45   46.741  303.608   3.6570  306.281   3.7001 -2.673798 5.202377 
1 1 1   13    4   10 o  357.260   2.8713  2633.75   42.309  2631.37   59.830  2636.12   59.838  357.098   4.0622  357.421   4.0591 -0.3225098 5.742676 
1 1 1   13    4   11 o  420.539   3.9501  3645.73   64.333  3670.07  112.499  3633.91   78.422  421.485   6.4714  419.594   4.5315 1.891144 7.900245 
1 1 1   13    4   12 o  293.180   2.6687  1777.56   31.473  1756.36   50.266  1791.23   40.365  291.717   4.1778  294.643   3.3216 -2.925842 5.337301 
1 1 1   13    4   13 o  206.879   3.2369  883.369   27.615  892.953   39.466  874.174   38.654  207.977   4.6009  205.781   4.5543 2.196320 6.473774 
1 1 1   13    4   14 o  418.907   3.5282  3624.08   60.307  3625.33   79.682  3622.40   92.271  419.034   4.6104  418.780   5.3421 0.2541199 7.056501 
1 1 1   13    4   15 o  187.220   2.3185  722.784   17.897  744.511   25.729  702.418   24.910  189.943   3.2843  184.496   3.2735 5.447159 4.637083 
1 1 1   13    4   16 o  402.523   3.1837  3344.01   52.830  3397.87   76.130  3293.98   73.372  405.642   4.5504  399.404   4.4540 6.237885 6.367437 
1 1 1   13    4   17 o  138.751   2.9599  397.519   16.937  405.826   24.029  389.317   23.876  140.193   4.1557  137.309   4.2159 2.883804 5.919757 
1 1 1   13    4   18 o  406.724   3.2153  3417.05   53.935  3433.07   76.720  3401.39   75.839  407.664   4.5629  405.784   4.5314 1.880188 6.430658 
1 1 1   13    4   19 o  203.174   4.2996  829.906   25.700  819.772   27.792  889.737   67.529  199.267   3.3815  207.081   7.9065 -7.813568 8.599266 
1 1 1   13    4   20 o  190.648   2.5518  750.781   19.990  748.838   29.559  752.420   27.136  190.409   3.7639  190.888   3.4467 -0.4789276 5.103631 
1 1 1   13    4   21 o  251.879   3.1998  1317.01   31.090  1294.94   54.451  1327.67   37.869  250.206   5.2765  253.552   3.6212 -3.345596 6.399553 
1 1 1   13    4   22 o  124.754   2.7311  321.223   13.935  323.775   21.155  319.267   18.521  125.177   4.0976  124.330   3.6119 0.8471375 5.462238 
1 1 1   13    4   23 o  159.751   2.4570  526.767   16.184  510.877   22.557  543.624   23.232  157.269   3.4775  162.232   3.4721 -4.962631 4.914086 
1 1 1   13    4   24 o   83.691   3.5006  148.096   11.743  129.253   18.218  161.488   15.359   78.998   5.5915   88.384   4.2134 -9.385437 7.001286 
1 1 1   13    4   25 o  133.782   3.2040  369.513   17.623  361.699   23.879  378.859   26.116  132.245   4.3780  135.318   4.6793 -3.072861 6.408015 
1 1 1   13    4   26 o  205.419   3.3798  878.981   25.887  886.729   30.718  859.992   48.089  207.151   3.5953  203.686   5.7242 3.464264 6.759653 
1 1 1   13    4   27 o  139.098   3.0015  395.086   16.206  385.485   19.703  415.169   28.495  136.584   3.4975  141.611   4.8788 -5.027145 6.002933 
1 1 1   13    4   28 o  188.234   2.8091  723.862   20.780  704.363   25.581  761.690   35.631  184.627   3.3594  191.840   4.5032 -7.213348 5.618195 
1 1 1   13    4   29 o  208.026   3.4838  885.217   29.461  961.146   46.461  834.157   38.100  215.333   5.2314  200.720   4.6022 14.61244 6.967607 
1 1 1   13    4   30 o   38.699   7.4737   35.656   12.072   41.755   13.588   12.810   26.299   44.729   7.3656   32.668   13.007 12.06048 14.94732 
1 1 1   13    4   31 o   73.559   5.3725  112.765   16.254  106.898   22.008  119.806   24.110   71.482   7.4650   75.636   7.7285 -4.153893 10.74505 
1 1 1   13    4   32 o  112.205   4.3686  262.969   20.171  255.425   29.278  269.785   27.829  110.622   6.4171  113.789   5.9296 -3.167038 8.737283 
1 1 1   13    4   33 o   58.253   8.4160   80.567   18.937   56.858   31.444   94.060   23.721   49.896   14.449   66.609   8.6345 -16.71226 16.83204 
1 1 1   13    4   34 o   71.961   5.4573  110.399   16.083   98.932   23.230  120.957   22.289   68.211   8.2570   75.711   7.1379 -7.500557 10.91458 
1 1 1   13    4   35 o   29.767   8.4381   11.401   15.947   4.8978   23.574   16.887   21.652   28.133   11.868   31.401   11.998 -3.268343 16.87626 
1 1 1   13    4   36 o   55.906   7.1332   69.043   15.935   54.537   21.784   85.740   23.371   48.824   11.072   62.988   8.9961 -14.16438 14.26633 
1 1 1   13    4   37 o   90.604   4.6488  174.941   17.369  170.384   24.403  179.620   24.727   89.388   6.6192   91.819   6.5294 -2.431412 9.297665 
1 1 1   13    4   38 o   33.619   8.1994   17.942   16.395  -9.5293   23.152   45.575   23.219   23.686   10.783   43.551   12.355 -19.86475 16.39882 
1 1 1   13    4   39 o   36.993   8.0753   29.573   14.871   49.673   21.492   11.111   20.598   45.754   11.424   28.232   11.417 17.52184 16.15069 
1 1 1   13    4   40 o   54.519   7.6292   70.335   16.548   70.641   23.397   70.028   23.408   54.657   10.762   54.380   10.817 0.2770615 15.25850 
1 1 1   13    4   41 o   21.016   7.0416 -28.2633   17.584 -73.6728   30.281  -5.1598   21.599   18.583   9.3060   23.450   10.571 -4.867085 14.08322 
1 1 1   13    4   42 o   43.188   8.0239   45.550   16.439   75.483   23.443   16.594   23.057   56.154   10.508   30.222   12.129 25.93175 16.04788 
1 1 1   13    4   43 o   31.975   8.8385   22.248   17.711   31.646   21.982   4.8603   29.900   35.354   12.301   28.596   12.695 6.757921 17.67699 
1 1 1   13    4   44 o   39.281   8.6851   41.300   15.639   38.140   21.709   44.708   22.548   37.822   12.216   40.739   12.349 -2.917374 17.37027 
1 1 1   13    4   45 o   32.359   8.7947   25.782   16.901   35.902   24.163   16.088   23.648   35.925   12.861   28.794   11.999 7.131079 17.58945 
1 1 1   13    4   46 o   33.455   8.8349   21.721   18.157   58.854   28.678  -3.1255   23.458   43.508   14.039   23.403   10.729 20.10528 17.66973 
1 1 1   13    4   47 o   32.651   10.256   28.876   28.485   9.5625   46.758   40.273   35.920   30.319   14.309   34.982   14.698 -4.662495 20.51279 
1 1 1   13    4   48 o   28.613   9.5443   9.7643   28.545   16.415   46.504   5.7436   36.159   29.988   14.189   27.237   12.769 2.750782 19.08868 
1 1 1   13    5    0 o   81.971   3.0961  139.788   14.707  139.788   14.707  139.788   14.707   81.971   4.3786   81.971   4.3786 0.000000 0.000000 
1 1 1   13    5    1 o  409.863   4.4460  3467.85   75.143  3495.68  107.479  3441.23  105.099  411.468   6.3332  408.258   6.2416 3.210175 8.891966 
1 1 1   13    5    2 o  322.599   3.4573  2149.16   45.138  2140.27   70.970  2155.19   58.494  322.017   5.3436  323.182   4.3883 -1.165833 6.914550 
1 1 1   13    5    3 o  227.352   2.8964  1065.57   26.602  1071.03   42.153  1061.96   34.294  227.823   4.4860  226.880   3.6649 0.9430389 5.792712 
1 1 1   13    5    4 o  440.710   4.0982  3987.36   69.401  4070.59  123.620  3949.06   83.864  443.967   6.7511  437.453   4.6481 6.513184 8.196472 
1 1 1   13    5    5 o  292.357   2.7357  1763.34   32.645  1764.38   49.900  1762.57   43.164  292.422   4.1373  292.292   3.5805 0.1302185 5.471500 
1 1 1   13    5    6 o  254.434   2.5517  1336.13   26.532  1331.38   40.308  1339.76   35.244  254.028   3.8472  254.841   3.3531 -0.8128357 5.103376 
1 1 1   13    5    7 o  100.076   2.2445  205.939   9.1772  211.321   14.052  201.935   12.119  101.210   3.3662   98.941   2.9697 2.269333 4.488954 
1 1 1   13    5    8 o   41.394   3.2054   35.363   5.4707   35.513   7.6514   35.207   7.8252   41.484   4.4720   41.304   4.5934 0.1798363 6.410774 
1 1 1   13    5    9 o  461.223   3.4434  4387.95   65.456  4322.08   90.588  4459.90   94.686  457.610   4.7997  464.837   4.9388 -7.226959 6.886843 
1 1 1   13    5   10 o  478.186   3.8279  4716.88   74.584  4748.40  114.919  4693.94   98.037  479.522   5.8106  476.850   4.9847 2.671478 7.655734 
1 1 1   13    5   11 o  223.359   2.7740  1032.40   24.120  1020.88   41.563  1038.24   29.617  222.391   4.5314  224.326   3.2011 -1.935410 5.548000 
1 1 1   13    5   12 o  256.660   2.5037  1354.71   25.632  1377.23   42.148  1341.49   32.290  258.327   3.9559  254.992   3.0702 3.335022 5.007497 
1 1 1   13    5   13 o  191.447   2.5404  756.352   20.059  758.404   28.443  754.321   28.293  191.706   3.5973  191.189   3.5880 0.5164795 5.080759 
1 1 1   13    5   14 o  349.798   3.3420  2526.68   48.204  2529.04   67.464  2524.21   68.901  349.970   4.6739  349.625   4.7781 0.3448792 6.683971 
1 1 1   13    5   15 o  216.275   4.7266  965.952   42.162  965.952   42.162   0.0000   0.0000  216.275   4.7266  ?   ?       ?      ? 
1 1 1   13    5   16 o  413.884   3.2378  3537.35   55.265  3516.10   77.545  3559.29   78.782  412.624   4.5566  415.145   4.6011 -2.520660 6.475515 
1 1 1   13    5   17 o  411.125   3.5040  3488.88   58.688  3514.37   90.502  3470.38   77.096  412.360   5.3213  409.891   4.5603 2.469147 7.008029 
1 1 1   13    5   18 o  485.182   3.6458  4865.64   72.956  4864.45  103.104  4866.83  103.248  485.124   5.1530  485.241   5.1589 -0.1171265 7.291596 
1 1 1   13    5   19 o  292.351   3.5959  1764.15   42.296  1752.92   54.074  1781.84   67.885  291.241   4.5017  293.462   5.6086 -2.221497 7.191798 
1 1 1   13    5   20 o  101.028   3.7291  210.830   15.460  213.991   23.133  208.278   20.782  101.697   5.5152  100.359   5.0207 1.338058 7.458228 
1 1 1   13    5   21 o  307.262   3.0278  1958.40   38.184  1858.49   55.958  2045.45   52.234  299.864   4.5245  314.659   4.0248 -14.79471 6.055608 
1 1 1   13    5   22 o  205.014   3.4270  878.966   28.375  922.711   37.117  817.442   44.017  211.289   4.2592  198.740   5.3700 12.54929 6.853973 
1 1 1   13    5   23 o   66.872   3.8983   89.855   10.563  107.732   16.994   78.599   13.484   72.123   5.7130   61.622   5.3055 10.50046 7.796587 
1 1 1   13    5   24 o  327.805   3.1384  2226.77   42.054  2257.59   56.082  2187.17   63.566  330.467   4.1146  325.144   4.7401 5.323303 6.276813 
1 1 1   13    5   25 o  225.288   2.7425  1046.59   24.511  1040.12   30.671  1058.03   40.774  224.395   3.3140  226.180   4.3708 -1.784653 5.485094 
1 1 1   13    5   26 o  142.026   3.0197  419.392   17.119  426.180   21.733  408.296   27.788  143.602   3.6694  140.450   4.7969 3.152359 6.039454 
1 1 1   13    5   27 o  106.604   4.2329  231.004   14.912  227.891   16.631  243.766   33.673  104.994   3.8405  108.213   7.5446 -3.218758 8.465819 
1 1 1   13    5   28 f  134.589   3.0370  371.763   16.058  365.018   19.800  384.725   27.448  132.885   3.6127  136.292   4.8828 -3.407059 6.073960 
1 1 1   13    5   29 o   91.639   4.9062  171.917   18.220  160.375   23.358  189.853   29.118   87.834   6.4476   95.445   7.3966 -7.611664 9.812351 
1 1 1   13    5   30 o   96.461   4.3157  192.991   17.071  188.697   22.833  198.433   25.705   95.287   5.8098   97.636   6.3832 -2.349319 8.631302 
1 1 1   13    5   31 o  110.879   4.0971  255.861   18.656  256.100   25.256  255.575   27.678  110.982   5.5176  110.775   6.0580 0.2069397 8.194128 
1 1 1   13    5   32 o   48.555   8.0312   52.413   15.793   52.662   22.063   52.151   22.616   48.701   11.216   48.409   11.498 0.2919388 16.06250 
1 1 1   13    5   33 o   43.662   10.482   39.115   19.608   41.098   43.613   38.612   21.952   45.764   17.131   41.560   12.083 4.203979 20.96388 
1 1 1   13    5   34 o   55.707   7.1730   70.203   15.684   34.908   21.603  109.547   22.808   39.536   12.109   71.879   7.6934 -32.34320 14.34610 
1 1 1   13    5   35 o  111.566   4.3377  262.256   19.894  235.236   27.775  290.725   28.510  105.568   6.3790  117.564   5.8796 -11.99580 8.675318 
1 1 1   13    5   36 o   62.944   7.6725   80.317   18.608   61.997   22.494  120.025   33.118   52.199   10.804   73.688   10.897 -21.48922 15.34500 
1 1 1   13    5   37 o   44.056   8.4423   45.850   15.937   56.495   22.999   36.018   22.104   48.921   11.579   39.191   12.289 9.730629 16.88464 
1 1 1   13    5   38 o   60.498   7.4243   83.584   18.097   88.026   25.412   79.014   25.777   62.815   9.8088   58.181   11.148 4.633854 14.84864 
1 1 1   13    5   39 o   67.428   5.8105   99.018   16.129  107.644   23.463   91.290   22.209   70.258   8.0971   64.597   8.3357 5.661781 11.62097 
1 1 1   13    5   40 o   38.227   8.9598   34.526   16.467   28.122   21.978   42.722   24.863   34.982   12.293   41.473   13.038 -6.491180 17.91962 
1 1 1   13    5   41 o   25.802   8.0488  -3.2276   16.822   12.155   26.008 -14.2919   22.057   29.949   12.540   21.654   10.093 8.294508 16.09766 
1 1 1   13    5   42 o   46.991   8.1343   55.537   15.876   43.247   22.657   67.390   22.252   41.152   12.357   52.830   10.581 -11.67776 16.26852 
1 1 1   13    5   43 o   45.964   8.6983   55.762   16.914   49.743   24.583   61.171   23.308   43.077   12.858   48.851   11.719 -5.773365 17.39663 
1 1 1   13    5   44 o   42.070   7.3846   42.671   16.055   81.244   23.029   6.1885   22.396   58.300   9.5770   25.840   11.243 32.46098 14.76930 
1 1 1   13    5   45 o   33.972   8.8814   30.926   16.479   31.964   23.478   29.918   23.136   34.374   12.625   33.570   12.495 0.8039284 17.76270 
1 1 1   13    5   46 o   29.023   7.7211   1.8302   16.889   48.921   24.051 -43.9794   23.721   40.738   12.826   17.309   8.5991 23.42828 15.44215 
1 1 1   13    5   47 o   35.560   10.705   43.988   28.083   32.286   46.172   50.859   35.379   33.396   15.212   37.725   15.065 -4.329079 21.40963 
1 1 1   13    5   48 o   33.060   10.452   39.164   28.835   39.392   48.577   39.040   35.831   32.916   15.217   33.203   14.334 -0.2867012 20.90470 
1 1 1   13    5   49 o   28.360   13.139   17.090   36.513   0.0000   0.0000   17.090   36.513  ?   ?    28.360   13.139      ?      ? 
1 1 1   13    6    0 o   75.459   3.1620  118.692   13.805  118.692   13.805  118.692   13.805   75.459   4.4717   75.459   4.4717 0.000000 0.000000 
1 1 1   13    6    1 o  316.114   3.0610  2061.46   39.900  2083.46   57.169  2040.56   55.713  317.757   4.3622  314.471   4.2955 3.285950 6.122051 
1 1 1   13    6    2 f  234.444   2.6286  1133.93   25.416  1139.64   36.112  1128.33   35.778  235.029   3.7253  233.860   3.7094 1.169205 5.257141 
1 1 1   13    6    3 o  468.748   4.0230  4534.95   77.758  4573.60  111.403  4498.24  108.583  470.691   5.7385  466.805   5.6398 3.885712 8.045936 
1 1 1   13    6    4 o  555.349   4.3413  6344.70   97.572  6485.40  154.384  6251.12  125.906  560.397   6.6794  550.301   5.5473 10.09540 8.682595 
1 1 1   13    6    5 o  324.400   2.9041  2171.75   38.471  2168.48   58.659  2174.21   50.963  324.173   4.3872  324.626   3.8063 -0.4523315 5.808237 
1 1 1   13    6    6 o  544.287   4.2321  6124.31   94.373  6046.35  141.406  6186.92  126.724  541.122   6.3359  547.453   5.6124 -6.330811 8.464190 
1 1 1   13    6    7 o  240.179   2.4909  1188.55   24.402  1200.57   37.487  1179.71   32.144  241.224   3.7679  239.134   3.2591 2.089920 4.981785 
1 1 1   13    6    8 o  423.971   3.2300  3709.50   56.477  3727.61   80.415  3691.86   79.338  424.991   4.5876  422.951   4.5480 2.040131 6.459962 
1 1 1   13    6    9 o  231.707   3.2565  1051.02   29.974  1323.70   51.544  911.696   36.844  253.230   4.9351  210.184   4.2501 43.04582 6.512918 
1 1 1   13    6   10 o  311.556   3.2521  1991.46   38.977  2037.28   69.315  1970.27   47.135  314.109   5.3503  309.003   3.6984 5.105652 6.504172 
1 1 1   13    6   11 o  303.970   3.0130  1902.31   37.687  1974.47   55.583  1840.92   51.272  309.286   4.3573  298.654   4.1624 10.63129 6.025942 
1 1 1   13    6   12 o  295.889   2.7045  1784.38   31.433  1879.60   53.976  1735.51   38.666  301.757   4.3369  290.022   3.2324 11.73508 5.408960 
1 1 1   13    6   13 o   79.098   3.4107  127.281   10.973  100.590   14.652  161.369   16.558   69.790   5.0903   88.407   4.5411 -18.61768 6.821475 
1 1 1   13    6   14 o   49.022   3.9281   49.935   7.8965   45.570   11.440   53.907   10.913   46.958   5.9069   51.086   5.1795 -4.127731 7.856120 
1 1 1   13    6   15 o  102.926   2.7735  219.546   11.612  224.167   15.301  213.268   17.833  104.217   3.5597  101.634   4.2542 2.582977 5.547020 
1 1 1   13    6   16 o  207.550   2.5034  887.402   21.248  902.452   32.345  875.978   28.181  209.084   3.7508  206.017   3.3166 3.066513 5.006779 
1 1 1   13    6   17 o   55.357   4.6683   68.015   9.7627   50.304   16.248   78.023   12.213   49.261   7.9969   61.452   4.8188 -12.19033 9.336519 
1 1 1   13    6   18 o  283.608   2.6372  1660.87   30.847  1665.14   43.776  1656.66   43.475  283.970   3.7376  283.247   3.7214 0.7231140 5.274366 
1 1 1   13    6   19 o  170.707   4.7652  602.446   33.550  602.446   33.550   0.0000   0.0000  170.707   4.7652  ?   ?       ?      ? 
1 1 1   13    6   20 o  201.437   2.9420  838.061   24.438  854.495   34.978  822.390   34.157  203.365   4.1702  199.509   4.1509 3.855225 5.883946 
1 1 1   13    6   21 o  240.115   2.6788  1187.18   26.335  1220.82   39.973  1161.38   35.006  243.091   3.9869  237.140   3.5790 5.951324 5.357699 
1 1 1   13    6   22 o  120.644   2.9302  305.237   14.140  281.475   22.475  320.806   18.192  116.664   4.6708  124.623   3.5394 -7.959373 5.860376 
1 1 1   13    6   23 o  188.126   4.8384  732.128   37.542   0.0000   0.0000  732.128   37.542  ?   ?   188.126   4.8384      ?      ? 
1 1 1   13    6   24 o  137.637   2.8384  386.237   15.336  374.690   18.842  408.900   26.396  134.678   3.3920  140.596   4.5519 -5.917953 5.676785 
1 1 1   13    6   25 o  106.447   3.2663  242.330   13.428  259.556   16.676  210.562   22.646  112.077   3.6076  100.818   5.4462 11.25887 6.532688 
1 1 1   13    6   26 o  197.059   3.3465  803.676   26.941  804.098   41.020  803.356   35.726  197.056   5.0471  197.063   4.3956 -0.7263184E-02 6.692914 
1 1 1   13    6   27 o   74.567   6.8609  144.002   13.643  156.815   15.043   84.604   32.390   87.072   4.1888   62.062   13.067 25.01060 13.72187 
1 1 1   13    6   28 o  154.664   3.0006  495.297   18.587  496.443   23.634  493.438   30.093  154.960   3.6978  154.368   4.7266 0.5925293 6.001236 
1 1 1   13    6   29 o  145.868   3.6653  456.988   20.507  489.030   25.306  395.707   34.997  153.744   3.9908  137.992   6.1491 15.75143 7.330593 
1 1 1   13    6   30 f  106.849   4.0391  235.389   17.703  220.212   23.581  254.989   26.797  102.956   5.5531  110.741   5.8669 -7.784615 8.078242 
1 1 1   13    6   31 o  100.850   3.6247  207.605   14.007  201.573   16.815  221.279   25.317   98.629   4.1337  103.071   5.9553 -4.442680 7.249360 
1 1 1   13    6   32 o   52.773   8.5392   56.353   19.286   97.953   30.643   29.065   24.818   67.637   10.984   37.909   13.077 29.72876 17.07848 
1 1 1   13    6   33 o  116.029   4.3989  283.334   20.874  271.999   31.247  292.470   28.052  113.789   6.6579  118.269   5.7509 -4.479820 8.797717 
1 1 1   13    6   34 o  105.467   4.2303  232.834   18.343  225.641   24.818  241.493   27.231  103.733   5.8009  107.202   6.1589 -3.469017 8.460629 
1 1 1   13    6   35 o   64.128   6.5454   92.902   16.019   61.850   22.792  123.212   22.518   52.109   10.953   76.146   7.1699 -24.03682 13.09071 
1 1 1   13    6   36 o   41.661   9.3088   41.398   17.821   47.171   21.239   27.661   32.762   45.143   11.403   38.180   14.717 6.963249 18.61766 
1 1 1   13    6   37 o   48.784   7.6009   55.632   15.876   84.847   22.686   27.594   22.224   62.202   8.8428   35.365   12.365 26.83708 15.20178 
1 1 1   13    6   38 o   30.209   7.8941   11.413   15.054   34.433   21.292 -11.5994   21.288   38.277   12.070   22.142   10.177 16.13466 15.78817 
1 1 1   13    6   39 o   57.332   7.1140   75.683   16.163   93.403   22.997   58.382   22.723   65.138   8.5597   49.525   11.365 15.61338 14.22809 
1 1 1   13    6   40 o   42.471   9.5522   46.309   19.321   33.281   31.233   54.384   24.590   38.121   14.448   46.821   12.499 -8.700150 19.10432 
1 1 1   13    6   41 f   26.612   8.0095   3.8324   16.295 -13.5815   25.086   16.542   21.431   23.359   10.846   29.865   11.788 -6.505791 16.01902 
1 1 1   13    6   42 o   40.536   7.7670   37.349   16.293   74.386   23.559   3.3927   22.558   55.303   10.715   25.769   11.247 29.53419 15.53408 
1 1 1   13    6   43 o   25.160   7.6651   2.1090   15.333 -14.3753   22.635   16.089   20.845   21.498   10.086   28.823   11.545 -7.324507 15.33021 
1 1 1   13    6   44 o   37.477   8.8583   38.724   17.254   52.283   23.177   21.871   25.840   43.725   12.323   31.230   12.729 12.49507 17.71658 
1 1 1   13    6   45 o   20.376   6.8681 -18.3238   16.001 -20.7340   22.667 -15.9297   22.591   19.992   9.5825   20.759   9.8417 -0.7670746 13.73623 
1 1 1   13    6   46 o   30.884   9.0337   24.040   18.676   24.897   24.515   22.855   28.831   30.976   12.480   30.793   13.065 0.1821480 18.06737 
1 1 1   13    6   47 o   37.495   10.507   49.944   24.456   58.115   34.054   41.242   35.143   39.979   15.102   35.011   14.611 4.968967 21.01352 
1 1 1   13    6   48 o   42.112   10.298   70.474   30.216 -10.6533   48.736  121.128   38.510   27.032   13.211   57.192   15.801 -30.16025 20.59622 
1 1 1   13    7    0 o   99.620   2.4174  205.420   14.009  205.420   14.009  205.420   14.009   99.620   3.4186   99.620   3.4186 0.000000 0.000000 
1 1 1   13    7    1 o  525.706   4.4095  5698.87   95.458  5832.28  139.595  5581.70  130.827  531.463   6.3684  519.948   6.1006 11.51508 8.818967 
1 1 1   13    7    2 o  539.175   4.4992  6001.80  100.034  6049.37  143.145  5956.39  139.850  541.258   6.4122  537.093   6.3132 4.165039 8.998474 
1 1 1   13    7    3 o  255.080   2.7360  1342.44   28.784  1342.98   40.712  1341.90   40.702  255.131   3.8689  255.029   3.8696 0.1022491 5.471960 
1 1 1   13    7    4 o   22.458   4.5364   9.7714   4.8878   17.152   7.0439   2.9181   6.7878   28.271   6.2106   16.645   6.6139 11.62641 9.072808 
1 1 1   13    7    5 o  557.470   4.3256  6417.89   98.477  6409.44  150.122  6424.28  130.470  557.098   6.5335  557.841   5.6707 -0.7427368 8.651222 
1 1 1   13    7    6 o  107.293   2.3713  237.385   10.491  231.227   14.664  243.843   15.015  105.868   3.3584  108.718   3.3486 -2.849937 4.742573 
1 1 1   13    7    7 o  494.826   4.1993  5055.79   85.697  5031.56  120.299  5080.75  122.108  493.626   5.9088  496.026   5.9686 -2.400421 8.398698 
1 1 1   13    7    8 o  250.303   2.5361  1294.72   25.984  1275.78   39.080  1309.73   34.788  248.652   3.8106  251.955   3.3477 -3.303558 5.072265 
1 1 1   13    7    9 o  262.124   2.9148  1422.16   29.958  1404.56   50.847  1431.51   37.078  260.847   4.7262  263.400   3.4130 -2.553223 5.829666 
1 1 1   13    7   10 o  210.896   2.7223  912.668   22.146  932.510   39.169  903.344   26.849  212.545   4.4681  209.247   3.1111 3.298813 5.444502 
1 1 1   13    7   11 o  472.433   3.8196  4583.45   72.857  4734.95  116.380  4485.80   93.430  478.750   5.8939  466.115   4.8599 12.63522 7.639159 
1 1 1   13    7   12 o  132.749   2.9552  334.250   15.493  483.565   27.004  260.988   18.915  153.052   4.2778  112.446   4.0785 40.60664 5.910472 
1 1 1   13    7   13 o  239.242   2.9473  1183.46   27.676  1175.50   46.938  1187.70   34.266  238.586   4.7700  239.899   3.4631 -1.313431 5.894596 
1 1 1   13    7   14 o   96.263   2.7059  192.130   10.695  177.832   15.473  205.209   14.799   92.814   4.0420   99.713   3.5985 -6.899384 5.411755 
1 1 1   13    7   15 o  326.635   3.0315  2202.79   40.342  2201.45   53.069  2204.62   62.094  326.550   3.9402  326.719   4.6080 -0.1697388 6.062930 
1 1 1   13    7   16 o  101.025   3.0381  215.488   12.147  229.590   15.463  192.762   19.631  105.461   3.5551   96.589   4.9277 8.872116 6.076237 
1 1 1   13    7   17 o  295.694   2.6689  1804.80   32.542  1831.23   46.589  1779.62   45.474  297.805   3.7931  293.582   3.7555 4.222870 5.337703 
1 1 1   13    7   18 f   95.333   3.5165  188.974   12.443  190.378   14.715  185.451   23.311   96.012   3.7158   94.654   5.9713 1.358589 7.033013 
1 1 1   13    7   19 f  189.717   2.6472  743.537   20.346  744.191   26.410  742.582   31.910  189.847   3.3728  189.587   4.0809 0.2600555 5.294337 
1 1 1   13    7   20 o  115.928   2.5662  277.539   12.270  279.461   17.410  275.642   17.294  116.327   3.6288  115.529   3.6294 0.7977142 5.132330 
1 1 1   13    7   21 o  124.160   2.5221  318.374   12.915  314.163   18.185  322.660   18.346  123.331   3.5749  124.989   3.5587 -1.657616 5.044269 
1 1 1   13    7   22 o  193.646   2.7349  769.489   21.276  798.063   34.501  751.955   27.027  196.486   4.2573  190.805   3.4343 5.680908 5.469821 
1 1 1   13    7   23 o  132.639   2.7579  363.364   15.023  365.890   22.332  361.275   20.305  133.048   4.0696  132.231   3.7231 0.8169861 5.515711 
1 1 1   13    7   24 o  180.143   2.7834  671.891   20.267  676.428   26.226  665.165   31.934  180.942   3.5143  179.344   4.3172 1.597534 5.566725 
1 1 1   13    7   25 o  148.424   3.4929  450.201   20.525  435.935   25.469  476.632   34.666  145.186   4.2532  151.662   5.5419 -6.475555 6.985887 
1 1 1   13    7   26 o  132.635   3.6296  362.099   19.712  382.341   30.045  346.802   26.118  135.843   5.3625  129.426   4.8928 6.416397 7.259209 
1 1 1   13    7   27 o   64.106   5.9947   74.366   12.039   68.991   13.065  104.632   31.002   57.687   5.4911   70.526   10.658 -12.83948 11.98944 
1 1 1   13    7   28 o   93.702   4.2080  181.243   16.217  167.726   21.976  197.404   24.029   89.890   5.9276   97.514   5.9745 -7.623955 8.416090 
1 1 1   13    7   29 f  173.253   3.3854  617.927   21.955  612.248   26.005  632.017   40.965  172.054   3.6646  174.452   5.6933 -2.397888 6.770769 
1 1 1   13    7   30 o   28.539   7.4424   13.754   10.369   14.056   11.870   12.783   21.302   26.736   9.0482   30.342   11.819 -3.606129 14.88478 
1 1 1   13    7   31 o   39.207   7.0947   34.607   10.500   36.234   12.070   29.543   21.292   40.987   7.4130   37.427   12.099 3.559490 14.18936 
1 1 1   13    7   32 o   37.430   8.3566   11.323   18.229   64.124   28.890 -23.6025   23.496   53.156   13.230   21.704   10.213 31.45160 16.71321 
1 1 1   13    7   33 o  138.504   3.9596  402.237   22.538  382.981   32.785  419.489   31.033  135.257   5.8769  141.751   5.3080 -6.494812 7.919188 
1 1 1   13    7   34 o   36.818   7.4720   23.058   10.302   16.793   11.535   47.753   22.902   28.063   8.8879   45.573   12.014 -17.51006 14.94401 
1 1 1   13    7   35 o   49.295   6.4011   49.565   10.554   46.635   11.843   60.859   23.256   47.036   6.1049   51.554   11.253 -4.518406 12.80220 
1 1 1   13    7   36 o   69.989   6.1014  106.943   17.465  121.242   24.584   92.373   24.815   75.006   7.9468   64.971   9.2605 10.03486 12.20282 
1 1 1   13    7   37 o   40.372   8.8479   38.691   16.859   49.711   23.012   25.926   24.768   45.611   12.052   35.134   12.957 10.47681 17.69581 
1 1 1   13    7   38 o   25.315   7.7099   1.8999   14.634  -1.2461   20.590   5.1114   20.803   24.316   10.675   26.314   11.127 -1.998425 15.41980 
1 1 1   13    7   39 o   52.076   7.4100   64.103   15.551   80.583   21.755   46.883   22.238   60.276   8.7509   43.876   11.961 16.39942 14.82003 
1 1 1   13    7   40 o   74.856   6.6717  124.811   20.337  136.992   31.869  116.444   26.413   77.522   9.9674   72.191   8.8710 5.331245 13.34333 
1 1 1   13    7   41 o   47.773   8.3833   56.830   16.499   50.633   23.228   63.142   23.440   44.838   12.224   50.708   11.476 -5.869320 16.76666 
1 1 1   13    7   42 o   21.371   7.0667 -13.8195   15.502 -15.5814   22.245 -12.1560   21.614   21.204   9.9647   21.537   10.023 -0.3329601 14.13338 
1 1 1   13    7   43 o   37.065   7.9735   34.177   15.780   5.8065   23.486   57.522   21.305   26.415   11.504   47.715   11.044 -21.29981 15.94696 
1 1 1   13    7   44 o   45.964   9.9265   48.884   19.462   28.496   22.592  107.557   38.325   33.065   12.339   58.863   15.553 -25.79817 19.85306 
1 1 1   13    7   45 f   78.611   5.8357  144.495   18.914  139.553   26.579  149.564   26.920   77.134   8.3546   80.087   8.1499 -2.953445 11.67135 
1 1 1   13    7   46 o   50.868   10.120   83.976   22.559   71.962   33.601   93.836   30.440   45.554   15.224   56.182   13.336 -10.62738 20.23921 
1 1 1   13    7   47 o   36.044   10.319   45.089   23.703   39.039   31.760   52.694   35.610   34.395   14.076   37.692   15.092 -3.296955 20.63744 
1 1 1   13    7   48 o   29.587   9.7402   20.555   28.161   27.558   46.152   16.400   35.546   30.787   14.431   28.386   13.085 2.400221 19.48030 
1 1 1   13    8    0 o  276.569   2.8359  1578.82   45.727  1578.82   45.727  1578.82   45.727  276.569   4.0106  276.569   4.0106 0.000000 0.000000 
1 1 1   13    8    1 o  398.550   3.3407  3269.33   54.064  3229.06   70.316  3327.56   84.553  395.581   4.3098  401.519   5.1057 -5.938263 6.681494 
1 1 1   13    8    2 o  441.828   4.0502  4047.96   70.334  4089.71   87.368  3971.06  118.558  445.156   4.7586  438.501   6.5553 6.655487 8.100392 
1 1 1   13    8    3 o  411.578   3.4054  3499.03   57.337  3519.20   76.480  3473.15   86.639  412.954   4.4904  410.201   5.1210 2.753448 6.810858 
1 1 1   13    8    4 o  445.879   3.6119  4106.47   65.847  4082.61   99.763  4124.88   87.651  444.703   5.4392  447.056   4.7537 -2.352509 7.223723 
1 1 1   13    8    5 o  343.595   3.0213  2431.82   42.249  2463.42   65.481  2409.29   55.299  345.485   4.5954  341.705   3.9237 3.779694 6.042600 
1 1 1   13    8    6 o  492.321   3.9102  5002.42   78.516  5018.22  120.435  4990.75  103.546  492.953   5.9235  491.689   5.1059 1.263763 7.820416 
1 1 1   13    8    7 o  207.292   2.3757  883.203   20.036  906.638   31.182  866.721   26.149  209.618   3.6067  204.966   3.0932 4.651291 4.751455 
1 1 1   13    8    8 o   92.300   3.3559  175.779   12.776   0.0000   0.0000  175.779   12.776  ?   ?    92.300   3.3559      ?      ? 
1 1 1   13    8    9 f  557.435   4.3552  6396.94   98.349  6539.60  155.135  6301.08  127.170  562.521   6.6866  552.348   5.5822 10.17328 8.710459 
1 1 1   13    8   10 f  233.594   2.6684  1125.88   25.705  1137.91   36.733  1114.33   35.984  234.815   3.7928  232.372   3.7545 2.443344 5.336864 
1 1 1   13    8   11 o  331.170   2.8474  2263.97   37.739  2262.83   61.276  2264.66   47.902  331.068   4.4875  331.273   3.5060 -0.2051392 5.694704 
1 1 1   13    8   12 o  383.525   3.2747  3026.98   50.931  3092.94   80.067  2982.15   66.007  386.979   5.0165  380.071   4.2108 6.908264 6.549493 
1 1 1   13    8   13 o  137.705   2.4423  391.918   13.828  383.518   20.254  399.251   18.924  136.316   3.6025  139.093   3.2986 -2.777069 4.884554 
1 1 1   13    8   14 o  211.367   3.3184  922.521   28.924  932.112   41.367  913.348   40.456  212.439   4.7212  210.294   4.6644 2.145325 6.636765 
1 1 1   13    8   15 o  350.350   3.8438  2530.30   53.936  2509.11   68.400  2565.13   87.704  348.509   4.7586  352.191   6.0378 -3.682220 7.687552 
1 1 1   13    8   16 o  206.497   2.7358  881.147   23.265  894.375   32.164  866.634   33.692  208.131   3.7469  204.862   3.9874 3.269196 5.471648 
1 1 1   13    8   17 o  128.018   3.2642  338.246   17.110  335.132   22.815  342.250   25.867  127.361   4.3433  128.675   4.8739 -1.314575 6.528400 
1 1 1   13    8   18 o   52.273   5.6703   62.911   10.266   69.693   12.238   46.800   18.863   58.050   5.1114   46.495   10.123 11.55514 11.34054 
1 1 1   13    8   19 o   41.450   6.6796   37.146   11.174   40.457   15.997   33.992   15.614   43.282   9.2423   39.618   9.6462 3.664383 13.35924 
1 1 1   13    8   20 o  168.003   2.3848  582.832   16.524  585.327   23.293  580.304   23.444  168.366   3.3544  167.639   3.3907 0.7263184 4.769567 
1 1 1   13    8   21 o   44.212   4.4384   40.472   8.0692   36.323   11.208   44.938   11.627   41.854   6.4926   46.570   6.0533 -4.715931 8.876723 
1 1 1   13    8   22 o   72.843   5.4710  110.543   16.035  109.151   25.575  111.446   20.583   72.399   8.5649   73.287   6.8094 -0.8877792 10.94191 
1 1 1   13    8   23 o   97.888   3.7828  199.173   15.204  178.842   21.625  219.046   21.380   92.907   5.6433  102.870   5.0390 -9.962601 7.565634 
1 1 1   13    8   24 o  138.540   2.9396  394.575   16.434  386.177   21.053  407.674   26.293  136.699   3.7341  140.381   4.5411 -3.681976 5.879220 
1 1 1   13    8   25 o   49.152   6.0119   56.956   10.473   65.332   12.655   38.746   18.659   56.150   5.4644   42.155   10.710 13.99538 12.02373 
1 1 1   13    8   26 o  162.875   3.2264  548.997   21.668  547.781   30.988  550.161   30.309  162.691   4.6181  163.058   4.5068 -0.3668365 6.452766 
1 1 1   13    8   27 o  124.728   3.2633  324.516   16.414  334.541   21.288  309.815   25.779  127.176   4.0584  122.279   5.1114 4.897217 6.526669 
1 1 1   13    8   28 o  113.812   7.4760  295.389   23.116  303.847   24.916  243.136   61.934  121.090   4.9890  106.535   14.095 14.55421 14.95194 
1 1 1   13    8   29 o   67.168   4.7405   92.112   11.777   89.807   13.793   98.315   22.625   65.795   5.0826   68.542   8.0035 -2.746269 9.480946 
1 1 1   13    8   30 o  101.101   3.7032  209.797   14.455  205.233   17.498  219.604   25.650   99.516   4.2630  102.686   6.0564 -3.169876 7.406317 
1 1 1   13    8   31 o   58.980   5.9986   76.607   12.238   79.172   14.289   69.544   23.709   61.670   5.6176   56.291   10.601 5.378994 11.99723 
1 1 1   13    8   32 o  181.759   3.4422  671.942   24.438  640.897   29.770  736.089   42.793  175.709   4.1079  187.808   5.5245 -12.09911 6.884413 
1 1 1   13    8   33 o   41.159   6.9166   31.942   10.607   24.220   12.297   54.400   20.970   33.093   8.8411   49.226   10.639 -16.13287 13.83311 
1 1 1   13    8   34 o   24.003   7.0488   5.4994   10.236   7.0212   11.667   0.4107   21.334   22.374   8.7379   25.633   11.063 -3.258570 14.09765 
1 1 1   13    8   35 o   20.886   6.6028  -2.0451   9.7021  -0.4458   10.844  -8.4596   21.718   18.311   7.8954   23.461   10.586 -5.149897 13.20570 
1 1 1   13    8   36 o   54.007   6.2991   63.191   11.838   61.603   13.662   67.976   23.717   53.868   6.1492   54.145   10.996 -0.2771645 12.59817 
1 1 1   13    8   37 o   83.096   9.1058  149.313   23.229  141.432   25.522  187.344   56.066   80.850   7.6537   85.343   16.525 -4.492226 18.21160 
1 1 1   13    8   38 o   46.333   8.2860   50.324   16.003   38.648   21.561   64.647   23.881   40.310   12.043   52.356   11.384 -12.04592 16.57191 
1 1 1   13    8   39 o   78.908   5.1611  135.366   16.780  127.256   23.437  143.896   24.035   76.406   7.4371   81.410   7.1582 -5.003807 10.32230 
1 1 1   13    8   40 o   32.576   8.3747   21.318   15.519   6.6708   21.987   35.860   21.908   26.891   11.409   38.261   12.263 -11.37053 16.74931 
1 1 1   13    8   41 o   28.607   8.0053   9.0981   15.715   29.364   21.816 -12.7574   22.655   35.012   12.251   22.201   10.308 12.81017 16.01058 
1 1 1   13    8   42 o   21.617   7.0704 -12.8503   15.159  -0.0871   21.756 -24.8934   21.134   24.310   10.809   18.925   9.1176 5.385590 14.14076 
1 1 1   13    8   43 o   23.776   7.4280   0.9240   14.350  -3.2743   19.885   5.4860   20.729   22.391   10.113   25.161   10.882 -2.769545 14.85594 
1 1 1   13    8   44 o   26.818   8.4996   4.8281   19.224   12.391   22.887 -13.2884   35.423   27.462   11.645   26.174   12.384 1.288481 16.99927 
1 1 1   13    8   45 o   20.699   6.9901 -18.6423   16.740 -16.2436   23.369 -21.1704   23.992   20.950   9.9546   20.447   9.8160 0.5025520 13.98027 
1 1 1   13    8   46 o   33.914   9.4389   21.632   21.263   70.851   34.314  -9.0478   27.092   44.570   15.377   23.257   10.951 21.31329 18.87774 
1 1 1   13    8   47 o   36.323   9.4126   42.726   21.826   7.1464   33.462   69.071   28.794   27.208   12.596   45.437   13.990 -18.22823 18.82521 
1 1 1   13    8   48 o   34.035   10.575   46.866   27.869   53.795   49.268   43.606   33.795   34.222   15.637   33.848   14.240 0.3736954 21.14980 
1 1 1   13    9    0 o   84.278   2.4851  147.273   12.168  147.273   12.168  147.273   12.168   84.278   3.5145   84.278   3.5145 0.000000 0.000000 
1 1 1   13    9    1 o  345.116   3.0165  2459.01   42.531  2465.95   56.443  2449.89   64.691  345.697   3.9587  344.536   4.5524 1.160614 6.032914 
1 1 1   13    9    2 o  555.038   4.3177  6357.49   97.672  6331.96  128.497  6392.42  150.314  553.779   5.6259  556.297   6.5513 -2.517456 8.635372 
1 1 1   13    9    3 o  268.448   2.9741  1486.13   30.990  1490.20   53.903  1484.12   37.875  268.691   4.8640  268.205   3.4239 0.4856262 5.948249 
1 1 1   13    9    4 f  249.777   2.5348  1284.48   25.761  1304.12   39.984  1270.55   33.684  251.396   3.8562  248.159   3.2910 3.236633 5.069630 
1 1 1   13    9    5 o  527.566   4.1319  5751.74   89.118  5775.21  118.574  5721.28  135.102  528.856   5.4361  526.276   6.2242 2.579834 8.263852 
1 1 1   13    9    6 o  285.751   2.8907  1684.71   34.063  1707.79   48.741  1662.69   47.622  287.662   4.1081  283.840   4.0679 3.821625 5.781394 
1 1 1   13    9    7 o  150.928   2.1956  468.411   13.517  480.264   20.832  459.794   17.764  152.566   3.3106  149.289   2.8849 3.277435 4.391240 
1 1 1   13    9    8 o   39.367   3.9165   32.179   6.0752   31.426   10.172   32.596   7.5743   38.998   6.3243   39.736   4.6216 -0.7380905 7.832988 
1 1 1   13    9    9 o  418.780   5.0892  3609.54   69.859  3654.38  157.969  3598.64   77.889  420.047   9.1182  417.512   4.5232 2.534637 10.17844 
1 1 1   13    9   10 o  239.517   2.5167  1186.77   24.665  1160.20   37.072  1207.87   33.039  237.094   3.7911  241.940   3.3109 -4.845612 5.033349 
1 1 1   13    9   11 o   72.659   2.6705  108.855   7.8229  109.489   12.471  108.445   10.045   72.826   4.1518   72.492   3.3598 0.3349304 5.340907 
1 1 1   13    9   12 o  116.960   2.2696  278.205   10.689  300.647   17.364  264.509   13.564  120.696   3.4881  113.224   2.9047 7.472633 4.539134 
1 1 1   13    9   13 o  194.232   2.4455  778.331   19.472  781.315   29.213  775.945   26.122  194.558   3.6405  193.905   3.2662 0.6526794 4.890989 
1 1 1   13    9   14 o  163.974   2.4669  553.150   16.599  572.622   24.932  537.645   22.247  166.552   3.6294  161.397   3.3420 5.154602 4.933722 
1 1 1   13    9   15 o  419.759   3.2748  3639.61   56.689  3665.47   80.863  3614.61   79.495  421.221   4.6545  418.296   4.6078 2.924988 6.549523 
1 1 1   13    9   16 o   77.008   4.8258  139.260   12.103  152.866   13.877   96.008   24.741   86.034   3.9106   67.981   8.8238 18.05329 9.651581 
1 1 1   13    9   17 o  336.816   3.0870  2344.94   42.435  2348.37   56.125  2340.38   64.838  337.154   4.0361  336.479   4.6720 0.6757813 6.173976 
1 1 1   13    9   18 o  121.680   2.7982  303.663   13.674  296.537   17.356  315.323   22.201  119.834   3.5116  123.526   4.3576 -3.692787 5.596447 
1 1 1   13    9   19 o  125.528   2.7274  320.549   13.763  304.674   17.411  346.995   22.472  121.467   3.4753  129.589   4.2044 -8.121986 5.454817 
1 1 1   13    9   20 o  220.875   2.4521  1007.48   22.337  1018.70   31.788  996.537   31.394  222.089   3.4703  219.661   3.4652 2.428253 4.904159 
1 1 1   13    9   21 o  283.328   2.9990  1659.27   35.043  1650.33   49.238  1668.44   49.884  282.558   4.2250  284.098   4.2573 -1.540558 5.997917 
1 1 1   13    9   22 o  147.531   3.3618  439.858   18.674  475.778   34.959  425.518   22.089  151.558   5.5927  143.504   3.7321 8.053421 6.723555 
1 1 1   13    9   23 o   67.609   4.2285   99.165   10.995  109.123   13.735   81.403   18.344   72.628   4.5852   62.590   7.1061 10.03789 8.457034 
1 1 1   13    9   24 o  105.044   3.3930  236.645   14.120  268.700   18.446  191.285   21.942  114.009   3.9228   96.079   5.5372 17.93064 6.785968 
1 1 1   13    9   25 o  101.272   3.2204  207.108   12.751  196.947   15.535  228.078   22.319   97.606   3.8591  104.937   5.1568 -7.330971 6.440845 
1 1 1   13    9   26 o   24.307   6.7848   7.5036   9.6416   10.286   11.420   0.5956   17.992   24.359   8.8263   24.255   10.307 0.1041126 13.56965 
1 1 1   13    9   27 f  128.423   3.0897  327.372   15.669  296.591   19.176  389.220   27.182  119.758   3.8823  137.088   4.8075 -17.33025 6.179332 
1 1 1   13    9   28 o   57.480   9.4986   99.025   14.431  105.249   14.947   13.509   55.403   71.245   5.0866   43.714   18.304 27.53133 18.99728 
1 1 1   13    9   29 o   70.649   4.6828  105.588   12.222  107.629   14.463  100.492   22.857   72.034   4.8681   69.264   8.0010 2.769325 9.365568 
1 1 1   13    9   30 o  118.365   3.8000  288.230   18.449  260.885   24.591  323.441   27.904  112.020   5.3225  124.710   5.4250 -12.68976 7.599945 
1 1 1   13    9   31 o  118.540   4.6780  296.337   22.663  269.038   33.336  319.796   30.902  113.286   7.1346  123.794   6.0523 -10.50785 9.355933 
1 1 1   13    9   32 o  116.921   3.5410  296.891   15.832  321.456   19.574  250.422   26.922  124.468   3.8129  109.374   5.9680 15.09445 7.082020 
1 1 1   13    9   33 o   31.523   8.3923   17.475   14.856   18.883   20.600   15.950   21.444   31.964   11.811   31.083   11.925 0.8814182 16.78468 
1 1 1   13    9   34 o   64.205   6.5739   88.396   17.256   96.619   26.596   82.418   22.677   66.625   9.6786   61.786   8.8990 4.839111 13.14790 
1 1 1   13    9   35 o  101.778   3.7147  206.905   14.407  191.516   17.070  245.011   26.862   95.801   4.3202  107.755   6.0441 -11.95320 7.429356 
1 1 1   13    9   36 o   24.778   7.3482   6.2097   10.331   6.8720   11.378   3.0985   24.660   21.924   8.6097   27.633   11.910 -5.709593 14.69648 
1 1 1   13    9   37 o   44.337   7.9727   53.856   12.123   58.185   12.939   22.730   34.691   52.320   5.9961   36.354   14.775 15.96594 15.94546 
1 1 1   13    9   38 o   24.136   6.4901   9.3239   9.7997   17.127   11.046 -19.5299   21.240   27.820   8.6815   20.452   9.6498 7.368504 12.98022 
1 1 1   13    9   39 o   24.320   7.1148   7.5712   10.639   11.193   11.865  -7.2977   24.038   24.282   8.9656   24.359   11.050 -0.7679367E-01 14.22952 
1 1 1   13    9   40 o   27.912   8.2073   9.9042   15.639   6.2847   21.810   13.735   22.437   26.601   11.327   29.224   11.880 -2.622742 16.41465 
1 1 1   13    9   41 f   25.079   7.7740   1.1667   15.346  -3.5313   20.607   7.0155   22.993   23.099   10.377   27.060   11.579 -3.960896 15.54794 
1 1 1   13    9   42 o   25.591   7.8636   3.9823   15.758  -5.8103   24.039   11.361   20.867   23.946   10.935   27.237   11.304 -3.290171 15.72725 
1 1 1   13    9   43 o   36.429   8.9838   35.874   16.699   39.402   22.613   31.642   24.765   38.119   12.478   34.740   12.928 3.379040 17.96762 
1 1 1   13    9   44 o   50.565   8.6574   69.707   17.873   72.405   24.955   66.866   25.610   51.995   11.895   49.135   12.582 2.859928 17.31480 
1 1 1   13    9   45 o   26.926   7.7250  -2.7171   16.938   38.798   23.852 -44.9496   24.058   36.463   12.807   17.390   8.6425 19.07323 15.45007 
1 1 1   13    9   46 o   34.932   9.8227   39.032   21.508   31.638   32.950   44.522   28.391   32.854   13.954   37.010   13.828 -4.156273 19.64531 
1 1 1   13    9   47 o   31.642   9.2801   30.112   21.181   10.513   32.374   44.781   28.008   27.324   12.556   35.960   13.669 -8.636232 18.56011 
1 1 1   13    9   48 o   23.264   8.0007 -23.6562   25.834 -81.8822   46.217   2.8058   31.157   21.268   10.757   25.261   11.846 -3.992781 16.00140 
1 1 1   13   10    0 o  299.437   3.6384  1851.77   63.505  1851.77   63.505  1851.77   63.505  299.437   5.1455  299.437   5.1455 0.000000 0.000000 
1 1 1   13   10    1 o  362.120   4.5195  2722.20   54.686  2731.51   61.466  2686.83  119.782  363.807   4.0963  360.433   8.0575 3.373627 9.039016 
1 1 1   13   10    2 o  150.473   2.2102  467.269   13.550  467.993   17.834  466.282   20.841  150.616   2.8709  150.330   3.3612 0.2859650 4.420429 
1 1 1   13   10    3 o  343.831   2.7867  2439.52   39.516  2454.26   56.275  2425.19   55.502  344.855   3.9565  342.808   3.9255 2.046997 5.573444 
1 1 1   13   10    4 o  225.368   2.2421  1046.95   20.828  1074.70   30.100  1021.46   28.851  228.230   3.1976  222.506   3.1438 5.723541 4.484187 
1 1 1   13   10    5 o  112.165   2.2210  260.094   10.171  263.375   13.506  255.796   15.458  112.988   2.8982  111.342   3.3662 1.645271 4.441940 
1 1 1   13   10    6 o  198.124   2.3442  810.193   18.943  811.728   25.009  808.126   29.014  198.352   3.0569  197.895   3.5547 0.4567261 4.688339 
1 1 1   13   10    7 o   85.997   2.3520  152.261   8.2865  155.455   12.521  149.772   11.054   86.796   3.4977   85.199   3.1456 1.596176 4.704066 
1 1 1   13   10    8 o  456.531   5.3593  4334.39   81.962  4272.50  178.795  4350.86   92.223  454.036   9.5477  459.026   4.8712 -4.990082 10.71857 
1 1 1   13   10    9 o   59.404   3.3807   75.470   7.6052   66.080   13.343   79.989   9.2561   56.552   5.7204   62.256   3.6048 -5.703934 6.761441 
1 1 1   13   10   10 f   59.604   3.1990   76.899   7.4516   59.846   11.794   88.230   9.6137   53.823   5.3127   65.384   3.5649 -11.56065 6.397911 
1 1 1   13   10   11 o  165.234   2.2277  556.912   14.682  588.401   24.353  538.931   18.403  168.849   3.4970  161.619   2.7608 7.230011 4.455439 
1 1 1   13   10   12 o  466.980   3.6312  4491.50   67.426  4557.31  111.652  4453.73   84.592  469.553   5.7652  464.408   4.4164 5.145111 7.262390 
1 1 1   13   10   13 o  248.895   2.6462  1273.64   26.901  1315.60   41.296  1242.71   35.456  252.424   3.9666  245.365   3.5036 7.059174 5.292343 
1 1 1   13   10   14 o  213.861   2.5065  945.030   22.001  935.214   32.680  953.167   29.755  212.833   3.7229  214.889   3.3572 -2.055984 5.013031 
1 1 1   13   10   15 o  151.148   2.4250  472.409   15.077  459.945   21.974  483.497   20.726  149.254   3.5695  153.042   3.2835 -3.787781 4.850029 
1 1 1   13   10   16 o  109.511   2.7490  247.230   12.240  244.849   15.980  250.611   19.038  108.889   3.5581  110.133   4.1913 -1.244652 5.497919 
1 1 1   13   10   17 o  277.570   3.1982  1591.18   34.285  1588.91   41.707  1595.90   60.213  277.375   3.6456  277.766   5.2559 -0.3918762 6.396469 
1 1 1   13   10   18 f  309.036   2.9822  1976.94   37.617  1999.24   49.895  1947.58   57.259  311.103   3.8885  306.968   4.5225 4.134949 5.964391 
1 1 1   13   10   19 o  230.968   2.4689  1101.72   23.519  1107.18   33.323  1096.31   33.200  231.538   3.4895  230.398   3.4938 1.140045 4.937884 
1 1 1   13   10   20 o  266.339   2.5883  1465.46   28.432  1467.20   40.204  1463.72   40.214  266.498   3.6577  266.181   3.6630 0.3170471 5.176540 
1 1 1   13   10   21 o   48.679   5.6913   53.110   10.487   62.315   13.526   39.238   16.605   54.837   5.9806   42.521   9.6848 12.31642 11.38261 
1 1 1   13   10   22 o   93.175   2.8996  179.125   11.132  171.292   15.326  187.870   16.194   91.025   4.0823   95.326   4.1190 -4.300758 5.799246 
1 1 1   13   10   23 o  107.906   3.4201  239.015   15.155  212.892   20.455  270.808   22.566  101.418   4.8901  114.393   4.7828 -12.97516 6.840181 
1 1 1   13   10   24 o   99.139   3.3815  204.161   13.516  206.956   17.437  199.954   21.394  100.033   4.2262   98.246   5.2798 1.786568 6.762924 
1 1 1   13   10   25 o   91.869   3.5197  173.662   12.667  171.266   15.585  178.325   21.742   91.000   4.1524   92.739   5.6842 -1.739418 7.039401 
1 1 1   13   10   26 o   62.539   5.0293   90.729   11.324  106.186   13.867   59.799   19.616   71.613   4.6950   53.464   8.8957 18.14899 10.05862 
1 1 1   13   10   27 o   75.603   4.3042  112.228   12.971   94.877   16.019  145.270   22.106   67.611   5.7445   83.595   6.4114 -15.98448 8.608477 
1 1 1   13   10   28 o  200.484   3.7592  835.623   28.006  837.405   33.107  831.139   52.516  201.143   3.9907  199.825   6.3719 1.318237 7.518444 
1 1 1   13   10   29 f   54.548   6.3027   71.864   11.526   80.906   13.558   48.306   21.886   62.405   5.2676   46.690   11.452 15.71488 12.60532 
1 1 1   13   10   30 o  140.922   3.5074  408.684   20.219  384.395   26.643  441.671   31.049  136.073   4.7472  145.770   5.1643 -9.696899 7.014711 
1 1 1   13   10   31 o   78.826   6.3078  136.713   19.725  103.704   29.517  163.350   26.515   69.535   10.292   88.118   7.2956 -18.58304 12.61551 
1 1 1   13   10   32 f   83.845   4.0275  140.897   12.834  131.912   15.201  163.197   23.948   79.594   4.6305   88.097   6.5910 -8.503395 8.054944 
1 1 1   13   10   33 o   97.197   4.4227  199.174   17.711  203.480   24.668  194.592   25.445   98.338   6.0820   96.056   6.4227 2.281876 8.845433 
1 1 1   13   10   34 o  106.310   4.5681  238.242   19.957  245.414   29.681  232.322   26.963  107.677   6.6832  104.943   6.2294 2.734207 9.136246 
1 1 1   13   10   35 o   66.475   6.0614   95.768   16.574   86.550   22.825  106.048   24.104   63.017   8.7819   69.933   8.3570 -6.915691 12.12275 
1 1 1   13   10   36 o   21.363   6.7884  -1.5307   10.234   0.8439   11.289 -12.4754   24.237   19.058   8.1329   23.668   10.871 -4.610262 13.57687 
1 1 1   13   10   37 o   90.295   5.6348  168.679   15.158  164.901   16.438  190.142   39.183   88.661   4.4953   91.928   10.334 -3.266716 11.26963 
1 1 1   13   10   38 o   41.864   7.0338   43.376   10.973   46.760   12.568   32.526   22.503   46.642   6.5333   37.085   12.458 9.557297 14.06754 
1 1 1   13   10   39 o   33.417   7.9226   25.031   11.527   25.309   12.986   23.998   25.033   33.031   9.1942   33.804   12.905 -0.7733078 15.84517 
1 1 1   13   10   40 o   25.144   7.1916   9.5083   10.255   10.058   11.653   7.6207   21.594   23.418   8.8370   26.870   11.348 -3.452787 14.38310 
1 1 1   13   10   41 o   25.530   7.7829   2.9229   15.477   14.108   21.252  -9.7104   22.586   28.493   11.570   22.568   10.413 5.925394 15.56589 
1 1 1   13   10   42 o   42.530   7.2031   47.724   11.753   51.998   13.584   34.993   23.444   48.494   6.7915   36.566   12.705 11.92799 14.40611 
1 1 1   13   10   43 o   68.083   7.2639  139.221   15.085  167.912   17.814   66.514   28.359   88.289   4.8921   47.877   13.679 40.41237 14.52788 
1 1 1   13   10   44 o   26.238   8.2373   2.9111   18.391   16.374   25.572 -11.5103   26.467   29.229   12.347   23.247   10.907 5.982069 16.47464 
1 1 1   13   10   45 o   29.981   9.5391   15.821   24.647   17.443   32.495   13.625   37.819   29.931   13.264   30.030   13.713 -0.9834862E-01 19.07830 
1 1 1   13   10   46 o   33.431   10.018   34.911   24.032   39.227   33.220   30.172   34.809   34.540   14.293   32.321   14.040 2.218983 20.03539 
1 1 1   13   10   47 o   39.554   9.9330   58.277   21.266   46.125   33.387   66.573   27.586   34.926   14.378   44.183   13.709 -9.257935 19.86608 
1 1 1   13   11    0 o  541.455   4.5128  6054.46  142.479  6054.46  142.479  6054.46  142.479  541.455   6.3820  541.455   6.3820 0.000000 0.000000 
1 1 1   13   11    1 o  280.943   2.6706  1629.97   30.663  1637.40   40.758  1620.29   46.544  281.694   3.5081  280.192   4.0276 1.502228 5.341194 
1 1 1   13   11    2 o  279.880   2.6708  1614.62   30.450  1604.43   39.980  1628.71   46.991  278.844   3.4763  280.916   4.0558 -2.072174 5.341692 
1 1 1   13   11    3 o  151.539   2.0422  473.765   12.764  471.487   18.029  476.054   18.073  151.174   2.8915  151.904   2.8847 -0.7304077 4.084387 
1 1 1   13   11    4 o  395.507   3.3140  3228.49   53.489  3236.40   81.855  3222.60   70.662  395.897   5.0130  395.116   4.3361 0.7806702 6.628074 
1 1 1   13   11    5 o   57.046   3.0531   70.189   6.8656   53.034   10.504   82.982   9.0714   50.678   5.0256   63.414   3.4683 -12.73638 6.106258 
1 1 1   13   11    6 o  228.590   2.4249  1077.73   22.653  1074.13   30.048  1082.46   34.479  228.159   3.1931  229.021   3.6502 -0.8624268 4.849701 
1 1 1   13   11    7 o  309.505   2.8353  1978.22   35.850  1970.96   54.534  1983.74   47.575  308.985   4.2792  310.025   3.7206 -1.040283 5.670508 
1 1 1   13   11    8 o  245.407   3.6173  1239.99   27.687  1250.04   66.704  1237.90   30.432  245.877   6.5776  244.937   3.0124 0.9400940 7.234581 
1 1 1   13   11    9 o  381.452   3.6860  3001.40   54.465  3018.61   95.174  2993.01   66.415  382.153   6.0383  380.752   4.2292 1.401001 7.372088 
1 1 1   13   11   10 o  375.656   3.6322  2925.05   53.383  2884.17   90.974  2946.51   65.927  373.542   5.9049  377.771   4.2312 -4.228119 7.264380 
1 1 1   13   11   11 o  197.487   2.4295  806.568   19.732  780.517   28.737  829.807   27.142  194.456   3.5831  200.517   3.2819 -6.061066 4.858915 
1 1 1   13   11   12 o  330.972   2.8481  2269.52   38.007  2225.02   60.181  2299.05   49.020  328.217   4.4456  333.726   3.5614 -5.508575 5.696231 
1 1 1   13   11   13 o  291.538   2.6726  1751.85   31.157  1767.20   50.813  1742.59   39.443  292.518   4.2117  290.558   3.2913 1.959686 5.345176 
1 1 1   13   11   14 o   96.855   2.6529  193.587   10.578  195.757   15.472  191.681   14.496   97.360   3.8529   96.349   3.6479 1.011971 5.305822 
1 1 1   13   11   15 o  192.443   2.4720  762.966   19.515  781.304   29.312  748.367   26.153  194.503   3.6538  190.383   3.3307 4.120590 4.944079 
1 1 1   13   11   16 o  227.902   2.7314  1066.61   25.569  1007.74   34.323  1140.01   38.327  220.887   3.7675  234.917   3.9557 -14.03050 5.462703 
1 1 1   13   11   17 o  242.424   4.3432  1225.78   32.166  1230.15   35.222  1203.79   78.953  244.074   3.4989  240.774   7.9505 3.299988 8.686347 
1 1 1   13   11   18 o  191.968   2.6041  753.847   20.118  729.110   25.581  793.955   32.572  187.909   3.3006  196.026   4.0287 -8.116318 5.208131 
1 1 1   13   11   19 o   57.635   3.5395   68.719   8.4016   73.807   12.002   63.830   11.765   59.732   4.8716   55.538   5.1362 4.193424 7.079094 
1 1 1   13   11   20 o  190.791   2.3883  751.638   18.790  771.828   26.785  732.075   26.366  193.315   3.3595  188.267   3.3955 5.047180 4.776518 
1 1 1   13   11   21 o   99.069   2.9538  202.654   12.042  206.735   17.705  199.141   16.428   99.989   4.2931   98.149   4.0582 1.839607 5.907591 
1 1 1   13   11   22 o  161.542   2.5634  536.693   16.992  515.788   22.727  563.188   25.586  158.004   3.4875  165.080   3.7579 -7.076004 5.126805 
1 1 1   13   11   23 o  115.099   3.2922  272.166   15.569  251.038   20.942  298.272   23.279  110.145   4.6099  120.052   4.7015 -9.907661 6.584465 
1 1 1   13   11   24 o  187.147   2.7019  713.680   19.888  690.893   24.478  757.932   34.111  182.878   3.2453  191.417   4.3207 -8.538940 5.403729 
1 1 1   13   11   25 o  249.749   3.8020  1315.03   38.116  1185.45   59.553  1404.95   49.608  238.981   6.0419  260.518   4.6168 -21.53755 7.603908 
1 1 1   13   11   26 o  160.835   2.8662  525.038   18.062  504.205   22.101  566.939   31.343  156.191   3.4308  165.479   4.5924 -9.287857 5.732366 
1 1 1   13   11   27 o  144.809   3.5232  429.205   19.659  419.522   23.747  450.291   35.043  142.378   4.0440  147.239   5.7706 -4.860443 7.046489 
1 1 1   13   11   28 o  152.013   4.9150  529.715   27.288  366.530   46.955  612.934   33.531  132.102   8.6179  171.923   4.7288 -39.82059 9.830032 
1 1 1   13   11   29 o  209.576   3.5302  899.155   25.882  887.703   29.515  937.272   53.847  207.119   3.4551  212.032   6.1573 -4.913696 7.060490 
1 1 1   13   11   30 o   83.921   4.0456  130.289   12.891  107.760   15.064  191.940   24.919   71.986   5.0736   95.857   6.3028 -23.87081 8.091179 
1 1 1   13   11   31 o   63.966   6.5090   85.419   16.377   63.978   21.270  116.637   25.666   53.824   9.9478   74.108   8.3969 -20.28448 13.01793 
1 1 1   13   11   32 o   45.072   6.2809   60.282   11.610   83.071   13.780   4.5160   21.555   63.029   5.3007   27.115   11.389 35.91347 12.56175 
1 1 1   13   11   33 o   42.934   8.2300   42.337   15.098   34.417   21.196   50.494   21.510   38.969   12.004   46.900   11.262 -7.930462 16.46008 
1 1 1   13   11   34 o  148.496   4.0865  475.341   24.393  389.962   36.486  544.346   32.801  135.735   6.5173  161.256   4.9318 -25.52068 8.173015 
1 1 1   13   11   35 o   22.316   6.6895   3.6680   9.8975   7.5079   11.200 -10.0176   21.145   22.155   8.5866   22.476   10.260 -0.3206539 13.37906 
1 1 1   13   11   36 o   80.648   4.5864  139.718   13.926  140.974   16.672  136.818   25.331   81.836   4.9394   79.460   7.7294 2.376228 9.172853 
1 1 1   13   11   37 o   44.782   6.9356   51.437   11.256   57.600   12.982   32.765   22.596   52.030   6.0494   37.534   12.483 14.49590 13.87121 
1 1 1   13   11   38 o   30.792   7.1178   22.997   10.728   28.577   12.011   0.9712   23.862   35.317   8.3729   26.267   11.513 9.050404 14.23554 
1 1 1   13   11   39 o   45.170   6.9931   41.945   11.114   36.000   12.626   62.397   23.418   39.778   7.9738   50.562   11.491 -10.78376 13.98624 
1 1 1   13   11   40 o   26.955   7.5315   11.168   10.226   9.4250   11.370   18.547   23.390   22.906   8.7084   31.003   12.291 -8.096622 15.06306 
1 1 1   13   11   41 o   22.380   7.3172 -13.3250   16.159 -26.1954   22.159   1.2930   23.615   19.293   9.3056   25.466   11.295 -6.172434 14.63443 
1 1 1   13   11   42 o   22.726   6.8335   5.7822   10.366   8.7593   11.784  -4.4012   21.795   22.410   8.7737   23.043   10.479 -0.6321583 13.66707 
1 1 1   13   11   43 o   33.107   7.9289   28.444   11.974   29.634   13.435   23.850   26.396   34.539   9.2474   31.674   12.882 2.865065 15.85783 
1 1 1   13   11   44 f   37.013   7.0038   41.185   12.682   51.401   14.398   5.8274   26.785   47.370   7.3692   26.656   11.912 20.71466 14.00751 
1 1 1   13   11   45 o   46.048   8.5333   52.146   15.610   52.146   15.610   0.0000   0.0000   46.048   8.5333  ?   ?       ?      ? 
1 1 1   13   11   46 o   20.986   6.6262  -0.5890   12.601   11.142   13.548 -75.8038   34.305   23.292   9.3150   18.679   9.4262 4.612865 13.25230 
1 1 1   13   11   47 o   36.671   8.6111   42.037   14.067   41.479   15.520   44.604   33.293   39.113   9.6744   34.229   14.248 4.884773 17.22214 
1 1 1   13   12    0 o  394.565   3.5338  3214.29   81.300  3214.29   81.300  3214.29   81.300  394.565   4.9976  394.565   4.9976 0.000000 0.000000 
1 1 1   13   12    1 o  179.609   2.2671  666.071   16.632  668.728   22.065  662.575   25.311  180.032   2.9715  179.187   3.4248 0.8448486 4.534217 
1 1 1   13   12    2 o  183.724   2.2730  695.414   17.020  689.526   22.368  703.512   26.233  182.809   2.9666  184.638   3.4448 -1.828568 4.546090 
1 1 1   13   12    3 o  274.990   2.4530  1560.27   27.817  1545.78   38.954  1575.36   39.737  273.688   3.4509  276.292   3.4871 -2.604126 4.905968 
1 1 1   13   12    4 o  220.310   2.2244  1001.52   20.212  1002.41   28.588  1000.64   28.581  220.408   3.1448  220.213   3.1468 0.1947784 4.448827 
1 1 1   13   12    5 o  229.777   2.2652  1089.48   21.467  1086.90   30.326  1092.07   30.392  229.504   3.2038  230.049   3.2031 -0.5454102 4.530335 
1 1 1   13   12    6 o  290.125   2.5250  1736.45   30.203  1710.41   42.053  1764.19   43.408  287.881   3.5417  292.368   3.5997 -4.487732 5.049942 
1 1 1   13   12    7 o  224.661   2.6746  1053.85   22.959  1009.50   40.662  1074.60   27.818  221.112   4.4587  228.210   2.9555 -7.098312 5.349287 
1 1 1   13   12    8 o  248.706   2.8974  1281.94   28.102  1261.77   48.191  1292.33   34.592  247.173   4.7271  250.240   3.3516 -3.067780 5.794746 
1 1 1   13   12    9 o  205.088   3.4268  870.436   23.483  866.099   51.544  871.572   26.380  204.664   6.1062  205.511   3.1123 -0.8464508 6.853619 
1 1 1   13   12   10 o  236.616   3.7487  1139.09   31.093  1191.31   64.610  1123.35   35.471  239.960   6.5283  233.273   3.6868 6.687119 7.497376 
1 1 1   13   12   11 o  127.933   2.3966  335.970   12.594  357.740   18.875  318.502   16.908  131.645   3.4763  124.222   3.3001 7.423225 4.793280 
1 1 1   13   12   12 o  225.281   2.6289  1042.19   24.357  970.928   32.975  1127.75   36.132  216.854   3.6869  233.707   3.7484 -16.85291 5.257740 
1 1 1   13   12   13 o  183.858   2.2729  695.908   16.733  705.815   27.233  689.900   21.208  184.884   3.5713  182.832   2.8124 2.052048 4.545769 
1 1 1   13   12   14 o   70.094   3.0148  101.332   8.6904  103.925   12.857   99.150   11.792   70.914   4.3959   69.275   4.1271 1.639328 6.029650 
1 1 1   13   12   15 o   81.445   2.8947  137.127   9.7093  127.953   13.677  146.447   13.785   78.693   4.2141   84.197   3.9697 -5.504272 5.789361 
1 1 1   13   12   16 o  114.869   3.4934  269.567   14.098  266.649   16.111  279.107   29.128  113.637   3.4373  116.102   6.0827 -2.464363 6.986784 
1 1 1   13   12   17 o  131.978   3.3508  368.500   15.915  377.738   18.572  342.973   30.874  135.251   3.3293  128.704   5.8162 6.547424 6.701663 
1 1 1   13   12   18 o  184.802   2.5110  703.004   19.024  726.965   28.717  684.265   25.396  187.584   3.7117  182.020   3.3829 5.564606 5.022018 
1 1 1   13   12   19 o   58.616   3.4510   71.356   8.3042   63.993   11.818   78.537   11.671   55.607   5.1529   61.625   4.5918 -6.018150 6.901965 
1 1 1   13   12   20 o  196.103   3.0926  811.055   23.388  749.531   40.295  842.312   28.722  190.280   5.1344  201.926   3.4487 -11.64575 6.185108 
1 1 1   13   12   21 o  117.640   2.6645  285.664   12.920  275.686   17.899  296.520   18.669  115.498   3.7575  119.782   3.7790 -4.283180 5.329071 
1 1 1   13   12   22 o  121.617   2.9175  296.779   14.068  275.167   17.358  338.149   24.016  115.391   3.6473  127.842   4.5548 -12.45074 5.835087 
1 1 1   13   12   23 o  132.902   3.0963  365.823   16.912  370.791   23.055  360.036   24.885  133.899   4.1746  131.905   4.5741 1.993744 6.192695 
1 1 1   13   12   24 o   99.794   3.2713  200.807   12.830  189.522   15.702  223.474   22.254   95.734   3.9768  103.855   5.1953 -8.121315 6.542650 
1 1 1   13   12   25 o   40.527   6.6464   35.691   10.461   35.871   12.852   35.338   18.009   40.793   7.9242   40.261   10.673 0.5325813 13.29280 
1 1 1   13   12   26 o  294.511   3.4431  1795.88   41.802  1719.30   58.256  1877.17   60.017  288.034   4.9038  300.988   4.8346 -12.95410 6.886221 
1 1 1   13   12   27 o   88.078   4.1340  154.824   13.735  146.060   16.193  177.298   25.931   83.941   4.6772   92.216   6.8178 -8.274658 8.267924 
1 1 1   13   12   28 o  258.422   4.0834  1393.73   43.354  1443.24   59.433  1337.42   63.381  263.462   5.4694  253.382   6.0648 10.08049 8.166785 
1 1 1   13   12   29 o   84.066   6.1988  149.661   18.891  150.298   22.039  147.898   36.677   84.865   6.2964   83.267   10.680 1.598167 12.39754 
1 1 1   13   12   30 f  129.771   4.4067  353.035   23.370  293.788   32.490  416.546   33.639  118.338   6.6568  141.206   5.7760 -22.86809 8.813364 
1 1 1   13   12   31 o   23.878   7.0614   2.9682   9.6719   1.3838   10.856   9.0650   21.296   19.185   8.0713   28.570   11.589 -9.384832 14.12280 
1 1 1   13   12   32 o   99.663   3.7513  205.371   14.207  201.275   16.983  214.924   25.933   98.316   4.1881  101.009   6.2248 -2.692627 7.502556 
1 1 1   13   12   33 o   55.328   6.9706   67.814   15.531   71.669   21.699   63.764   22.240   57.548   9.1420   53.107   10.525 4.440395 13.94126 
1 1 1   13   12   34 o   41.901   7.0217   34.178   10.766   27.190   12.377   55.913   21.827   34.713   8.6702   49.090   11.047 -14.37706 14.04331 
1 1 1   13   12   35 o   33.739   7.7135   26.886   11.571   30.435   12.854   11.718   26.570   36.628   8.6470   30.851   12.776 5.776819 15.42696 
1 1 1   13   12   36 o   30.051   7.4730   14.197   9.8825   9.5976   11.123   31.436   21.535   23.215   8.6591   36.886   12.182 -13.67026 14.94596 
1 1 1   13   12   37 o   22.132   6.8152   1.9048   9.6479   2.5539   10.745  -0.7949   21.913   19.300   8.0692   24.965   10.985 -5.665327 13.63037 
1 1 1   13   12   38 o   36.847   8.3417   36.154   12.906   40.701   13.392 -23.0803   48.334   42.479   7.9356   31.215   14.675 11.26486 16.68346 
1 1 1   13   12   39 o   35.930   7.1609   34.085   11.245   40.044   12.876   14.931   23.085   42.067   7.7049   29.793   12.073 12.27463 14.32188 
1 1 1   13   12   40 o   43.055   7.3276   41.987   11.290   39.049   12.846   51.961   23.665   41.281   7.8311   44.829   12.387 -3.547821 14.65516 
1 1 1   13   12   41 o   73.380   4.8531  116.674   13.488  112.985   16.085  125.416   24.761   72.419   5.3850   74.341   8.0755 -1.921364 9.706295 
1 1 1   13   12   42 o   70.656   5.9749  121.553   14.463  127.918   16.790  103.242   28.477   76.856   5.2968   64.457   10.712 12.39936 11.94981 
1 1 1   13   12   43 o   27.251   7.8836   7.8126   11.388   2.0371   12.613   33.283   26.488   19.690   8.5025   34.811   13.278 -15.12047 15.76718 
1 1 1   13   12   44 o   50.547   8.8578   87.798   17.207   93.721   18.418   47.144   48.255   64.104   6.9662   36.991   16.288 27.11337 17.71560 
1 1 1   13   12   45 o   28.025   10.139   19.949   15.061   19.949   15.061   0.0000   0.0000   28.025   10.139  ?   ?       ?      ? 
1 1 1   13   12   46 o   31.431   7.9199   30.812   14.132   36.886   15.518   1.2878   34.211   36.745   9.9806   26.118   12.300 10.62680 15.83987 
1 1 1   13   12   47 o   25.470   7.9791   11.097   14.103   8.9470   15.836   19.336   31.003   22.699   9.6583   28.242   12.704 -5.542139 15.95822 
1 1 1   13   13    0 o  232.194   2.6203  1113.15   35.468  1113.15   35.468  1113.15   35.468  232.194   3.7057  232.194   3.7057 0.000000 0.000000 
1 1 1   13   13    1 f  224.759   2.4203  1040.99   22.169  1032.66   29.130  1052.45   34.172  223.705   3.1572  225.814   3.6691 -2.108902 4.840504 
1 1 1   13   13    2 o  290.221   2.7219  1737.99   32.222  1734.56   42.512  1742.61   49.398  289.905   3.5554  290.536   4.1224 -0.6319580 5.443775 
1 1 1   13   13    3 o  248.522   2.3326  1274.57   23.910  1276.04   33.843  1273.10   33.785  248.665   3.2998  248.379   3.2979 0.2863159 4.665290 
1 1 1   13   13    4 o  390.895   3.0384  3154.75   48.985  3146.56   69.063  3163.05   69.489  390.385   4.2893  391.405   4.3045 -1.019958 6.076766 
1 1 1   13   13    5 o  150.057   2.3457  460.972   14.455  506.895   21.697  424.320   19.384  156.722   3.3566  143.392   3.2775 13.32979 4.691363 
1 1 1   13   13    6 o  267.978   2.6134  1482.18   28.605  1483.33   43.603  1481.30   37.900  268.052   3.9439  267.903   3.4300 0.1487732 5.226815 
1 1 1   13   13    7 o  104.096   2.5999  229.096   10.157  210.429   18.356  237.334   12.194  100.943   4.4090  107.249   2.7567 -6.305412 5.199880 
1 1 1   13   13    8 o  229.802   2.4638  1086.92   23.009  1108.18   35.896  1072.09   29.977  231.686   3.7565  227.917   3.1890 3.768982 4.927535 
1 1 1   13   13    9 o  138.416   2.5332  397.889   13.656  388.223   23.428  402.865   16.807  137.111   4.1428  139.721   2.9165 -2.610321 5.066422 
1 1 1   13   13   10 o  285.714   3.0004  1692.16   32.417  1670.62   58.945  1701.49   38.813  284.317   5.0267  287.110   3.2777 -2.792725 6.000896 
1 1 1   13   13   11 o  135.638   2.5310  380.218   12.948  378.984   23.709  380.743   15.456  135.448   4.2440  135.829   2.7590 -0.3808746 5.061921 
1 1 1   13   13   12 o  353.331   2.9705  2577.96   41.943  2585.20   68.415  2573.59   53.090  353.647   4.6905  353.016   3.6463 0.6311951 5.941032 
1 1 1   13   13   13 o  103.704   2.3501  223.902   9.7873  213.626   15.553  230.640   12.593  101.702   3.7078  105.706   2.8885 -4.003792 4.700147 
1 1 1   13   13   14 f  152.270   2.6787  480.902   16.285  470.816   26.461  487.051   20.661  150.949   4.2502  153.592   3.2614 -2.642731 5.357329 
1 1 1   13   13   15 o   44.155   5.5590   43.578   9.5017   59.034   13.067   26.235   13.841   53.400   5.9329   34.911   9.4027 18.48901 11.11800 
1 1 1   13   13   16 o  123.019   3.2476  313.445   16.239  316.240   21.287  309.555   25.117  123.704   4.1721  122.335   4.9780 1.368988 6.495156 
1 1 1   13   13   17 o   34.061   6.9347   30.662   10.089   36.856   10.429 -59.9324   39.882   42.176   5.9952   25.946   12.507 16.22926 13.86938 
1 1 1   13   13   18 o  227.221   3.3874  1072.14   30.689  1084.61   38.849  1051.45   50.048  229.076   4.1119  225.366   5.3844 3.710022 6.774892 
1 1 1   13   13   19 o   46.143   4.2281   44.386   7.9988   40.924   11.656   47.469   10.997   44.416   6.3625   47.869   5.5699 -3.452965 8.456125 
1 1 1   13   13   20 o   60.512   3.7282   75.784   9.2657   76.310   13.770   75.349   12.525   60.692   5.5009   60.331   5.0337 0.3609467 7.456418 
1 1 1   13   13   21 o  160.459   2.5287  532.092   16.690  532.903   22.800  531.156   24.499  160.602   3.4421  160.315   3.7052 0.2872467 5.057306 
1 1 1   13   13   22 o   98.583   3.4213  194.115   13.021  182.194   15.632  221.140   23.536   93.869   4.0376  103.296   5.5243 -9.427490 6.842509 
1 1 1   13   13   23 o  126.597   3.3434  331.550   17.451  343.696   25.026  320.055   24.347  128.854   4.7090  124.340   4.7475 4.514343 6.686828 
1 1 1   13   13   24 o  167.079   2.8278  569.229   18.886  545.891   23.708  609.753   31.241  162.513   3.5370  171.646   4.4129 -9.133575 5.655503 
1 1 1   13   13   25 o   94.640   3.6641  188.212   14.000  200.126   18.383  171.762   21.601   98.313   4.5337   90.967   5.7574 7.345039 7.328142 
1 1 1   13   13   26 o  157.916   3.5651  505.920   22.492  474.447   28.106  561.971   37.508  151.328   4.5031  164.503   5.5282 -13.17500 7.130128 
1 1 1   13   13   27 o   28.962   7.2349   16.014   10.325   18.308   12.149   10.050   19.591   29.470   9.0897   28.454   11.258 1.016081 14.46976 
1 1 1   13   13   28 o   64.986   4.8997   91.357   11.964   96.324   14.467   80.610   21.279   68.079   5.1522   61.892   8.3357 6.186344 9.799432 
1 1 1   13   13   29 o   93.784   5.2380  162.625   14.461  154.075   15.520  218.933   39.830   86.146   4.3682  101.422   9.5218 -15.27514 10.47596 
1 1 1   13   13   30 o   74.022   5.1625  125.121   13.944  140.383   16.933   92.962   24.580   82.062   5.0029   65.982   9.0321 16.07973 10.32509 
1 1 1   13   13   31 o   55.296   6.0205   70.909   11.713   77.479   14.044   55.899   21.228   60.806   5.6001   49.786   10.659 11.01969 12.04096 
1 1 1   13   13   32 o   71.513   4.5242  106.361   12.083  104.133   14.265  112.017   22.732   70.559   4.9019   72.467   7.6057 -1.908058 9.048448 
1 1 1   13   13   33 o   85.784   3.9602  149.863   12.960  142.329   15.441  167.824   23.841   82.540   4.5358   89.028   6.4929 -6.488335 7.920343 
1 1 1   13   13   34 f   71.381   4.6544  106.289   12.489  102.856   14.780  114.857   23.352   69.886   5.1278   72.876   7.7690 -2.990150 9.308725 
1 1 1   13   13   35 o   79.562   5.2061  139.212   14.630  142.022   16.943  130.978   29.003   82.117   5.0027   77.008   9.1316 5.108429 10.41217 
1 1 1   13   13   36 o   45.851   6.9008   50.547   11.366   53.726   13.191   41.385   22.393   50.163   6.3759   41.539   12.241 8.624020 13.80168 
1 1 1   13   13   37 o   27.267   6.7144   16.027   10.248   23.608   11.703  -8.9158   21.226   32.048   8.6516   22.486   10.271 9.562635 13.42885 
1 1 1   13   13   38 o   48.198   9.6321   57.141   13.421   57.359   13.896   54.104   51.789   51.510   6.5409   44.887   18.120 6.622917 19.26424 
1 1 1   13   13   39 o   31.227   7.6266   13.529   10.483   6.0894   11.739   42.830   23.297   21.412   8.6326   41.042   12.575 -19.63004 15.25324 
1 1 1   13   13   40 o   62.690   6.2396   98.126   13.206  107.875   15.677   74.307   24.505   70.844   5.3653   54.537   11.267 16.30655 12.47922 
1 1 1   13   13   41 o   58.452   5.8091   73.000   12.350   67.489   14.231   89.813   24.856   55.505   6.2162   61.400   9.8154 -5.894630 11.61821 
1 1 1   13   13   42 o   42.179   8.2278   43.494   12.667   40.179   14.144   56.924   28.467   40.745   8.6824   43.614   13.979 -2.869171 16.45563 
1 1 1   13   13   43 o   29.745   6.9076   23.558   12.037   34.269   13.524 -17.2786   26.407   37.298   8.9129   22.192   10.555 15.10652 13.81514 
1 1 1   13   13   44 o   25.693   7.7580   11.859   12.427   13.590   13.536   2.5738   31.353   24.746   9.4794   26.641   12.284 -1.894272 15.51599 
1 1 1   13   13   45 o   26.772   8.7912  -4.4338   24.552 -36.6381   34.979   26.839   34.470   22.154   10.901   31.389   13.796 -9.235121 17.58244 
1 1 1   13   13   46 o   18.965   6.2881  -7.3131   12.338   2.7422   13.653 -52.1216   28.820   19.756   8.6824   18.174   9.0981 1.581413 12.57617 
1 1 1   13   14    0 o  427.689   3.7526  3777.67   93.581  3777.67   93.581  3777.67   93.581  427.689   5.3069  427.689   5.3069 0.000000 0.000000 
1 1 1   13   14    1 o  229.343   2.4322  1086.88   22.809  1095.52   30.394  1075.73   34.509  230.401   3.1984  228.285   3.6651 2.116516 4.864453 
1 1 1   13   14    2 o   70.535   2.5128  101.943   7.2601   96.708   9.6239  108.858   11.060   68.451   3.4088   72.619   3.6926 -4.167809 5.025508 
1 1 1   13   14    3 o  177.772   2.0891  652.096   15.317  656.525   21.784  647.766   21.540  178.369   2.9612  177.175   2.9476 1.193329 4.178141 
1 1 1   13   14    4 o  147.851   2.2070  446.074   13.244  478.628   20.964  424.453   17.085  152.282   3.3378  143.420   2.8883 8.862030 4.413994 
1 1 1   13   14    5 f   29.124   4.3246   18.245   5.1402   12.240   7.3042   24.136   7.2349   24.073   6.9617   34.176   5.1327 -10.10346 8.649249 
1 1 1   13   14    6 o  108.566   2.4620  234.058   10.101  266.298   18.997  221.352   11.926  113.561   4.0560  103.571   2.7918 9.990173 4.923969 
1 1 1   13   14    7 o  272.998   2.9022  1545.43   29.920  1523.18   54.508  1555.03   35.795  271.508   4.8676  274.487   3.1618 -2.978821 5.804345 
1 1 1   13   14    8 o  259.610   2.5887  1395.81   27.614  1330.87   40.260  1453.51   37.946  253.874   3.8449  265.346   3.4673 -11.47171 5.177380 
1 1 1   13   14    9 o  235.148   2.4997  1142.14   23.979  1138.46   36.690  1144.88   31.681  234.797   3.7887  235.500   3.2617 -0.7027740 4.999329 
1 1 1   13   14   10 o  146.668   2.5483  447.992   14.530  432.810   24.952  455.782   17.873  144.737   4.1798  148.599   2.9162 -3.861725 5.096559 
1 1 1   13   14   11 o  241.762   2.7801  1210.15   25.378  1200.55   46.322  1214.26   30.336  240.993   4.6603  242.532   3.0327 -1.538498 5.560194 
1 1 1   13   14   12 o  116.067   2.2793  280.333   10.595  268.631   16.981  287.791   13.557  114.052   3.6099  118.083   2.7836 -4.031326 4.558513 
1 1 1   13   14   13 o   71.103   2.7057  105.774   7.6094   99.504   12.504  109.461   9.5895   69.391   4.3690   72.815   3.1931 -3.424263 5.411445 
1 1 1   13   14   14 o  187.154   2.4251  724.056   18.654  713.689   27.450  732.952   25.428  185.897   3.5802  188.411   3.2722 -2.514481 4.850268 
1 1 1   13   14   15 o  256.572   2.8529  1357.43   30.157  1428.04   43.888  1294.27   41.510  262.878   4.0479  250.267   4.0214 12.61121 5.705873 
1 1 1   13   14   16 o  360.907   3.2286  2698.71   47.680  2736.69   63.802  2650.68   71.755  363.854   4.2515  357.960   4.8602 5.894348 6.457266 
1 1 1   13   14   17 o   96.876   2.5593  193.885   10.224  193.617   14.586  194.144   14.337   96.808   3.6530   96.943   3.5856 -0.1349182 5.118689 
1 1 1   13   14   18 o  133.117   3.5531  393.280   16.776  423.988   19.747  313.614   31.806  143.269   3.3418  122.964   6.2714 20.30495 7.106192 
1 1 1   13   14   19 o   96.378   2.7000  192.473   10.688  172.069   15.098  212.969   15.132   91.234   4.0123  101.522   3.6139 -10.28854 5.399908 
1 1 1   13   14   20 o  100.130   4.2587  211.034   17.105  193.436   26.925  222.942   22.148   96.503   6.7646  103.756   5.1756 -7.253166 8.517435 
1 1 1   13   14   21 o   29.043   5.9085   18.057   7.9564   8.6017   11.985   25.507   10.639   23.749   8.9620   34.336   7.7022 -10.58716 11.81700 
1 1 1   13   14   22 o   62.591   5.0403   88.913   11.378   99.661   13.704   65.066   20.414   69.382   4.7890   55.799   8.8703 13.58360 10.08051 
1 1 1   13   14   23 o  191.468   3.1698  752.177   23.061  742.001   27.587  775.783   42.018  189.470   3.5302  193.466   5.2658 -3.995987 6.339674 
1 1 1   13   14   24 o   49.388   7.9233   65.802   16.072   84.227   18.689   13.494   31.491   63.598   7.1250   35.179   14.155 28.41955 15.84663 
1 1 1   13   14   25 o  169.661   3.4973  600.221   24.330  551.664   35.383  643.769   33.508  163.054   5.2613  176.267   4.6091 -13.21236 6.994627 
1 1 1   13   14   26 o   82.650   4.5202  141.417   14.044  140.120   16.689  144.563   25.993   82.177   4.9240   83.122   7.5819 -0.9451599 9.040475 
1 1 1   13   14   27 o   81.633   4.4095  145.091   13.229  153.604   15.784  124.995   24.251   86.058   4.4469   77.207   7.6157 8.850960 8.818959 
1 1 1   13   14   28 f   46.819   6.7758   53.178   11.075   58.946   12.788   35.876   22.148   53.171   5.8313   40.468   12.233 12.70250 13.55153 
1 1 1   13   14   29 f   66.430   6.8019   88.468   17.734  115.028   31.517   76.163   21.452   73.028   10.464   59.832   8.6930 13.19586 13.60382 
1 1 1   13   14   30 o   64.461   7.9906   60.643   12.774   53.623   13.306  143.239   45.642   50.495   6.3889   78.428   14.649 -27.93278 15.98123 
1 1 1   13   14   31 o   80.046   4.1909  132.348   12.794  128.462   15.307  141.355   23.303   78.421   4.7324   81.672   6.9180 -3.250999 8.381816 
1 1 1   13   14   32 o   79.089   4.2352  128.088   12.891  121.929   15.482  142.014   23.280   76.345   4.9168   81.833   6.8974 -5.488075 8.470443 
1 1 1   13   14   33 o   54.810   5.9876   64.195   11.610   61.967   13.487   70.568   22.812   54.061   6.0486   55.558   10.335 -1.497150 11.97517 
1 1 1   13   14   34 o   26.969   7.9730   6.7605   14.805   6.1503   20.258   7.4600   21.690   26.419   11.066   27.519   11.482 -1.100222 15.94593 
1 1 1   13   14   35 f   40.391   7.3670   34.200   10.937   30.356   12.493   46.803   22.623   36.604   8.4470   44.178   12.072 -7.573887 14.73394 
1 1 1   13   14   36 o   43.876   7.1197   49.954   11.638   55.920   13.380   31.411   23.587   51.064   6.3527   36.688   12.744 14.37567 14.23940 
1 1 1   13   14   37 o   65.062   8.9075  113.517   20.879   77.966   37.881  129.030   25.023   53.512   15.958   76.613   7.9191 -23.10103 17.81502 
1 1 1   13   14   38 o   28.578   5.9438   18.671   10.569   34.168   12.020 -34.1440   22.189   38.747   7.7913   18.409   8.9784 20.33818 11.88764 
1 1 1   13   14   39 o   41.263   8.5311   41.160   12.075   41.297   12.776   40.018   36.958   43.256   7.1609   39.270   15.487 3.985741 17.06229 
1 1 1   13   14   40 o   51.898   6.3470   57.639   12.251   49.586   14.429   78.440   23.189   47.077   7.4311   56.719   10.292 -9.642673 12.69393 
1 1 1   13   14   41 o   26.619   7.6254   12.516   10.902   11.957   12.078   14.971   25.330   24.080   9.0151   29.158   12.301 -5.077894 15.25089 
1 1 1   13   14   42 o   29.394   8.3486   2.7949   18.538   45.607   27.390 -33.3941   25.182   39.337   13.729   19.451   9.5037 19.88588 16.69725 
1 1 1   13   14   43 o   20.778   6.7771  -3.5720   12.374   0.3825   14.189 -16.1280   25.283   19.861   8.7846   21.696   10.322 -1.834785 13.55424 
1 1 1   13   14   44 o   46.812   8.5830   60.131   14.777   57.838   16.511   69.358   33.123   49.189   8.1383   44.434   15.114 4.754837 17.16595 
1 1 1   13   14   45 o   25.700   8.0225   6.5221   13.120   0.8764   14.553   31.038   30.326   19.744   8.8051   31.656   13.413 -11.91188 16.04495 
1 1 1   13   14   46 o   27.045   8.3576   10.187   13.055   4.2273   14.198   42.813   33.219   20.449   8.9236   33.640   14.134 -13.19186 16.71529 
1 1 1   13   15    0 o   41.897   3.8196   38.006   8.9075   38.006   8.9075   38.006   8.9075   41.897   5.4017   41.897   5.4017 0.000000 0.000000 
1 1 1   13   15    1 o  244.720   2.5011  1235.44   24.974  1230.50   32.957  1242.09   38.272  244.165   3.2726  245.276   3.7832 -1.110519 5.002297 
1 1 1   13   15    2 o  260.296   2.3793  1398.26   25.539  1383.98   35.721  1413.18   36.527  258.939   3.3447  261.653   3.3847 -2.714417 4.758512 
1 1 1   13   15    3 o  137.429   2.0117  389.751   11.403  388.185   16.126  391.317   16.125  137.152   2.8508  137.705   2.8392 -0.5525513 4.023418 
1 1 1   13   15    4 o  138.804   2.0164  397.214   11.538  381.478   16.049  414.048   16.599  135.961   2.8620  141.647   2.8413 -5.685944 4.032866 
1 1 1   13   15    5 o   95.053   2.6351  174.553   9.9233  232.124   17.228  145.969   12.139  106.021   3.9398   84.086   3.5003 21.93439 5.270127 
1 1 1   13   15    6 o  154.100   2.4482  495.462   14.308  476.977   25.716  503.749   17.219  151.961   4.1031  156.240   2.6721 -4.278748 4.896467 
1 1 1   13   15    7 o  133.981   2.1688  370.612   11.641  370.263   18.849  370.828   14.802  133.915   3.4127  134.048   2.6772 -0.1328278 4.337543 
1 1 1   13   15    8 o  211.701   2.3849  927.151   20.616  912.411   31.322  938.417   27.385  210.194   3.6129  213.207   3.1141 -3.013275 4.769817 
1 1 1   13   15    9 o  316.766   2.7730  2069.84   35.090  2084.44   57.346  2061.10   44.365  317.592   4.3779  315.940   3.4046 1.652008 5.545964 
1 1 1   13   15   10 o  256.882   2.8325  1373.74   27.592  1336.26   49.730  1390.41   33.166  254.241   4.7425  259.523   3.0985 -5.282516 5.664945 
1 1 1   13   15   11 o  378.703   3.5747  2951.75   50.206  2998.04   94.998  2933.81   59.140  380.525   6.0529  376.882   3.8046 3.643311 7.149304 
1 1 1   13   15   12 o  194.983   2.6686  773.668   19.925  816.330   35.997  754.822   23.925  198.746   4.3914  191.219   3.0336 7.526703 5.337291 
1 1 1   13   15   13 o  289.357   2.6515  1727.25   30.661  1739.00   50.058  1720.19   38.790  290.084   4.1839  288.631   3.2584 1.452850 5.303045 
1 1 1   13   15   14 o  179.742   2.9918  665.188   21.974  686.503   33.663  649.364   29.006  182.215   4.4793  177.268   3.9672 4.947403 5.983552 
1 1 1   13   15   15 o  250.715   2.8065  1299.04   29.019  1306.65   40.871  1291.30   41.210  251.459   3.9407  249.971   3.9971 1.488968 5.613061 
1 1 1   13   15   16 o   96.238   2.9511  189.900   11.586  181.519   15.162  201.662   17.963   93.720   3.9225   98.755   4.4101 -5.035530 5.902162 
1 1 1   13   15   17 o  155.736   2.3401  500.841   15.029  492.011   21.046  510.028   21.468  154.335   3.3063  157.135   3.3125 -2.799988 4.680221 
1 1 1   13   15   18 o  120.750   2.6953  299.681   13.188  292.716   17.033  310.107   20.840  119.031   3.4694  122.469   4.1258 -3.438507 5.390615 
1 1 1   13   15   19 o  175.117   2.5540  632.453   18.232  641.896   28.097  625.583   23.963  176.218   3.8658  174.017   3.3387 2.201263 5.107992 
1 1 1   13   15   20 o  195.067   2.5234  785.202   20.195  775.579   27.123  797.173   30.252  193.747   3.3942  196.387   3.7349 -2.639786 5.046826 
1 1 1   13   15   21 o  104.579   2.6635  225.894   11.483  232.496   16.552  219.767   15.944  106.050   3.7841  103.108   3.7493 2.941711 5.326945 
1 1 1   13   15   22 o  134.604   3.2654  374.538   18.100  346.085   25.120  405.266   26.104  129.284   4.7109  139.924   4.5233 -10.63997 6.530874 
1 1 1   13   15   23 o  169.211   2.7513  594.309   18.508  600.338   23.323  584.058   30.415  170.440   3.3178  167.981   4.3899 2.459534 5.502663 
1 1 1   13   15   24 o  118.778   3.4013  290.992   16.622  269.364   22.607  316.442   24.524  113.998   4.8081  123.559   4.8122 -9.560555 6.802615 
1 1 1   13   15   25 o  143.468   3.3247  424.041   19.547  403.932   25.969  450.324   29.690  139.601   4.5103  147.335   4.8858 -7.734268 6.649371 
1 1 1   13   15   26 o   88.306   4.1051  161.260   14.897  149.392   20.054  175.870   22.251   84.715   5.7396   91.897   5.8705 -7.181480 8.210134 
1 1 1   13   15   27 o  126.148   3.3992  330.568   17.325  330.694   22.368  330.379   27.392  126.270   4.2951  126.027   5.2697 0.2423172 6.798323 
1 1 1   13   15   28 o  187.088   3.4732  733.773   25.250  743.933   31.031  713.866   43.437  189.330   3.9738  184.847   5.6975 4.482605 6.946401 
1 1 1   13   15   29 o  111.061   4.2586  248.062   17.311  236.429   20.056  282.044   34.278  106.558   4.5634  115.564   7.1916 -9.006157 8.517252 
1 1 1   13   15   30 o   72.949   7.7748  132.545   14.281  137.671   15.359   99.839   38.796   81.233   4.5842   64.665   14.858 16.56860 15.54953 
1 1 1   13   15   31 o   46.191   7.0608   48.056   14.978   10.390   21.001   87.053   21.369   28.646   11.547   63.737   8.1288 -35.09068 14.12167 
1 1 1   13   15   32 o   23.232   6.8621   3.6247   9.6144   2.1486   11.056   8.2034   19.472   19.517   8.1746   26.947   11.024 -7.430656 13.72415 
1 1 1   13   15   33 o   82.467   4.2646  140.110   13.190  134.325   15.550  154.950   24.905   79.985   4.7137   84.949   7.1083 -4.963745 8.529191 
1 1 1   13   15   34 o  124.064   4.7826  313.539   23.016  284.671   27.641  378.799   41.560  115.843   5.7853  132.285   7.6173 -16.44185 9.565213 
1 1 1   13   15   35 o   25.308   7.4268   7.0821   9.9861   6.7694   10.905   8.7061   24.851   21.513   8.4352   29.103   12.226 -7.589985 14.85352 
1 1 1   13   15   36 o   28.122   8.0110   13.880   12.143   18.025   12.856 -20.3908   36.966   28.532   9.4121   27.711   12.966 0.8205853 16.02199 
1 1 1   13   15   37 o   29.650   7.4690   19.595   12.057   26.181   14.012   0.8169   23.661   33.374   9.6397   25.926   11.411 7.447432 14.93802 
1 1 1   13   15   38 o   55.068   5.8758   58.087   11.814   48.116   13.451   91.732   24.707   46.903   6.9532   63.232   9.4737 -16.32957 11.75152 
1 1 1   13   15   39 o   21.658   7.4511  -8.3512   10.412  -8.0918   10.841 -11.4353   37.383   15.234   7.0926   28.082   13.106 -12.84739 14.90221 
1 1 1   13   15   40 o   31.821   8.4392   23.448   15.114   16.939   20.652   30.954   22.177   28.926   11.523   34.715   12.333 -5.788445 16.87839 
1 1 1   13   15   41 o   19.450   6.5771 -10.2151   10.430 -11.1657   11.402  -5.3412   25.817   14.719   6.9822   24.180   11.148 -9.460678 13.15417 
1 1 1   13   15   42 o   28.875   8.3458   15.095   16.830   30.319   23.218  -1.7591   24.430   33.505   12.508   24.246   11.053 9.258377 16.69158 
1 1 1   13   15   43 o   24.157   8.0724 -12.4397   21.736 -32.2380   32.853   2.9731   28.987   22.212   10.853   26.102   11.952 -3.890251 16.14477 
1 1 1   13   15   44 o   37.161   7.2053   44.356   13.890   55.288   15.657   3.9715   30.094   48.133   7.8870   26.189   12.061 21.94349 14.41053 
1 1 1   13   15   45 o   27.670   8.1460   17.446   13.130   14.580   14.728   28.542   28.980   24.800   9.7777   30.540   13.032 -5.740578 16.29196 
1 1 1   13   16    0 o  106.388   2.9803  234.716   18.428  234.716   18.428  234.716   18.428  106.388   4.2148  106.388   4.2148 0.000000 0.000000 
1 1 1   13   16    1 o   83.761   2.3164  144.338   7.9232  141.385   10.444  148.342   12.162   82.761   3.0596   84.761   3.4788 -1.999763 4.632829 
1 1 1   13   16    2 o  227.007   2.2468  1063.59   21.034  1049.82   29.450  1077.93   30.051  225.509   3.1663  228.506   3.1886 -2.997452 4.493635 
1 1 1   13   16    3 o   83.689   2.1510  144.453   7.4182  153.180   10.648  136.221   10.341   86.144   2.9969   81.233   3.0864 4.910713 4.301985 
1 1 1   13   16    4 o  131.003   2.1529  356.625   11.350  343.179   17.977  365.538   14.636  128.921   3.3809  133.086   2.6663 -4.164490 4.305751 
1 1 1   13   16    5 o  203.975   2.5870  857.628   19.808  863.222   36.655  855.320   23.541  204.382   4.3483  203.568   2.8039 0.8143463 5.173939 
1 1 1   13   16    6 o  100.900   2.5048  204.800   9.5593  223.830   17.798  197.085   11.333  104.084   4.1459   97.717   2.8119 6.366486 5.009511 
1 1 1   13   16    7 o  325.504   2.9202  2187.24   38.720  2200.63   59.714  2177.53   50.861  326.316   4.4368  324.692   3.7980 1.624298 5.840377 
1 1 1   13   16    8 o  184.612   2.2926  701.121   17.194  717.988   26.883  689.445   22.367  186.467   3.4955  182.757   2.9674 3.710037 4.585195 
1 1 1   13   16    9 o  268.795   2.5448  1485.07   27.243  1518.84   45.026  1465.57   34.216  271.146   4.0262  266.443   3.1136 4.703033 5.089645 
1 1 1   13   16   10 o  313.425   2.7566  2025.18   34.458  2045.40   56.585  2013.27   43.441  314.599   4.3609  312.252   3.3731 2.346710 5.513183 
1 1 1   13   16   11 o  124.677   2.5209  321.368   11.880  320.256   21.670  321.846   14.204  124.484   4.2206  124.870   2.7580 -0.3852158 5.041859 
1 1 1   13   16   12 o  402.722   3.7026  3359.01   55.849  3350.42  103.477  3362.53   66.341  402.059   6.2401  403.384   3.9875 -1.325104 7.405274 
1 1 1   13   16   13 o   98.113   2.3620  200.072   9.2283  193.855   15.049  203.818   11.683   96.865   3.7669   99.362   2.8507 -2.497650 4.723976 
1 1 1   13   16   14 o  223.639   2.4850  1031.68   22.670  1042.81   34.816  1023.49   29.869  224.658   3.7575  222.620   3.2531 2.037476 4.970011 
1 1 1   13   16   15 o  181.023   2.6914  679.062   20.021  703.710   27.482  651.184   29.227  184.552   3.6105  177.494   3.9925 7.058426 5.382885 
1 1 1   13   16   16 o  237.492   2.8249  1164.29   27.579  1146.49   37.375  1185.56   40.862  235.523   3.8475  239.460   4.1374 -3.937408 5.649874 
1 1 1   13   16   17 o  139.872   2.6835  409.775   15.134  433.824   19.790  375.898   23.488  144.918   3.3110  134.826   4.2239 10.09267 5.366975 
1 1 1   13   16   18 f  115.060   2.4983  273.550   11.856  271.222   16.716  275.907   16.818  114.567   3.5376  115.553   3.5288 -0.9859467 4.996689 
1 1 1   13   16   19 f   43.713   6.5375   56.913   11.937   74.903   13.602  -3.3885   24.903   60.119   5.4855   27.307   11.869 32.81232 13.07509 
1 1 1   13   16   20 o   70.016   3.2568  101.476   9.4039  103.134   13.286   99.811   13.312   70.592   4.5634   69.441   4.6479 1.151268 6.513645 
1 1 1   13   16   21 o   75.469   3.0909  118.319   9.5803  107.391   13.684  128.823   13.417   72.023   4.6067   78.914   4.1222 -6.890785 6.181742 
1 1 1   13   16   22 o  145.464   3.0028  445.496   17.698  367.275   25.839  514.625   24.291  133.169   4.7044  157.759   3.7332 -24.59030 6.005630 
1 1 1   13   16   23 o  190.707   2.9408  751.923   22.977  744.762   30.700  761.042   34.644  189.716   3.9234  191.698   4.3818 -1.982056 5.881592 
1 1 1   13   16   24 o   96.924   3.8926  194.368   15.519  176.006   21.248  215.364   22.721   92.026   5.5981  101.823   5.4101 -9.796654 7.785174 
1 1 1   13   16   25 o   67.117   5.0007  102.900   12.010  114.835   14.389   75.493   21.804   74.390   4.6897   59.844   8.8338 14.54605 10.00144 
1 1 1   13   16   26 o   31.648   7.0338   20.947   9.8162   21.149   11.900   20.516   17.365   31.231   8.8398   32.065   10.943 -0.8340530 14.06758 
1 1 1   13   16   27 f   88.127   3.8470  157.140   13.441  145.448   16.583  179.532   22.950   83.603   4.8093   92.651   6.0057 -9.047905 7.694027 
1 1 1   13   16   28 o   76.011   4.1974  121.640   12.209  122.678   14.781  119.411   21.658   76.751   4.6693   75.270   6.9764 1.480797 8.394753 
1 1 1   13   16   29 o  134.774   3.4370  370.949   17.789  357.057   21.363  402.371   32.128  131.035   3.9528  138.513   5.6238 -7.477692 6.873992 
1 1 1   13   16   30 o   92.552   5.2881  174.286   14.857  170.438   16.166  195.187   37.678   90.406   4.3356   94.699   9.6467 -4.292686 10.57617 
1 1 1   13   16   31 o   36.784   6.8067   33.412   10.517   39.354   12.168   15.863   20.911   43.032   6.8559   30.536   11.761 12.49620 13.61331 
1 1 1   13   16   32 o   57.100   5.5313   69.670   12.165   68.077   14.721   73.101   21.602   56.553   6.3111   57.647   9.0858 -1.093792 11.06258 
1 1 1   13   16   33 f   36.345   7.3844   31.718   11.540   35.477   13.924   23.472   20.622   39.517   8.7722   33.174   11.881 6.342358 14.76872 
1 1 1   13   16   34 o   26.102   8.0849  -4.3435   17.063 -17.6206   23.100   11.598   25.312   21.955   10.265   30.250   12.494 -8.294769 16.16984 
1 1 1   13   16   35 o   29.811   7.7186   18.284   11.094   19.399   12.442   13.961   24.501   29.318   9.2246   30.303   12.378 -0.9848042 15.43711 
1 1 1   13   16   36 o   25.607   7.2768   9.4633   10.660   8.7104   12.421   11.568   20.765   23.182   9.0263   28.032   11.416 -4.849243 14.55356 
1 1 1   13   16   37 o   40.098   7.9860   33.357   17.712  -6.9160   24.741   75.696   25.368   24.520   11.156   55.677   11.430 -31.15756 15.97201 
1 1 1   13   16   38 o   35.616   7.7471   30.725   11.543   30.545   13.315   31.268   23.154   35.821   9.0185   35.410   12.599 0.4110832 15.49427 
1 1 1   13   16   39 o   71.421   7.5295  127.609   14.563  129.602   15.834  116.668   37.100   77.812   4.9339   65.031   14.228 12.78073 15.05895 
1 1 1   13   16   40 o   42.470   7.2847   46.087   11.578   47.130   13.276   42.773   23.659   45.784   7.0305   39.156   12.761 6.627380 14.56941 
1 1 1   13   16   41 o   42.668   8.4198   43.694   12.554   40.287   13.740   60.916   30.891   40.968   8.4134   44.368   14.587 -3.400196 16.83967 
1 1 1   13   16   42 o   37.584   9.3965   43.787   18.921   50.775   23.680   31.449   31.466   41.676   12.660   33.492   13.889 8.183964 18.79297 
1 1 1   13   16   43 o   55.778   7.8063   77.873   15.302   71.998   17.567   96.359   31.160   55.263   7.7071   56.293   13.578 -1.030453 15.61262 
1 1 1   13   16   44 o   29.809   7.9016   25.726   13.600   30.485   15.562   10.348   27.975   33.100   10.301   26.519   11.985 6.581514 15.80326 
1 1 1   13   16   45 o   28.002   8.0418   20.753   13.304   20.532   15.093   21.524   28.172   27.498   10.119   28.507   12.502 -1.008850 16.08361 
1 1 1   13   17    0 o  134.571   2.3144  374.335   18.142  374.335   18.142  374.335   18.142  134.571   3.2731  134.571   3.2731 0.000000 0.000000 
1 1 1   13   17    1 o  252.024   2.5288  1312.19   26.037  1315.46   34.548  1307.90   39.612  252.412   3.3186  251.636   3.8167 0.7757111 5.057685 
1 1 1   13   17    2 o  210.000   2.1766  910.319   18.852  903.195   26.514  917.602   26.809  209.170   3.0733  210.831   3.0831 -1.660965 4.353270 
1 1 1   13   17    3 o  132.117   1.9511  360.513   10.615  355.369   15.393  365.176   14.657  131.214   2.8443  133.019   2.6715 -1.805069 3.902157 
1 1 1   13   17    4 o  290.417   3.0147  1731.23   32.441  1769.06   61.573  1716.70   38.168  292.474   5.1043  288.360   3.2092 4.113983 6.029397 
1 1 1   13   17    5 o  219.808   2.7553  968.096   22.805  1071.18   42.907  927.510   26.923  227.650   4.5698  211.966   3.0796 15.68372 5.510602 
1 1 1   13   17    6 o  144.077   2.1417  422.369   12.299  451.923   20.490  405.723   15.378  147.943   3.3580  140.210   2.6592 7.733398 4.283393 
1 1 1   13   17    7 o   81.653   2.4451  139.419   8.0291  129.233   12.598  146.387   10.419   79.096   3.8618   84.210   2.9999 -5.113747 4.890102 
1 1 1   13   17    8 o  349.854   3.0508  2533.33   43.672  2499.67   65.824  2559.79   58.369  347.725   4.5897  351.983   4.0206 -4.258179 6.101694 
1 1 1   13   17    9 o  208.788   2.2976  901.823   19.294  892.627   30.840  907.737   24.732  207.881   3.5970  209.696   2.8596 -1.814651 4.595199 
1 1 1   13   17   10 o  132.224   2.1707  357.819   11.476  373.689   18.872  348.506   14.456  134.511   3.4017  129.936   2.6975 4.574783 4.341416 
1 1 1   13   17   11 o  133.018   2.2249  366.519   11.894  360.158   19.017  370.605   15.243  132.047   3.4918  133.989   2.7582 -1.941818 4.449776 
1 1 1   13   17   12 o  181.125   2.5579  674.501   17.452  685.647   32.180  669.856   20.773  182.116   4.2842  180.134   2.7959 1.982178 5.115821 
1 1 1   13   17   13 o  173.805   2.5548  620.261   16.779  633.747   30.808  614.574   20.006  175.076   4.2665  172.534   2.8115 2.541855 5.109522 
1 1 1   13   17   14 f  466.718   4.0613  4510.02   78.082  4433.42  107.411  4595.86  113.707  462.564   5.6300  470.871   5.8549 -8.307190 8.122641 
1 1 1   13   17   15 o  116.711   2.7776  282.726   13.249  291.030   17.738  272.247   19.926  118.678   3.6239  114.744   4.2104 3.933601 5.555161 
1 1 1   13   17   16 o  221.406   2.5541  1008.74   23.106  1043.24   35.420  983.184   30.486  224.660   3.8226  218.151   3.3883 6.508865 5.108120 
1 1 1   13   17   17 o  118.410   2.4351  289.681   11.890  281.487   16.735  298.034   16.896  116.717   3.4764  120.103   3.4109 -3.385887 4.870249 
1 1 1   13   17   18 o  141.804   2.5922  415.591   15.016  415.708   22.869  415.501   19.909  141.800   3.9103  141.808   3.4040 -0.8163452E-02 5.184371 
1 1 1   13   17   19 o   80.459   4.0975  136.447   13.303  104.932   18.926  167.222   18.703   71.071   6.4565   89.847   5.0470 -18.77602 8.195014 
1 1 1   13   17   20 o   71.015   3.1982  104.503   9.3563   99.323   13.293  109.587   13.171   69.261   4.6535   72.768   4.3884 -3.506851 6.396358 
1 1 1   13   17   21 o  154.770   2.4534  495.152   15.661  495.385   22.219  494.922   22.077  154.805   3.4799  154.735   3.4592 0.7019043E-01 4.906740 
1 1 1   13   17   22 o  204.571   2.6104  866.276   21.942  858.393   32.396  872.958   29.824  203.682   3.8563  205.460   3.5195 -1.777847 5.220897 
1 1 1   13   17   23 o  147.379   3.0833  446.816   18.658  417.091   24.984  484.300   28.056  141.891   4.2692  152.867   4.4499 -10.97516 6.166620 
1 1 1   13   17   24 o  110.001   3.5408  251.443   16.055  256.492   22.484  246.190   22.934  111.144   4.9048  108.857   5.1082 2.286232 7.081697 
1 1 1   13   17   25 o   51.155   5.4093   49.869   10.780   40.391   12.905   71.749   19.607   43.915   7.1250   58.394   8.1410 -14.47879 10.81860 
1 1 1   13   17   26 o   79.788   3.8948  133.835   12.130  136.041   14.988  129.646   20.651   80.904   4.4915   78.672   6.3644 2.232368 7.789686 
1 1 1   13   17   27 o   77.101   4.1009  123.706   12.488  121.929   15.519  126.971   21.036   76.480   4.9198   77.722   6.5624 -1.241669 8.201782 
1 1 1   13   17   28 o   32.426   7.0377   18.031   10.236   9.1050   12.304   38.099   18.449   23.854   9.0615   40.999   10.771 -17.14460 14.07549 
1 1 1   13   17   29 o   38.907   6.8422   29.795   10.193   22.992   11.996   47.471   19.335   32.128   8.7954   45.686   10.483 -13.55741 13.68436 
1 1 1   13   17   30 o   25.161   6.9469   9.8779   9.5783   11.706   10.965   3.9909   19.676   24.580   8.6785   25.742   10.850 -1.161757 13.89381 
1 1 1   13   17   31 o   36.664   8.0855   32.534   11.235   35.060   11.863   10.525   35.019   39.769   7.5074   33.560   14.323 6.208725 16.17109 
1 1 1   13   17   32 o   81.369   5.3371  145.180   17.585  127.588   26.380  159.247   23.590   76.441   8.3673   86.297   6.6279 -9.856758 10.67426 
1 1 1   13   17   33 o   64.214   5.3713   88.579   12.171   88.003   13.991   90.370   24.679   64.572   5.2536   63.856   9.3703 0.7154121 10.74259 
1 1 1   13   17   34 o   39.007   8.9448   34.839   16.451   48.881   25.908   25.351   21.295   44.235   13.199   33.778   12.076 10.45704 17.88954 
1 1 1   13   17   35 o   41.906   6.9317   32.289   11.165   19.411   12.964   69.276   21.971   29.362   9.4355   54.449   10.157 -25.08672 13.86341 
1 1 1   13   17   36 f   43.962   7.6798   42.430   12.750   35.859   14.958   59.894   24.384   39.000   9.4075   48.924   12.142 -9.923286 15.35966 
1 1 1   13   17   37 o   26.436   7.4473   10.180   10.397   7.6890   11.747   19.192   22.342   22.113   8.7278   30.760   12.070 -8.646835 14.89468 
1 1 1   13   17   38 o   56.640   5.9603   67.605   12.585   60.535   14.640   87.619   24.632   52.387   6.7756   60.894   9.8077 -8.506367 11.92058 
1 1 1   13   17   39 o   38.841   8.9367   28.840   12.677   21.968   13.739   68.213   32.886   30.097   9.7179   47.584   15.001 -17.48657 17.87334 
1 1 1   13   17   40 o   35.205   7.7747   34.724   12.735   39.357   14.507   19.153   26.594   40.102   8.9927   30.309   12.685 9.792252 15.54943 
1 1 1   13   17   41 f   27.979   7.8424   16.555   11.731   16.040   13.140   18.579   26.044   26.253   9.4747   29.706   12.500 -3.452894 15.68470 
1 1 1   13   17   42 o   20.017   6.6298  -6.4386   11.566  -7.6399   13.250  -2.5920   23.710   16.787   7.8241   23.246   10.705 -6.458839 13.25964 
1 1 1   13   17   43 o   38.242   8.9888   36.027   13.882   27.882   15.468   69.740   31.469   31.956   10.311   44.527   14.727 -12.57132 17.97766 
1 1 1   13   17   44 o   22.845   7.3182   2.6315   12.468  -0.9644   14.181   14.873   26.165   18.844   8.5233   26.845   11.899 -8.000620 14.63634 
1 1 1   13   18    0 f  182.860   2.4150  690.740   25.738  690.740   25.738  690.740   25.738  182.860   3.4153  182.860   3.4153 0.000000 0.000000 
1 1 1   13   18    1 o  103.016   2.2097  217.256   9.3025  206.430   12.228  232.132   14.333  100.000   2.9647  106.031   3.2775 -6.031113 4.419433 
1 1 1   13   18    2 o   99.764   2.0375  205.447   8.3837  205.184   11.868  205.709   11.845   99.700   2.8861   99.828   2.8768 -0.1276321 4.074987 
1 1 1   13   18    3 o  168.813   2.1618  585.364   14.581  600.161   23.923  576.619   18.391  170.479   3.4023  167.146   2.6678 3.333542 4.323520 
1 1 1   13   18    4 o   67.011   2.9343   94.371   7.2555   89.238   13.592   96.416   8.5801   65.683   5.0174   68.339   3.0441 -2.655975 5.868686 
1 1 1   13   18    5 o  128.500   2.5901  345.677   13.340  320.327   21.124  362.492   17.205  124.501   4.1138  132.499   3.1483 -7.998596 5.180217 
1 1 1   13   18    6 o   91.927   2.2869  176.045   8.4304  167.663   13.441  181.480   10.824   90.092   3.6174   93.762   2.7989 -3.670258 4.573758 
1 1 1   13   18    7 o   79.049   2.4742  132.016   7.8111  115.686   12.258  143.180   10.135   74.821   3.9722   83.277   2.9509 -8.456055 4.948329 
1 1 1   13   18    8 o  244.150   2.4327  1230.00   23.794  1236.20   38.586  1226.20   30.226  244.600   3.8248  243.699   3.0072 0.9017181 4.865364 
1 1 1   13   18    9 o  112.605   2.2313  264.276   10.102  250.368   15.968  273.555   13.044  110.094   3.5167  115.116   2.7473 -5.021912 4.462569 
1 1 1   13   18   10 f  143.335   2.1870  425.357   12.640  418.850   20.033  429.661   16.293  142.402   3.4109  144.269   2.7382 -1.866928 4.374052 
1 1 1   13   18   11 o  188.030   2.2611  724.485   16.970  752.517   27.993  708.197   21.339  190.850   3.5563  185.210   2.7934 5.640381 4.522229 
1 1 1   13   18   12 o  102.009   2.6206  214.026   10.041  217.471   18.603  212.610   11.927  102.542   4.3987  101.475   2.8498 1.067055 5.241196 
1 1 1   13   18   13 o   58.732   3.8141   81.670   7.8366   50.120   13.865   96.479   9.4994   49.125   6.8434   68.340   3.3702 -19.21537 7.628225 
1 1 1   13   18   14 o   43.860   4.8595   42.819   8.1004   31.300   12.522   51.107   10.622   38.042   8.2208   49.678   5.1842 -11.63661 9.718945 
1 1 1   13   18   15 o   86.526   3.0274  155.847   10.567  159.896   13.691  149.882   16.618   87.953   3.7743   85.099   4.7346 2.854752 6.054878 
1 1 1   13   18   16 o  200.701   2.4910  830.300   20.474  849.367   31.005  815.557   27.264  202.717   3.7083  198.685   3.3271 4.032028 4.982070 
1 1 1   13   18   17 o   65.270   3.1847   88.560   8.5337   81.677   12.333   94.881   11.820   62.812   4.7607   67.727   4.2314 -4.914299 6.369410 
1 1 1   13   18   18 o   75.809   3.2019  119.144   9.8527  117.875   15.317  120.040   12.868   75.438   4.9229   76.179   4.0956 -0.7410889 6.403809 
1 1 1   13   18   19 o  229.179   2.7656  1085.47   26.128  1063.26   36.266  1109.46   37.677  226.747   3.8778  231.610   3.9441 -4.862686 5.531139 
1 1 1   13   18   20 o  129.078   2.8088  337.978   14.650  313.527   18.651  377.368   23.673  123.132   3.6725  135.025   4.2508 -11.89261 5.617539 
1 1 1   13   18   21 o   91.532   2.8472  173.616   10.735  168.272   15.414  178.650   14.960   90.153   4.1456   92.912   3.9038 -2.759315 5.694370 
1 1 1   13   18   22 o  102.894   2.7296  219.139   11.578  220.086   16.656  218.254   16.105  103.103   3.9168  102.685   3.8026 0.4183273 5.459103 
1 1 1   13   18   23 o  172.316   2.4859  614.510   17.665  602.771   24.919  626.369   25.047  170.657   3.5403  173.974   3.4906 -3.317291 4.971751 
1 1 1   13   18   24 o   59.213   4.8910   73.130   11.048   72.717   13.292   74.051   19.869   59.109   5.4524   59.317   8.1215 -0.2089386 9.781959 
1 1 1   13   18   25 o  130.368   3.4988  353.116   18.790  369.197   27.412  338.864   25.807  133.151   4.9915  127.585   4.9042 5.565559 6.997605 
1 1 1   13   18   26 o   61.089   4.7689   82.208   10.948   88.690   13.349   68.891   19.134   65.221   4.9624   56.957   8.1451 8.263378 9.537733 
1 1 1   13   18   27 o   62.525   4.7316   77.882   11.483   69.756   13.770   96.430   20.805   57.654   5.7909   67.396   7.4845 -9.742085 9.463202 
1 1 1   13   18   28 o   55.412   9.4791   63.618   13.592   62.033   14.210   80.678   46.618   54.200   6.3564   56.624   17.861 -2.423492 18.95818 
1 1 1   13   18   29 o   64.271   4.8802   89.977   12.165   95.307   15.142   80.274   20.430   67.371   5.4493   61.171   8.0976 6.199249 9.760485 
1 1 1   13   18   30 o   90.526   4.3405  173.464   16.160  156.189   22.244  192.771   23.516   85.702   6.2930   95.351   5.9797 -9.648773 8.680922 
1 1 1   13   18   31 o   48.701   8.3545   47.126   12.076   44.130   12.879   68.939   34.754   45.374   6.8818   52.028   15.226 -6.654064 16.70893 
1 1 1   13   18   32 f   29.685   7.0781   19.710   10.451   24.455   12.294   7.3393   19.849   32.782   8.8748   26.588   11.029 6.193968 14.15627 
1 1 1   13   18   33 o   66.848   4.9575   87.054   12.099   77.392   13.858  118.039   24.816   60.370   5.5655   73.326   8.2057 -12.95541 9.915085 
1 1 1   13   18   34 o   60.344   5.1822   75.328   11.613   70.479   13.551   88.740   22.536   57.495   5.7145   63.194   8.6466 -5.698944 10.36435 
1 1 1   13   18   35 o   24.592   7.5865   0.0815   14.787   8.5511   20.832  -8.5183   20.992   26.902   11.241   22.283   10.192 4.618952 15.17293 
1 1 1   13   18   36 o   70.397   6.1087  109.595   17.524   89.968   23.143  135.969   26.828   62.962   8.9119   77.833   8.3572 -14.87026 12.21738 
1 1 1   13   18   37 o   42.495   7.1026   46.783   11.698   51.285   13.732   34.871   22.337   48.194   6.9086   36.796   12.412 11.39788 14.20523 
1 1 1   13   18   38 f   43.043   7.0484   47.986   11.348   51.366   13.139   38.061   22.515   48.238   6.6041   37.849   12.454 10.38971 14.09677 
1 1 1   13   18   39 o   44.773   6.9584   52.735   11.441   56.333   13.332   42.685   22.284   50.329   6.4226   39.217   12.346 11.11245 13.91680 
1 1 1   13   18   40 o   60.966   9.5578  104.582   15.207  104.218   16.018  107.914   48.427   68.975   5.6304   52.956   18.268 16.01886 19.11561 
1 1 1   13   18   41 o   28.763   7.6309   20.347   11.259   20.972   12.728   18.098   24.139   28.810   9.3582   28.716   12.056 0.9419823E-01 15.26173 
1 1 1   13   18   42 o   38.292   8.2254   43.801   13.603   45.676   15.250   36.500   30.095   42.544   8.9735   34.041   13.788 8.502529 16.45086 
1 1 1   13   18   43 o   15.769   5.5830 -27.9793   11.944 -25.1411   13.567 -37.7624   25.188   13.399   6.6295   18.139   8.9850 -4.739572 11.16605 
1 1 1   13   18   44 o   28.963   8.2936   9.7677   12.573  -0.6754   13.854   58.508   29.930   18.693   8.4425   39.234   14.278 -20.54031 16.58719 
1 1 1   13   19    0 o  249.065   2.6928  1281.39   39.100  1281.39   39.100  1281.39   39.100  249.065   3.8082  249.065   3.8082 0.000000 0.000000 
1 1 1   13   19    1 o  150.895   2.1864  470.068   13.471  469.574   17.829  470.725   20.564  150.816   2.8662  150.974   3.3025 -0.1579590 4.372804 
1 1 1   13   19    2 o  153.328   2.3236  478.409   14.577  544.769   22.401  429.665   19.199  162.412   3.3441  144.244   3.2271 18.16772 4.647255 
1 1 1   13   19    3 o  308.960   3.1157  1971.51   35.998  1978.45   66.985  1968.69   42.686  309.176   5.2530  308.745   3.3521 0.4310608 6.231433 
1 1 1   13   19    4 o  229.225   2.6983  1082.28   23.161  1093.71   43.079  1077.64   27.469  229.982   4.5416  228.468   2.9151 1.513779 5.396659 
1 1 1   13   19    5 o  169.721   2.2438  598.373   15.580  561.898   23.127  628.683   21.082  164.941   3.3996  174.502   2.9292 -9.561462 4.487504 
1 1 1   13   19    6 o  239.967   2.4893  1192.84   24.466  1159.30   36.546  1220.08   32.936  236.875   3.7407  243.059   3.2855 -6.183411 4.978664 
1 1 1   13   19    7 o  152.952   2.2362  487.453   13.979  435.703   20.436  532.958   19.164  145.236   3.4116  160.667   2.8919 -15.43019 4.472392 
1 1 1   13   19    8 o  163.744   2.1856  551.658   14.357  562.376   23.278  545.078   18.239  164.997   3.4206  162.490   2.7215 2.506897 4.371142 
1 1 1   13   19    9 o  164.797   2.1888  558.236   14.449  571.780   23.545  550.054   18.300  166.366   3.4314  163.228   2.7183 3.137894 4.377612 
1 1 1   13   19   10 o   90.092   2.3562  165.693   8.5061  175.796   13.955  159.721   10.730   92.235   3.6683   87.948   2.9581 4.287064 4.712354 
1 1 1   13   19   11 o  161.458   2.2137  534.539   14.297  554.027   23.445  523.003   18.039  163.757   3.4713  159.160   2.7480 4.596390 4.427317 
1 1 1   13   19   12 o  230.841   2.4909  1105.36   23.598  1048.73   34.598  1154.62   32.267  225.264   3.7239  236.417   3.3092 -11.15329 4.981772 
1 1 1   13   19   13 o  100.633   2.7159  214.264   10.564  194.718   18.034  224.475   13.035   97.012   4.5072  104.254   3.0314 -7.242699 5.431823 
1 1 1   13   19   14 o  232.449   2.8960  1115.08   26.535  1124.98   44.759  1109.72   32.949  233.149   4.6546  231.748   3.4471 1.401001 5.792037 
1 1 1   13   19   15 o   47.171   4.5622   44.981   8.4005   32.104   10.856   64.199   13.262   38.704   7.0609   55.639   5.7791 -16.93510 9.124434 
1 1 1   13   19   16 o   66.148   3.7173   89.661   10.010   84.754   13.001   96.807   15.688   63.970   4.9276   68.326   5.5670 -4.356529 7.434565 
1 1 1   13   19   17 o  188.420   4.7184  735.138   36.668   0.0000   0.0000  735.138   36.668  ?   ?   188.420   4.7184      ?      ? 
1 1 1   13   19   18 o   58.733   3.4842   71.856   8.3912   66.696   12.254   76.411   11.514   56.720   5.2383   60.747   4.5956 -4.027145 6.968431 
1 1 1   13   19   19 o  109.041   2.6495  245.861   11.913  242.447   16.627  249.462   17.076  108.265   3.7236  109.816   3.7701 -1.551018 5.298967 
1 1 1   13   19   20 o   71.579   3.6060  102.932   10.474   86.062   13.472  128.714   16.655   64.403   5.0719   78.756   5.1273 -14.35294 7.212010 
1 1 1   13   19   21 o  165.199   2.8078  563.071   18.641  555.955   23.753  574.483   30.079  163.921   3.5133  166.478   4.3808 -2.556808 5.615535 
1 1 1   13   19   22 o   74.389   4.5165  116.085   13.741  110.109   20.491  120.968   18.523   72.575   6.8455   76.203   5.8934 -3.628090 9.032928 
1 1 1   13   19   23 o   81.887   3.1459  140.564   10.504  118.706   15.069  161.226   14.650   75.585   4.8336   88.189   4.0278 -12.60396 6.291844 
1 1 1   13   19   24 f   88.193   7.4083  160.563   14.642  159.232   15.259  176.039   52.031   87.555   4.2256   88.831   14.201 -1.276436 14.81658 
1 1 1   13   19   25 o  121.836   3.6621  311.477   18.296  278.667   26.213  342.643   25.548  115.451   5.5050  128.220   4.8309 -12.76923 7.324112 
1 1 1   13   19   26 o   81.966   3.8117  142.675   12.215  147.321   15.190  134.174   20.547   84.093   4.3796   79.839   6.2398 4.253868 7.623413 
1 1 1   13   19   27 o   82.573   5.9361  163.469   17.773   97.231   28.790  204.252   22.591   66.524   10.493   98.622   5.5539 -32.09781 11.87226 
1 1 1   13   19   28 o   32.200   8.4959   19.438   15.235   12.398   24.331   23.979   19.540   30.709   12.412   33.692   11.605 -2.983601 16.99174 
1 1 1   13   19   29 o  104.191   3.4214  226.063   14.132  221.152   17.617  234.929   23.670  102.865   4.1523  105.518   5.4389 -2.653824 6.842775 
1 1 1   13   19   30 o   27.710   7.0507   14.078   9.3007   12.294   10.807   19.171   18.263   24.700   8.6234   30.719   11.157 -6.019478 14.10133 
1 1 1   13   19   31 o   78.873   4.0897  122.592   12.250  109.533   14.407  156.671   23.274   72.160   4.8408   85.586   6.5932 -13.42599 8.179438 
1 1 1   13   19   32 o  121.265   4.0595  311.003   20.025  303.298   26.109  322.011   31.208  119.725   5.2873  122.806   6.1614 -3.081535 8.119058 
1 1 1   13   19   33 o   40.909   6.9434   38.132   10.548   37.028   12.282   41.235   20.589   40.618   7.6108   41.201   11.615 -0.5833321 13.88683 
1 1 1   13   19   34 f   34.153   7.3725   26.147   10.247   24.814   11.780   30.291   20.772   32.728   8.6106   35.579   11.970 -2.851086 14.74506 
1 1 1   13   19   35 o   31.279   8.9183   17.196   16.995   23.047   28.954   14.120   20.991   33.806   13.583   28.752   11.561 5.054001 17.83670 
1 1 1   13   19   36 o   30.720   6.9174   24.005   10.498   30.069   12.126   5.8557   20.977   35.789   8.3648   25.650   11.020 10.13927 13.83485 
1 1 1   13   19   37 o   27.983   6.8095   18.255   10.957   27.360   12.748  -7.4956   21.439   33.714   8.9996   22.251   10.222 11.46376 13.61909 
1 1 1   13   19   38 o   24.853   6.7115   12.541   10.298   19.205   11.735  -9.7864   21.479   28.245   8.9666   21.461   9.9888 6.784340 13.42294 
1 1 1   13   19   39 o   19.580   6.4279  -4.3703   10.234  -2.9964   11.424  -9.9555   23.033   17.081   7.6947   22.079   10.299 -4.997892 12.85590 
1 1 1   13   19   40 o   59.473   9.4319  110.197   15.279  111.812   16.088   95.331   48.802   71.354   5.4666   47.592   18.054 23.76139 18.86381 
1 1 1   13   19   41 o   48.307   7.2996   68.039   12.912   75.615   15.049   46.901   25.137   57.853   6.3068   38.761   13.167 19.09184 14.59915 
1 1 1   13   19   42 o   29.796   8.1540   24.109   13.196   24.331   14.928   23.315   28.230   29.917   10.147   29.675   12.767 0.2424393 16.30806 
1 1 1   13   19   43 o   27.201   8.7157   13.632   20.417   23.369   33.308   7.7713   25.842   29.314   13.179   25.087   11.410 4.226765 17.43136 
1 1 1   13   20    0 o  258.298   2.7409  1378.28   41.273  1378.28   41.273  1378.28   41.273  258.298   3.8762  258.298   3.8762 0.000000 0.000000 
1 1 1   13   20    1 o  140.831   2.4483  409.320   14.185  404.333   19.337  415.130   20.873  139.911   3.3510  141.751   3.5702 -1.840256 4.896532 
1 1 1   13   20    2 o  276.518   2.5639  1574.53   28.239  1600.14   46.587  1559.66   35.506  278.223   4.0598  274.813   3.1325 3.409332 5.127841 
1 1 1   13   20    3 o  247.122   2.7840  1257.35   25.708  1273.80   48.014  1250.74   30.439  248.133   4.6916  246.111   2.9987 2.022202 5.568069 
1 1 1   13   20    4 o  232.786   2.7754  1130.03   25.362  1086.96   42.633  1153.61   31.552  229.238   4.5091  236.333   3.2370 -7.096024 5.550707 
1 1 1   13   20    5 o  206.721   2.3575  884.432   19.902  870.245   30.219  895.299   26.448  205.229   3.5701  208.213   3.0798 -2.984070 4.714958 
1 1 1   13   20    6 o  119.882   2.2035  295.641   10.712  303.105   16.854  290.583   13.875  121.131   3.3735  118.633   2.8357 2.498657 4.407017 
1 1 1   13   20    7 o  201.626   2.3410  839.576   19.229  840.870   29.610  838.632   25.287  201.735   3.5587  201.518   3.0424 0.2167816 4.681935 
1 1 1   13   20    8 o  238.527   2.4111  1180.70   23.227  1148.52   36.521  1202.56   30.099  235.740   3.7561  241.314   3.0241 -5.574081 4.822247 
1 1 1   13   20    9 o   68.082   2.6516   97.021   7.1352   91.374   11.747  100.322   8.9821   66.470   4.2848   69.695   3.1247 -3.225128 5.303128 
1 1 1   13   20   10 o  259.485   2.5093  1390.91   26.107  1393.18   42.209  1389.51   33.225  259.594   3.9423  259.375   3.1057 0.2192688 5.018690 
1 1 1   13   20   11 o  132.548   2.2377  368.845   11.933  332.654   18.536  394.458   15.594  126.878   3.5421  138.219   2.7354 -11.34144 4.475379 
1 1 1   13   20   12 o  161.135   2.3113  540.235   15.250  481.634   22.038  594.069   21.123  152.670   3.5000  169.600   3.0197 -16.92981 4.622610 
1 1 1   13   20   13 o   52.951   3.4016   61.046   6.9408   48.533   11.410   68.396   8.7451   48.378   5.7181   57.524   3.6859 -9.145584 6.803154 
1 1 1   13   20   14 o  106.887   2.9388  234.587   12.908  213.273   17.414  260.576   19.229  101.538   4.1581  112.236   4.1540 -10.69735 5.877542 
1 1 1   13   20   15 o  176.636   2.5331  644.243   18.269  649.836   27.935  640.064   24.150  177.276   3.8206  175.995   3.3270 1.280869 5.066142 
1 1 1   13   20   16 o   91.364   2.7253  173.312   10.201  165.990   15.146  179.392   13.800   89.574   4.0996   93.154   3.5919 -3.580452 5.450585 
1 1 1   13   20   17 o  190.988   2.8316  747.194   21.330  780.355   36.222  729.590   26.392  194.111   4.5244  187.865   3.4061 6.246536 5.663178 
1 1 1   13   20   18 o  151.517   3.2231  469.691   19.966  432.864   26.213  520.580   30.814  144.558   4.3966  158.477   4.7143 -13.91885 6.446298 
1 1 1   13   20   19 o  121.793   2.9209  308.659   14.331  314.183   18.482  300.329   22.697  123.225   3.6365  120.361   4.5720 2.863808 5.841861 
1 1 1   13   20   20 o   31.862   5.7766   21.716   7.9493   31.463   11.525   12.870   10.979   38.103   7.5998   25.621   8.7017 12.48251 11.55323 
1 1 1   13   20   21 o  163.739   3.8106  561.964   24.252  570.877   29.828  544.579   41.659  165.912   4.3589  161.565   6.2516 4.346542 7.621190 
1 1 1   13   20   22 o   35.257   5.5098   28.293   8.0032   17.060   12.232   36.702   10.583   28.602   9.1626   41.913   6.1220 -13.31097 11.01956 
1 1 1   13   20   23 o  106.679   3.9864  237.637   17.495  235.212   23.850  240.463   25.741  106.137   5.4483  107.221   5.8208 -1.084732 7.972817 
1 1 1   13   20   24 o   91.909   4.1664  178.905   15.620  158.128   22.900  196.981   21.360   86.733   6.4016   97.085   5.3345 -10.35224 8.332890 
1 1 1   13   20   25 o  102.162   3.8710  218.585   16.236  220.538   24.185  216.982   21.907  102.502   5.7207  101.823   5.2164 0.6789932 7.741901 
1 1 1   13   20   26 o   34.579   6.6177   24.462   9.2744   19.169   11.267   35.584   16.333   29.525   8.6775   39.633   9.9938 -10.10769 13.23539 
1 1 1   13   20   27 o  147.975   3.1235  457.131   18.865  457.586   24.959  456.525   28.811  148.190   4.0836  147.759   4.7275 0.4307709 6.246994 
1 1 1   13   20   28 o   87.814   3.6709  159.063   12.868  149.800   16.077  175.577   21.466   84.523   4.6117   91.105   5.7127 -6.582680 7.341835 
1 1 1   13   20   29 o   36.440   6.4603   23.734   9.5800   12.462   11.318   52.212   17.990   24.991   8.8178   47.888   9.4439 -22.89712 12.92057 
1 1 1   13   20   30 o   29.684   6.8784   13.381   9.3651   5.6411   10.948   34.492   18.081   20.996   8.3817   38.373   10.909 -17.37635 13.75686 
1 1 1   13   20   31 o   48.801   5.8201   49.859   10.488   45.546   12.380   60.829   19.742   46.105   6.5103   51.498   9.6493 -5.392590 11.64013 
1 1 1   13   20   32 o   58.628   10.310   91.380   19.969   93.177   21.562   80.546   52.948   65.080   8.0328   52.176   18.990 12.90446 20.61908 
1 1 1   13   20   33 o   37.944   6.6759   37.977   10.574   45.308   12.325   17.533   20.583   45.784   6.5270   30.104   11.648 15.67929 13.35189 
1 1 1   13   20   34 o   91.167   3.9562  175.191   13.659  171.061   16.289  184.976   25.070   90.029   4.3867   92.305   6.5851 -2.276398 7.912474 
1 1 1   13   20   35 o   35.842   9.2786   30.705   17.333   39.625   28.986   25.739   21.625   38.703   14.056   32.981   12.116 5.722710 18.55729 
1 1 1   13   20   36 f   25.557   6.9588   13.072   10.237   17.231   11.643  -1.0882   21.485   27.298   8.9548   23.816   10.654 3.482014 13.91756 
1 1 1   13   20   37 o   24.405   6.9995   0.7569   9.6216  -6.4811   10.806   28.443   21.135   15.554   7.1855   33.256   12.014 -17.70293 13.99890 
1 1 1   13   20   38 o   17.968   6.0420 -11.1768   9.7129 -12.9015   11.018  -5.1609   20.577   13.985   6.6974   21.950   10.058 -7.964990 12.08396 
1 1 1   13   20   39 o   21.682   6.8858  -2.4531   10.563  -6.6651   11.951   12.578   22.577   16.262   7.5282   27.101   11.532 -10.83931 13.77162 
1 1 1   13   20   40 o   27.916   8.7176   12.855   12.171   12.153   12.611   22.390   46.474   23.752   9.1374   32.080   14.849 -8.328537 17.43513 
1 1 1   13   20   41 o   21.499   6.9242  -0.7195   11.756  -3.3885   13.617   7.0916   23.296   18.048   8.2367   24.950   11.133 -6.902281 13.84845 
1 1 1   13   20   42 f   33.410   8.5596   25.383   13.578   14.048   15.489   63.001   28.218   24.680   9.9282   42.140   13.946 -17.45972 17.11914 
1 1 1   13   21    0 o   66.247   3.3652   92.051   12.849   92.051   12.849   92.051   12.849   66.247   4.7591   66.247   4.7591 0.000000 0.000000 
1 1 1   13   21    1 o   99.315   2.3609  204.367   9.6066  198.012   14.312  209.578   12.960   97.895   3.5446  100.735   3.1193 -2.840401 4.721714 
1 1 1   13   21    2 o  146.074   2.2113  442.041   13.153  431.917   20.160  449.543   17.355  144.594   3.3804  147.553   2.8517 -2.958115 4.422624 
1 1 1   13   21    3 o  104.457   2.5977  232.055   10.372  207.391   17.999  244.318   12.691  100.136   4.3579  108.778   2.8287 -8.641724 5.195482 
1 1 1   13   21    4 o  100.506   2.2312  209.635   9.0028  204.203   14.401  213.119   11.534   99.414   3.5122  101.599   2.7526 -2.184807 4.462348 
1 1 1   13   21    5 f  338.714   2.8891  2360.26   38.814  2415.37   64.778  2329.39   48.481  341.665   4.5969  335.763   3.5008 5.901703 5.778149 
1 1 1   13   21    6 o   63.947   2.6871   84.979   6.8524   82.707   11.148   86.358   8.6872   63.237   4.2744   64.657   3.2576 -1.420216 5.374223 
1 1 1   13   21    7 o  101.005   2.2901  212.025   9.3506  204.050   14.616  217.550   12.166   99.369   3.5663  102.641   2.8738 -3.271492 4.580106 
1 1 1   13   21    8 o  127.562   2.1789  333.164   11.109  347.734   18.284  324.639   13.986  129.730   3.4171  125.393   2.7043 4.337524 4.357766 
1 1 1   13   21    9 o  120.844   2.2116  299.955   10.732  308.904   17.397  294.458   13.635  122.270   3.4498  119.418   2.7683 2.851593 4.423184 
1 1 1   13   21   10 o  161.834   2.3762  526.003   15.592  625.710   25.019  462.694   19.937  174.011   3.4861  149.658   3.2299 24.35318 4.752328 
1 1 1   13   21   11 o  155.908   2.2898  504.950   14.559  482.134   22.031  522.641   19.399  152.740   3.4971  159.075   2.9568 -6.335312 4.579554 
1 1 1   13   21   12 o  193.601   2.4879  774.121   19.847  727.599   27.694  823.237   28.456  187.618   3.5789  199.584   3.4569 -11.96556 4.975835 
1 1 1   13   21   13 f   84.323   2.5531  150.046   8.5121  135.508   13.827  158.917   10.801   80.933   4.1424   87.712   2.9857 -6.779030 5.106244 
1 1 1   13   21   14 o  116.951   2.7416  279.842   12.954  268.584   16.571  297.534   20.774  113.987   3.5248  119.914   4.2003 -5.926361 5.483294 
1 1 1   13   21   15 o  103.468   2.7876  225.197   11.692  193.323   17.381  251.545   15.803   96.631   4.3610  110.305   3.4735 -13.67408 5.575273 
1 1 1   13   21   16 o  269.040   3.3451  1487.58   36.448  1565.91   57.895  1436.15   46.911  274.743   5.1092  263.336   4.3192 11.40659 6.690224 
1 1 1   13   21   17 o   86.856   3.4859  156.660   12.466  145.736   17.600  167.659   17.659   83.797   5.0923   89.915   4.7619 -6.118179 6.971852 
1 1 1   13   21   18 o  181.526   2.5197  681.265   18.837  734.104   27.063  631.602   26.237  188.362   3.4835  174.690   3.6415 13.67133 5.039324 
1 1 1   13   21   19 o  130.531   2.6770  353.421   14.243  348.979   21.805  356.727   18.812  129.771   4.0738  131.291   3.4740 -1.519241 5.353958 
1 1 1   13   21   20 o  114.399   3.0184  271.740   13.910  272.860   17.872  270.019   22.153  114.770   3.7755  114.029   4.7104 0.7410278 6.036790 
1 1 1   13   21   21 o  100.374   3.1910  208.861   13.141  204.330   17.621  214.540   19.727   99.185   4.3074  101.563   4.7092 -2.377396 6.382036 
1 1 1   13   21   22 o   25.197   7.0878   4.4412   11.075   16.937   18.227  -2.8708   13.943   30.412   11.131   19.981   8.7781 10.43072 14.17568 
1 1 1   13   21   23 o  144.959   3.1894  441.069   18.917  391.335   27.368  486.566   26.176  136.962   4.8449  152.955   4.1494 -15.99226 6.378861 
1 1 1   13   21   24 o   96.306   3.3323  193.811   12.856  194.251   16.358  193.100   20.790   96.593   4.1059   96.019   5.2496 0.5747299 6.664614 
1 1 1   13   21   25 o   82.565   4.1416  143.665   14.077  134.816   20.016  152.327   19.803   79.985   6.0673   85.145   5.6390 -5.160027 8.283150 
1 1 1   13   21   26 o   50.827   5.8851   61.017   11.178   79.398   14.858   37.038   16.969   61.367   5.8702   40.288   10.202 21.07914 11.77024 
1 1 1   13   21   27 o   74.918   4.3175  126.736   12.097  140.974   14.878   98.963   20.779   82.047   4.3965   67.789   7.4320 14.25761 8.635057 
1 1 1   13   21   28 o   43.629   5.9565   39.980   9.7684   34.802   11.745   51.599   17.593   39.598   7.4652   47.660   9.2837 -8.061886 11.91291 
1 1 1   13   21   29 o  103.798   4.2440  230.451   17.903  219.629   27.374  238.539   23.665  101.360   6.5479  106.235   5.4010 -4.874702 8.488002 
1 1 1   13   21   30 o   58.912   4.6813   71.746   10.883   65.614   13.332   83.992   18.840   55.541   5.8197   62.284   7.3340 -6.743179 9.362514 
1 1 1   13   21   31 f   69.039   4.5679  108.370   11.981  121.849   14.990   84.528   19.937   75.973   4.7839   62.106   7.7831 13.86755 9.135794 
1 1 1   13   21   32 o   78.861   7.6394  167.708   15.196  177.513   16.517  113.664   38.777   91.801   4.3623   65.921   14.643 25.88063 15.27879 
1 1 1   13   21   33 o   50.546   5.9692   54.896   10.939   51.027   12.803   65.356   21.053   48.556   6.3928   52.537   10.082 -3.980934 11.93833 
1 1 1   13   21   34 o   47.579   6.5133   50.980   11.839   46.998   14.380   59.360   20.858   45.914   7.5933   49.245   10.585 -3.330402 13.02663 
1 1 1   13   21   35 o   33.267   8.5118   26.567   15.202   19.643   21.013   34.169   22.019   30.194   11.745   36.340   12.323 -6.145895 17.02354 
1 1 1   13   21   36 o   19.574   6.2591  -8.4206   9.4011 -14.5131   10.862   9.7689   18.768   13.546   6.5287   25.603   10.681 -12.05715 12.51826 
1 1 1   13   21   37 o   30.714   7.1278   24.224   10.255   26.758   11.913   16.971   20.155   33.132   8.6313   28.297   11.346 4.834743 14.25558 
1 1 1   13   21   38 o   26.059   7.3924   13.197   10.789   12.791   12.290   14.558   22.525   24.332   9.0969   27.787   11.655 -3.455292 14.78481 
1 1 1   13   21   39 o   31.193   7.7208   24.486   11.157   22.461   12.885   30.558   22.309   29.621   9.3949   32.765   12.255 -3.144148 15.44168 
1 1 1   13   21   40 o   18.390   6.1515  -6.5690   10.201  -4.6679   11.400 -14.2064   22.850   16.235   7.4565   20.546   9.7858 -4.311747 12.30290 
1 1 1   13   21   41 o   27.843   9.8485   20.751   14.127   20.751   14.127   0.0000   0.0000   27.843   9.8485  ?   ?       ?      ? 
1 1 1   13   21   42 o   39.523   7.4541   52.067   13.947   60.522   15.944   24.519   28.779   49.824   7.7587   29.223   12.730 20.60015 14.90821 
1 1 1   13   22    0 f   25.354   7.5254   18.840   11.185   18.840   11.185   18.840   11.185   25.354   10.642   25.354   10.642 0.000000 0.000000 
1 1 1   13   22    1 o  164.177   2.5111  557.425   16.948  562.408   23.108  551.623   24.932  164.986   3.3958  163.368   3.7003 1.618347 5.022280 
1 1 1   13   22    2 o   94.251   2.6827  188.533   9.5726  170.951   16.972  196.736   11.593   90.895   4.5271   97.607   2.8796 -6.711624 5.365338 
1 1 1   13   22    3 o  167.711   2.4996  576.132   15.674  593.297   29.363  569.292   18.535  169.371   4.2033  166.050   2.7064 3.321289 4.999290 
1 1 1   13   22    4 o  143.758   2.1568  427.274   12.478  424.858   19.936  428.830   15.998  143.400   3.3708  144.117   2.6915 -0.7175293 4.313529 
1 1 1   13   22    5 o  150.588   2.1625  465.246   13.034  481.142   21.330  455.772   16.467  152.600   3.3889  148.575   2.6871 4.025238 4.325003 
1 1 1   13   22    6 o   90.885   2.3312  168.181   8.5189  181.464   13.893  160.178   10.784   93.703   3.5947   88.066   2.9690 5.636719 4.662311 
1 1 1   13   22    7 o  131.003   2.1856  353.329   11.493  359.552   18.597  349.485   14.618  131.909   3.4183  130.097   2.7243 1.811981 4.371151 
1 1 1   13   22    8 o   48.454   3.3813   51.152   6.2547   41.267   10.526   56.548   7.7765   44.604   5.7217   52.305   3.6048 -7.700756 6.762592 
1 1 1   13   22    9 o  167.767   2.2145  583.908   14.978  569.639   23.689  593.412   19.333  166.020   3.4596  169.515   2.7652 -3.495407 4.428911 
1 1 1   13   22   10 o  131.613   2.2464  363.460   11.922  327.665   18.389  389.414   15.659  125.906   3.5412  137.319   2.7648 -11.41365 4.492716 
1 1 1   13   22   11 o  123.635   2.4181  318.082   12.193  262.887   17.203  373.801   17.284  112.761   3.6990  134.510   3.1155 -21.74969 4.836209 
1 1 1   13   22   12 o  136.418   2.3142  383.943   12.817  388.249   20.021  380.952   16.685  137.040   3.5422  135.795   2.9790 1.244461 4.628349 
1 1 1   13   22   13 o   85.431   2.6370  147.657   9.1669  171.506   14.487  131.731   11.838   91.050   3.8577   79.813   3.5963 11.23672 5.273991 
1 1 1   13   22   14 o  131.459   2.8853  356.173   14.902  352.603   18.411  362.955   25.375  130.583   3.4185  132.335   4.6491 -1.751526 5.770647 
1 1 1   13   22   15 f  188.384   2.5555  735.573   19.675  723.890   29.778  744.625   26.212  187.011   3.8607  189.757   3.3492 -2.745956 5.110962 
1 1 1   13   22   16 o  166.862   4.1242  576.835   28.383   0.0000   0.0000  576.835   28.383  ?   ?   166.862   4.1242      ?      ? 
1 1 1   13   22   17 o  208.340   2.9763  900.093   25.072  897.913   39.542  901.559   32.423  208.023   4.6087  208.658   3.7675 -0.6346130 5.952646 
1 1 1   13   22   18 o  199.469   3.0560  832.434   24.512  791.026   38.752  860.051   31.648  195.161   4.8144  203.777   3.7655 -8.615646 6.112034 
1 1 1   13   22   19 o  124.674   2.5514  322.118   13.116  318.584   18.693  325.545   18.409  123.993   3.6552  125.355   3.5606 -1.362640 5.102808 
1 1 1   13   22   20 o  203.333   2.4601  856.959   20.631  850.435   29.152  863.505   29.201  202.555   3.4895  204.111   3.4687 -1.556610 4.920185 
1 1 1   13   22   21 o   98.194   2.7455  200.402   11.100  196.985   16.100  203.497   15.324   97.373   4.0089   99.015   3.7523 -1.641487 5.490992 
1 1 1   13   22   22 o  107.084   3.2430  238.181   13.765  235.800   17.197  242.426   22.963  106.502   3.9151  107.666   5.1712 -1.164795 6.486028 
1 1 1   13   22   23 o  103.405   3.3974  231.156   13.468  201.304   23.014  246.705   16.609   97.870   5.7012  108.939   3.6965 -11.06920 6.794702 
1 1 1   13   22   24 o   64.337   4.6427   96.016   11.119  122.793   14.507   57.882   17.311   76.689   4.5863   51.986   8.0738 24.70309 9.285492 
1 1 1   13   22   25 o   47.332   5.3791   50.565   9.5085   54.512   11.809   43.288   16.034   50.848   5.6308   43.817   9.1670 7.030495 10.75824 
1 1 1   13   22   26 o  101.557   4.5250  227.640   18.012  189.161   28.869  252.167   23.048   93.682   7.4715  109.432   5.1066 -15.74959 9.049912 
1 1 1   13   22   27 o   70.898   4.2645  111.161   11.439  119.237   14.001   94.945   19.838   75.397   4.5022   66.399   7.2439 8.998474 8.529051 
1 1 1   13   22   28 o   53.216   5.3209   64.798   10.303   70.134   12.602   54.043   17.891   57.632   5.3017   48.800   9.2272 8.832020 10.64182 
1 1 1   13   22   29 o   81.180   3.8981  140.280   12.589  141.592   15.898  138.073   20.614   82.002   4.7006   80.357   6.2197 1.645432 7.796122 
1 1 1   13   22   30 o   70.814   4.2056  106.018   11.843  102.828   14.807  111.680   19.731   69.663   5.1535   71.964   6.6475 -2.300812 8.411162 
1 1 1   13   22   31 o   92.366   4.3964  180.708   16.612  156.125   21.991  213.379   25.353   85.139   6.2626   99.594   6.1720 -14.45503 8.792859 
1 1 1   13   22   32 o   39.687   6.6142   36.743   9.9183   36.440   11.754   37.493   18.483   40.218   7.3570   39.156   10.994 1.061378 13.22831 
1 1 1   13   22   33 o   47.789   8.3574   61.669   12.231   63.391   12.971   47.848   36.739   54.177   5.8046   41.400   15.675 12.77787 16.71487 
1 1 1   13   22   34 o   26.978   7.1397   10.986   9.9567   4.7924   11.656   27.704   19.151   20.527   8.4780   33.428   11.490 -12.90068 14.27933 
1 1 1   13   22   35 o   26.021   6.8040   14.888   9.8303   18.955   11.635   4.7385   18.378   28.230   8.9248   23.812   10.273 4.418177 13.60810 
1 1 1   13   22   36 o   41.688   7.8683   46.052   14.161   58.359   20.162   34.070   19.895   47.781   10.516   35.595   11.707 12.18635 15.73658 
1 1 1   13   22   37 o   42.434   6.7711   45.495   10.883   46.739   12.890   42.407   20.306   45.499   6.8689   39.368   11.671 6.130562 13.54217 
1 1 1   13   22   38 f   52.637   6.6013   64.661   12.373   59.472   14.338   79.787   24.482   51.030   6.8126   54.244   11.309 -3.214577 13.20261 
1 1 1   13   22   39 o   20.272   6.5511  -0.8216   10.540  -0.0199   11.947  -3.6353   22.382   18.156   8.0441   22.388   10.342 -4.231857 13.10229 
1 1 1   13   22   40 o   19.953   6.5038  -1.6577   11.280   0.6578   12.991  -8.7554   22.744   18.785   8.3523   21.121   9.9718 -2.336021 13.00760 
1 1 1   13   22   41 o   36.838   9.6105   36.985   14.755   36.985   14.755   0.0000   0.0000   36.838   9.6105  ?   ?       ?      ? 
1 1 1   13   23    0 o  295.593   3.6561  1807.84   62.993  1807.84   62.993  1807.84   62.993  295.593   5.1705  295.593   5.1705 0.000000 0.000000 
1 1 1   13   23    1 o  172.069   2.7471  606.410   18.947  588.466   23.942  636.476   30.991  168.745   3.4400  175.392   4.2841 -6.646286 5.494294 
1 1 1   13   23    2 o  178.140   2.4086  656.295   17.494  652.406   26.803  659.181   23.091  177.651   3.6581  178.628   3.1342 -0.9770966 4.817120 
1 1 1   13   23    3 f  252.494   2.8623  1284.86   26.236  1390.05   52.140  1249.20   30.360  259.067   4.8797  245.921   2.9932 13.14583 5.724591 
1 1 1   13   23    4 o   96.324   2.2899  193.772   8.7925  183.369   14.208  200.227   11.193   94.181   3.6577   98.467   2.7561 -4.286095 4.579855 
1 1 1   13   23    5 o   50.926   3.2958   58.355   6.3312   38.971   10.139   70.744   8.1056   43.343   5.6717   58.509   3.3589 -15.16618 6.591695 
1 1 1   13   23    6 o   77.862   2.4939  125.611   7.7989  123.967   12.505  126.658   9.9769   77.423   3.9160   78.301   3.0893 -0.8777237 4.987893 
1 1 1   13   23    7 o  308.121   2.7408  1958.36   33.683  1982.94   55.333  1943.89   42.455  309.544   4.3340  306.697   3.3562 2.847382 5.481621 
1 1 1   13   23    8 o  124.919   2.2228  323.898   11.151  315.798   17.827  329.104   14.291  123.602   3.4970  126.236   2.7448 -2.633881 4.445581 
1 1 1   13   23    9 o  214.901   2.6103  954.392   23.125  935.968   32.108  974.251   33.334  212.753   3.6591  217.050   3.7236 -4.297043 5.220511 
1 1 1   13   23   10 o  175.406   2.5720  640.603   17.093  625.324   30.879  647.352   20.524  173.788   4.3080  177.025   2.8110 -3.236694 5.143995 
1 1 1   13   23   11 o  160.824   2.6290  532.200   16.401  543.478   28.683  526.722   19.991  161.999   4.2929  159.649   3.0360 2.349609 5.257930 
1 1 1   13   23   12 o  177.971   2.2934  652.994   16.352  662.549   26.575  647.171   20.744  178.964   3.6003  176.978   2.8419 1.985214 4.586782 
1 1 1   13   23   13 o   73.882   2.9779  114.605   8.9512   99.023   13.150  128.059   12.219   69.105   4.6137   78.658   3.7664 -9.552864 5.955839 
1 1 1   13   23   14 f  141.846   3.1366  418.845   18.232  400.783   27.028  433.926   24.696  138.978   4.7151  144.713   4.1377 -5.734665 6.273221 
1 1 1   13   23   15 o  210.282   2.6784  909.634   23.143  846.439   31.129  987.721   34.603  202.184   3.7330  218.380   3.8418 -16.19644 5.356729 
1 1 1   13   23   16 o   90.193   2.9065  165.986   10.550  180.382   17.183  157.277   13.365   93.240   4.4681   87.145   3.7185 6.094505 5.813023 
1 1 1   13   23   17 o  141.413   3.1803  414.897   18.504  408.761   25.218  422.052   27.234  140.313   4.3577  142.514   4.6332 -2.200317 6.360517 
1 1 1   13   23   18 o  106.516   2.8144  236.497   12.274  203.245   17.312  270.106   17.405   98.908   4.2438  114.123   3.6977 -15.21554 5.628717 
1 1 1   13   23   19 o  129.651   2.5067  348.645   13.395  332.203   18.858  365.389   19.030  126.551   3.6129  132.751   3.4757 -6.199402 5.013339 
1 1 1   13   23   20 o   85.614   3.2882  151.150   11.409  144.391   14.679  161.461   18.131   83.294   4.2728   87.933   4.9992 -4.638580 6.576382 
1 1 1   13   23   21 o   58.514   3.5723   71.350   8.5774   74.320   12.897   68.994   11.486   59.568   5.2494   57.460   4.8465 2.108624 7.144595 
1 1 1   13   23   22 o   87.315   3.4573  160.955   12.002  165.431   15.209  153.568   19.539   89.112   4.1381   85.517   5.5395 3.595413 6.914522 
1 1 1   13   23   23 o   72.569   5.8854  111.730   12.942  110.999   14.137  115.511   32.163   72.866   4.7039   72.272   10.790 0.5938721 11.77086 
1 1 1   13   23   24 o   29.649   5.6147   20.046   7.3942   11.162   11.014   27.336   9.9765   24.147   8.6794   35.151   7.1252 -11.00459 11.22943 
1 1 1   13   23   25 o   75.039   3.4764  118.240   10.528  119.278   16.729  117.559   13.547   75.162   5.3963   74.916   4.3842 0.2466965 6.952770 
1 1 1   13   23   26 o   31.794   6.8200   14.519   12.210   45.371   18.461  -9.4728   16.279   44.161   10.321   19.426   8.9181 24.73499 13.64005 
1 1 1   13   23   27 o  107.723   3.7376  245.195   16.477  207.346   22.916  285.706   23.709   98.948   5.6153  116.498   4.9343 -17.55055 7.475222 
1 1 1   13   23   28 o   26.715   6.6240   10.269   9.0415   2.6104   10.932   26.852   16.086   19.447   8.1357   33.982   10.456 -14.53460 13.24794 
1 1 1   13   23   29 o   52.751   4.8011   55.033   9.9507   43.921   12.042   78.960   17.670   45.181   6.4619   60.320   7.1025 -15.13861 9.602195 
1 1 1   13   23   30 o   21.035   6.2797   3.4214   9.0640   6.0657   10.918  -2.4420   16.258   20.976   8.3714   21.093   9.3627 -0.1164379 12.55945 
1 1 1   13   23   31 o  113.726   3.4793  273.414   15.915  269.237   20.315  280.053   25.608  112.957   4.3605  114.495   5.4229 -1.538155 6.958560 
1 1 1   13   23   32 o   21.691   6.2881   6.0335   8.9007   10.328   10.284  -6.7826   17.766   22.811   8.3591   20.571   9.3959 2.240602 12.57611 
1 1 1   13   23   33 o   60.677   7.8156   89.008   13.968   88.168   15.280   93.277   34.458   63.749   5.8115   57.604   14.511 6.145004 15.63113 
1 1 1   13   23   34 o   55.997   5.1926   62.972   11.110   51.499   13.051   93.168   21.172   48.226   6.5612   63.768   8.0501 -15.54233 10.38523 
1 1 1   13   23   35 f   38.264   6.9043   37.892   10.441   39.796   12.390   33.228   19.394   41.270   7.5577   35.258   11.557 6.011967 13.80864 
1 1 1   13   23   36 o   22.145   7.0267  -1.4594   13.457  -7.7643   18.873   5.0609   19.193   20.405   9.4511   23.885   10.401 -3.479805 14.05334 
1 1 1   13   23   37 o   19.375   6.1933  -1.1959   10.004   1.5117   11.836  -7.9683   18.719   18.753   8.1665   19.997   9.3131 -1.244001 12.38653 
1 1 1   13   23   38 o   31.982   7.8181   24.292   11.193   19.166   12.890   39.995   22.562   27.538   9.4284   36.427   12.474 -8.888483 15.63612 
1 1 1   13   23   39 o   40.661   7.5834   48.449   12.566   51.061   14.852   41.869   23.573   45.296   8.2542   36.027   12.724 9.268906 15.16689 
1 1 1   13   23   40 o   30.881   8.2595   22.820   12.894   14.418   14.873   48.231   25.866   24.641   9.7906   37.120   13.305 -12.47903 16.51905 
1 1 1   13   24    0 o  149.727   2.6417  463.812   23.039  463.812   23.039  463.812   23.039  149.727   3.7360  149.727   3.7360 0.000000 0.000000 
1 1 1   13   24    1 o   56.794   3.4609   66.099   7.9827   62.881   10.313   70.908   12.608   55.107   4.5376   58.481   5.2270 -3.373379 6.921816 
1 1 1   13   24    2 o  119.625   2.4800  294.293   12.049  304.480   18.897  287.314   15.642  121.338   3.7759  117.913   3.2163 3.424301 4.960059 
1 1 1   13   24    3 o  149.118   2.2181  458.560   13.628  435.430   18.802  484.166   19.783  145.164   3.1403  153.073   3.1334 -7.909088 4.436193 
1 1 1   13   24    4 o   88.210   2.4333  160.764   8.8363  147.687   12.327  174.585   12.673   84.517   3.5363   91.904   3.3433 -7.387321 4.866550 
1 1 1   13   24    5 o  134.024   2.2010  370.785   11.855  372.983   19.068  369.400   15.137  134.316   3.4419  133.731   2.7443 0.5854340 4.402052 
1 1 1   13   24    6 o  190.166   2.7657  755.799   21.180  711.322   33.259  786.141   27.470  185.337   4.3509  194.996   3.4156 -9.659027 5.531438 
1 1 1   13   24    7 o  118.595   2.2676  294.572   10.779  273.351   17.075  308.631   13.898  114.961   3.6011  122.229   2.7568 -7.268463 4.535202 
1 1 1   13   24    8 o  117.708   2.2661  290.018   10.701  269.887   16.923  303.430   13.813  114.225   3.5921  121.191   2.7635 -6.965836 4.532131 
1 1 1   13   24    9 o   89.531   2.3986  162.007   8.5067  179.042   14.476  153.021   10.514   93.014   3.7733   86.048   2.9624 6.966667 4.797271 
1 1 1   13   24   10 o   37.362   5.0648   30.472   6.2767   28.381   13.535   31.045   7.0845   36.023   9.1055   38.701   4.4384 -2.677582 10.12963 
1 1 1   13   24   11 o   60.152   3.2751   74.492   8.0759   80.058   12.261   70.227   10.733   62.110   4.7863   58.195   4.4716 3.914997 6.550139 
1 1 1   13   24   12 o  127.115   2.2773  331.853   11.560  343.568   19.030  325.003   14.553  128.835   3.5814  125.394   2.8139 3.440392 4.554607 
1 1 1   13   24   13 o  108.848   2.8371  242.940   12.634  226.610   16.643  265.150   19.410  104.595   3.8579  113.100   4.1609 -8.504570 5.674162 
1 1 1   13   24   14 o   82.783   2.7065  141.717   9.2272  146.731   13.501  137.322   12.640   84.148   3.8900   81.418   3.7642 2.730278 5.413061 
1 1 1   13   24   15 o   29.940   5.6582   20.249   7.0061   15.544   12.124   22.608   8.5847   27.608   9.1415   32.271   6.6702 -4.663795 11.31631 
1 1 1   13   24   16 o  139.576   2.5725  403.731   14.799  383.045   20.674  425.468   21.193  135.901   3.6884  143.251   3.5870 -7.350128 5.144990 
1 1 1   13   24   17 o  135.644   2.6093  381.425   14.552  341.661   20.231  424.056   20.948  128.295   3.8233  142.994   3.5518 -14.69888 5.218538 
1 1 1   13   24   18 f   65.945   3.4884   92.748   9.1166   82.910   14.663   98.948   11.640   62.909   5.6512   68.981   4.0912 -6.072792 6.976702 
1 1 1   13   24   19 o   81.482   3.0326  141.039   9.9823  119.332   14.915  158.651   13.435   75.590   4.7841   87.374   3.7281 -11.78399 6.065174 
1 1 1   13   24   20 o   97.321   2.6943  197.386   10.793  188.657   15.533  205.535   15.007   95.205   3.9557   99.438   3.6591 -4.233498 5.388571 
1 1 1   13   24   21 o   41.051   4.5606   36.656   7.4047   31.529   10.948   40.978   10.053   37.925   7.2633   44.178   5.5174 -6.252415 9.121253 
1 1 1   13   24   22 o   37.746   4.9713   31.143   7.4628   29.438   11.418   32.415   9.8607   36.358   7.8442   39.133   6.1094 -2.774712 9.942610 
1 1 1   13   24   23 o   32.701   8.3697   7.3091   10.191   1.9606   10.772   52.881   31.444   19.156   8.0486   46.246   14.677 -27.08967 16.73940 
1 1 1   13   24   24 o   57.864   3.6786   70.804   8.7185   68.770   13.006   72.463   11.749   57.024   5.5298   58.703   4.8527 -1.679058 7.357148 
1 1 1   13   24   25 o   46.599   4.5358   44.542   8.5238   55.605   13.962   37.970   10.762   50.973   6.6412   42.225   6.1796 8.748688 9.071547 
1 1 1   13   24   26 o  102.945   3.4456  232.128   13.964  184.180   21.807  265.456   18.181   93.191   5.6735  112.699   3.9114 -19.50726 6.891151 
1 1 1   13   24   27 o   25.116   7.1176   7.9812   11.776  -3.3079   18.384   15.836   15.335   22.266   9.9156   27.966   10.214 -5.700308 14.23511 
1 1 1   13   24   28 o   50.990   5.3055   59.241   10.185   63.920   12.791   51.134   16.837   54.758   5.6636   47.221   8.9731 7.537045 10.61098 
1 1 1   13   24   29 o   60.828   4.4554   76.793   10.787   68.904   13.339   91.707   18.339   56.732   5.7006   64.924   6.8488 -8.191315 8.910825 
1 1 1   13   24   30 o   20.546   6.2578   1.9032   9.2672   5.2082   10.972  -6.3213   17.309   20.517   8.3200   20.575   9.3498 -0.5791283E-01 12.51560 
1 1 1   13   24   31 o   68.974   4.4815  102.108   12.287   97.623   15.318  110.201   20.575   67.343   5.5151   70.606   7.0654 -3.262726 8.963055 
1 1 1   13   24   32 o   25.595   6.8987   12.347   9.3706   10.867   11.110   15.994   17.444   23.337   8.6639   27.853   10.738 -4.516268 13.79741 
1 1 1   13   24   33 o   73.869   4.4683  123.412   13.031  134.184   16.744  106.867   20.750   78.871   5.1472   68.867   7.3055 10.00426 8.936631 
1 1 1   13   24   34 o   23.994   7.1743   8.9287   10.843   13.336   11.515 -25.5630   32.212   24.559   8.8684   23.429   11.280 1.130085 14.34864 
1 1 1   13   24   35 o   44.866   6.0755   40.538   10.361   26.934   12.210   75.550   19.587   33.053   8.7999   56.678   8.3789 -23.62440 12.15094 
1 1 1   13   24   36 o   28.542   7.6836   17.735   13.414   4.1922   18.568   32.520   19.401   23.001   10.117   34.082   11.567 -11.08117 15.36726 
1 1 1   13   24   37 f   23.285   6.9899   7.3816   10.170   5.4679   11.632   13.593   20.955   20.160   8.4093   26.411   11.168 -6.250671 13.97989 
1 1 1   13   24   38 o   28.182   7.2984   9.5780   10.535  -1.4500   11.996   46.744   22.023   17.531   7.8926   38.833   12.279 -21.30160 14.59687 
1 1 1   13   24   39 o   39.060   7.9082   46.336   13.465   49.214   16.825   41.211   22.456   42.603   9.7815   35.517   12.429 7.085896 15.81637 
1 1 1   13   25    0 o   91.206   4.3888  174.706   23.100  174.706   23.100  174.706   23.100   91.206   6.2067   91.206   6.2067 0.000000 0.000000 
1 1 1   13   25    1 o   89.544   4.1431  160.011   13.542  181.324   26.939  152.805   15.665   93.213   7.0072   85.875   4.4228 7.338020 8.286244 
1 1 1   13   25    2 o   48.223   4.6272   54.422   7.9079   35.504   13.231   64.936   9.8637   40.456   8.2098   55.989   4.2714 -15.53334 9.254487 
1 1 1   13   25    3 o  243.615   2.7214  1226.75   27.318  1192.77   37.641  1264.57   39.709  240.066   3.8015  247.164   3.8953 -7.097473 5.442884 
1 1 1   13   25    4 o   80.697   2.6173  134.953   8.6743  119.665   12.170  150.740   12.367   76.031   3.8809   85.363   3.5127 -9.332245 5.234506 
1 1 1   13   25    5 o  114.061   2.5333  270.652   11.786  258.488   17.823  280.104   15.712  111.740   3.8674  116.382   3.2732 -4.642403 5.066595 
1 1 1   13   25    6 o  155.371   2.4271  499.299   15.550  483.769   21.835  515.279   22.149  152.916   3.4620  157.826   3.4027 -4.910187 4.854234 
1 1 1   13   25    7 o  189.850   2.2775  749.673   17.463  723.804   27.395  767.382   22.665  187.017   3.5516  192.684   2.8520 -5.667404 4.554964 
1 1 1   13   25    8 o   71.452   2.6256  105.960   7.4029  104.809   12.394  106.599   9.2303   71.108   4.2260   71.796   3.1171 -0.6883926 5.251242 
1 1 1   13   25    9 o  112.939   2.3025  268.738   10.417  241.016   16.342  287.716   13.521  107.894   3.6722  117.984   2.7785 -10.08987 4.604916 
1 1 1   13   25   10 o  119.909   2.3528  301.208   11.454  272.334   17.297  323.757   15.285  114.686   3.6566  125.132   2.9617 -10.44613 4.705583 
1 1 1   13   25   11 o   76.480   2.8511  128.357   8.4744   91.776   13.090  154.749   11.119   66.468   4.7749   86.491   3.1169 -20.02256 5.702157 
1 1 1   13   25   12 o  163.445   2.3338  556.322   15.542  530.399   23.586  576.219   20.664  160.005   3.5739  166.886   3.0021 -6.881119 4.667513 
1 1 1   13   25   13 o  113.417   2.6999  264.899   12.435  256.263   16.111  277.628   19.559  111.198   3.5128  115.636   4.1010 -4.438377 5.399851 
1 1 1   13   25   14 o   35.389   4.8581   29.435   6.6771   16.782   10.416   38.261   8.6997   27.927   8.3770   42.850   4.9225 -14.92298 9.716191 
1 1 1   13   25   15 o   28.249   5.7133   15.990   6.6579   22.306   11.824   13.057   8.0566   31.817   8.7413   24.680   7.3593 7.136202 11.42667 
1 1 1   13   25   16 o  118.815   2.4489  292.802   11.995  295.866   17.276  289.949   16.667  119.405   3.5079  118.224   3.4182 1.181534 4.897894 
1 1 1   13   25   17 o   78.690   2.8825  128.836   9.3306  129.611   13.719  128.169   12.728   78.885   4.2166   78.496   3.9313 0.3892975 5.764974 
1 1 1   13   25   18 o   77.373   2.9451  125.586   9.3308  114.249   13.607  135.650   12.820   73.996   4.4584   80.749   3.8493 -6.753204 5.890223 
1 1 1   13   25   19 o   34.054   5.3319   26.122   7.2164   21.423   11.899   28.856   9.0761   31.087   8.8534   37.021   5.9441 -5.933868 10.66373 
1 1 1   13   25   20 o   15.210   4.8066  -3.3320   6.1897  -7.7771   9.9135  -0.4920   7.9240   14.796   6.8520   15.624   6.7428 -0.8276386 9.613295 
1 1 1   13   25   21 o   36.188   5.0877   28.609   7.2884   33.035   11.068   25.220   9.6849   38.680   7.2025   33.697   7.1878 4.983494 10.17546 
1 1 1   13   25   22 o   90.532   2.8405  170.907   10.580  176.076   15.614  166.520   14.385   91.762   4.1256   89.302   3.9056 2.460747 5.681030 
1 1 1   13   25   23 o   80.454   3.0125  135.505   9.9566  136.098   14.763  135.010   13.485   80.562   4.4429   80.346   4.0694 0.2154083 6.024916 
1 1 1   13   25   24 o   30.299   4.8813   15.565   8.2795  -9.2377   11.414   43.110   12.028   15.676   7.2913   44.922   6.4919 -29.24639 9.762541 
1 1 1   13   25   25 o   57.605   3.6311   69.276   8.5572   77.088   13.164   63.560   11.261   60.338   5.2895   54.871   4.9759 5.467323 7.262166 
1 1 1   13   25   26 o   48.508   4.1601   50.478   8.2328   48.623   12.451   51.920   10.974   47.576   6.3454   49.441   5.3817 -1.865067 8.320273 
1 1 1   13   25   27 o   36.609   6.4399   31.636   11.881   3.3581   18.060   53.213   15.776   24.017   10.269   49.200   7.7742 -25.18295 12.87984 
1 1 1   13   25   28 o   36.502   6.4686   29.761   9.4979   24.564   11.919   38.800   15.720   32.488   8.7151   40.517   9.5614 -8.029037 12.93723 
1 1 1   13   25   29 o   17.825   5.7280  -4.9340   8.5429  -5.8843   10.357  -2.9111   15.111   15.560   7.1321   20.090   8.9652 -4.530297 11.45606 
1 1 1   13   25   30 o   40.996   6.3543   37.153   9.9903   30.963   12.144   50.115   17.573   36.343   8.2854   45.648   9.6364 -9.304737 12.70862 
1 1 1   13   25   31 o   45.907   6.3379   50.685   11.368   54.403   14.552   44.865   18.208   49.419   7.1395   42.396   10.474 7.023659 12.67585 
1 1 1   13   25   32 o   40.913   6.6015   36.245   10.397   26.494   12.450   58.723   18.903   32.961   8.9341   48.864   9.7212 -15.90287 13.20308 
1 1 1   13   25   33 o   37.518   7.1329   33.901   10.398   31.230   12.194   41.020   19.906   35.990   8.3727   39.047   11.550 -3.056625 14.26589 
1 1 1   13   25   34 o   49.770   7.8533   72.788   12.365   76.500   13.423   51.989   31.772   59.121   5.5049   40.418   14.710 18.70292 15.70663 
1 1 1   13   25   35 o   23.835   6.8506   8.9496   9.7940   5.1905   11.692   17.792   17.932   20.160   8.4220   27.510   10.807 -7.349951 13.70125 
1 1 1   13   25   36 o   35.743   7.1856   30.116   10.524   22.097   12.561   49.003   19.278   29.330   9.2733   42.155   10.979 -12.82441 14.37114 
1 1 1   13   25   37 o   54.415   7.7038   83.190   16.855  103.307   23.483   61.810   24.208   64.156   8.8744   44.673   12.595 19.48305 15.40768 
1 1 1   13   25   38 o   21.047   6.6874   1.7190   10.541  -0.9946   12.184   9.7906   21.014   17.660   7.9520   24.433   10.754 -6.772835 13.37486 
1 1 1   13   26    0 f  132.664   3.3904  365.582   26.157  365.582   26.157  365.582   26.157  132.664   4.7947  132.664   4.7947 0.000000 0.000000 
1 1 1   13   26    1 o  128.642   3.8599  342.763   20.480  342.763   20.480   0.0000   0.0000  128.642   3.8599  ?   ?       ?      ? 
1 1 1   13   26    2 o   83.029   2.8795  145.963   9.6071  126.089   14.738  160.649   12.669   77.953   4.5838   88.104   3.4864 -10.15107 5.759004 
1 1 1   13   26    3 o  170.595   2.3552  600.758   16.464  590.513   21.980  613.853   24.851  168.970   3.1539  172.219   3.4987 -3.248795 4.710415 
1 1 1   13   26    4 o  104.648   2.4346  225.611   10.479  213.328   14.190  240.345   15.541  101.535   3.3886  107.761   3.4967 -6.225914 4.869205 
1 1 1   13   26    5 o   74.420   3.1300  114.301   9.2601  112.712   11.601  117.091   15.372   73.767   3.8131   75.072   4.9645 -1.305016 6.259917 
1 1 1   13   26    6 o  140.126   2.6804  398.439   14.624  382.562   17.774  431.702   25.727  135.988   3.1691  144.264   4.3238 -8.275543 5.360819 
1 1 1   13   26    7 o  145.821   2.2125  437.391   12.924  450.448   21.082  429.530   16.358  147.501   3.4654  144.141   2.7515 3.360199 4.424963 
1 1 1   13   26    8 o   45.034   3.3836   42.426   5.8558   41.445   10.304   42.894   7.1169   44.579   5.6041   45.489   3.7933 -0.9101944 6.767151 
1 1 1   13   26    9 o   74.487   2.5978  116.058   7.6076  111.505   12.739  118.582   9.4847   73.280   4.2148   75.694   3.0380 -2.414658 5.195611 
1 1 1   13   26   10 o   48.203   3.3185   46.753   6.2044   53.047   11.099   43.892   7.4828   50.420   5.3370   45.985   3.9453 4.434742 6.636970 
1 1 1   13   26   11 o  106.994   2.3406  237.501   9.9445  236.087   16.432  238.318   12.492  106.673   3.7349  107.315   2.8223 -0.6415787 4.681283 
1 1 1   13   26   12 o   61.704   3.0703   83.588   7.1255   67.677   12.327   91.573   8.7322   56.927   5.2502   66.482   3.1846 -9.555294 6.140529 
1 1 1   13   26   13 o   38.815   4.8058   32.272   7.5164   34.998   10.719   29.634   10.543   40.787   6.3715   36.843   7.1964 3.944466 9.611673 
1 1 1   13   26   14 o   87.179   2.7681  160.550   9.7721  128.883   14.069  190.071   13.584   78.658   4.3366   95.700   3.4414 -17.04169 5.536204 
1 1 1   13   26   15 o  122.120   2.6162  309.279   12.907  313.490   20.485  306.507   16.621  122.713   4.0474  121.527   3.3160 1.186409 5.232349 
1 1 1   13   26   16 o  181.796   2.4823  686.098   18.562  680.366   25.288  692.793   27.332  181.019   3.3871  182.573   3.6297 -1.553757 4.964606 
1 1 1   13   26   17 o   70.039   3.0600  103.793   8.7069   88.748   12.795  116.766   11.882   65.161   4.7610   74.917   3.8454 -9.755592 6.120020 
1 1 1   13   26   18 o   90.203   2.6962  169.488   9.9966  169.159   14.751  169.768   13.594   90.085   3.9702   90.321   3.6492 -0.2366409 5.392490 
1 1 1   13   26   19 o   61.475   3.4149   80.796   8.4613   71.146   12.935   88.012   11.186   58.069   5.4009   64.881   4.1803 -6.811756 6.829719 
1 1 1   13   26   20 o   58.107   3.7443   72.127   8.6913   67.301   13.882   75.239   11.146   56.309   5.9772   59.905   4.5113 -3.595741 7.488551 
1 1 1   13   26   21 o   50.590   3.9300   54.990   8.0476   48.581   12.142   60.012   10.747   47.772   6.1623   53.408   4.8790 -5.635948 7.859933 
1 1 1   13   26   22 f   67.413   3.7364   95.609   10.269   93.754   13.481   98.174   15.849   66.747   4.8969   68.079   5.6446 -1.331474 7.472748 
1 1 1   13   26   23 o   61.711   3.4412   80.908   8.6329   75.380   13.096   85.157   11.480   59.705   5.3182   63.716   4.3686 -4.010853 6.882422 
1 1 1   13   26   24 o   32.984   5.7973   24.336   7.6367   26.967   12.666   22.832   9.5724   34.171   8.8989   31.796   7.4326 2.374907 11.59455 
1 1 1   13   26   25 o   39.761   5.5777   34.564   8.9377   26.147   11.866   45.602   13.588   33.721   8.5267   45.802   7.1928 -12.08137 11.15536 
1 1 1   13   26   26 o   58.255   3.6786   71.969   8.7756   73.849   13.290   70.515   11.685   58.832   5.4771   57.678   4.9121 1.154030 7.357152 
1 1 1   13   26   27 o   44.977   6.1270   46.153   9.4959   46.231   19.429   46.129   10.885   43.560   10.854   46.394   5.6884 -2.833080 12.25396 
1 1 1   13   26   28 o   32.793   6.6873   25.326   9.2944   24.514   11.621   26.768   15.484   32.294   8.5793   33.292   10.260 -0.9982147 13.37469 
1 1 1   13   26   29 o   24.785   6.6683   12.044   9.0970   13.174   10.956   9.5345   16.324   24.691   8.6791   24.879   10.126 -0.1877003 13.33658 
1 1 1   13   26   30 o   51.118   4.9898   55.909   10.221   49.037   12.753   68.248   17.090   47.161   6.5566   55.075   7.5235 -7.914841 9.979639 
1 1 1   13   26   31 o   66.028   4.3008   90.887   11.259   78.371   13.803  115.769   19.462   59.938   5.5836   72.117   6.5431 -12.17895 8.601635 
1 1 1   13   26   32 o   26.528   7.1264   15.164   10.644   13.260   13.948   17.819   16.469   25.168   9.6268   27.889   10.510 -2.720572 14.25271 
1 1 1   13   26   33 o   35.522   7.1677   30.724   10.292   27.465   12.229   38.638   19.058   33.324   8.7762   37.720   11.335 -4.395622 14.33544 
1 1 1   13   26   34 o   35.872   7.0167   32.229   10.169   29.055   12.264   39.209   18.188   34.029   8.7036   37.714   11.008 -3.684155 14.03336 
1 1 1   13   26   35 o   27.086   7.9554   13.632   10.937   11.908   11.743   24.915   30.042   23.315   8.8535   30.857   13.220 -7.541958 15.91085 
1 1 1   13   26   36 o   27.792   7.4262   18.344   10.333   15.652   11.831   27.005   21.221   25.118   8.9988   30.467   11.816 -5.348562 14.85250 
1 1 1   13   26   37 o   48.678   7.6204   68.950   16.053   38.949   22.414  100.545   23.002   34.562   12.386   62.794   8.8813 -28.23222 15.24087 
1 1 1   13   27    0 o   11.889   5.3340   1.0364   8.0269   1.0364   8.0269   1.0364   8.0269   11.889   7.5434   11.889   7.5434 0.000000 0.000000 
1 1 1   13   27    1 o   96.307   2.9465  192.719   11.671  211.193   16.633  174.800   16.382  100.883   3.9974   91.730   4.3299 9.152245 5.892958 
1 1 1   13   27    2 o   85.709   2.7936  153.141   9.6526  148.959   15.253  155.935   12.466   84.670   4.3678   86.749   3.4842 -2.078270 5.587292 
1 1 1   13   27    3 o  124.810   2.2773  321.973   11.712  307.421   16.149  338.120   17.011  121.841   3.2135  127.778   3.2277 -5.936455 4.554637 
1 1 1   13   27    4 o  101.926   2.3587  215.210   9.9153  218.484   14.088  211.997   13.958  102.696   3.3260  101.157   3.3455 1.538803 4.717477 
1 1 1   13   27    5 o   98.894   2.7057  204.399   10.918  191.396   16.378  214.797   14.646   95.992   4.1369  101.797   3.4884 -5.804741 5.411346 
1 1 1   13   27    6 o   83.084   2.7071  142.459   9.2262  136.122   12.314  150.570   13.931   81.008   3.6855   85.159   3.9664 -4.151169 5.414297 
1 1 1   13   27    7 o   32.896   4.7671   23.222   6.2214   27.151   9.4366   20.201   8.2743   35.378   6.7128   30.413   6.7704 4.964504 9.534157 
1 1 1   13   27    8 o   15.049   4.4342   1.2034   4.5362  -8.1061   9.3523   4.0674   5.1872   14.213   6.6071   15.885   5.9156 -1.672793 8.868409 
1 1 1   13   27    9 o  152.787   2.3718  485.246   14.891  467.646   21.777  500.704   20.408  150.137   3.5168  155.437   3.1833 -5.300034 4.743583 
1 1 1   13   27   10 o   67.979   2.7077   94.314   7.2839  101.997   12.367   90.234   9.0130   69.997   4.2839   65.962   3.3129 4.035736 5.415426 
1 1 1   13   27   11 o   44.797   3.4627   40.057   5.8248   46.497   11.109   37.616   6.8404   47.062   5.7233   42.532   3.8995 4.530575 6.925444 
1 1 1   13   27   12 o   63.515   3.1207   82.945   8.0807   91.797   12.631   76.812   10.514   66.309   4.6185   60.721   4.1981 5.588726 6.241358 
1 1 1   13   27   13 o   67.172   3.3895   93.429   9.3215   87.396   12.316  101.519   14.262   64.691   4.6161   69.653   4.9644 -4.962746 6.778932 
1 1 1   13   27   14 o   39.859   5.2228   35.361   8.1598   29.662   12.655   39.417   10.675   36.454   8.5626   43.264   5.9826 -6.809593 10.44552 
1 1 1   13   27   15 o   73.935   2.8767  114.178   8.7051  111.519   13.061  116.304   11.677   73.107   4.3316   74.762   3.7868 -1.654808 5.753481 
1 1 1   13   27   16 o   99.869   2.6225  207.881   10.790  196.401   15.242  219.417   15.278   97.077   3.8067  102.662   3.6083 -5.585205 5.245061 
1 1 1   13   27   17 o   75.192   2.9746  120.103   9.0760  101.350   13.309  136.404   12.409   69.505   4.6427   80.880   3.7198 -11.37594 5.949115 
1 1 1   13   27   18 o   38.608   4.3723   31.168   6.8786   35.172   10.790   28.426   8.9278   40.611   6.4419   36.605   5.9135 4.006618 8.744594 
1 1 1   13   27   19 o   54.694   3.5574   63.168   7.9449   61.887   12.044   64.154   10.571   54.116   5.3960   55.273   4.6371 -1.157085 7.114750 
1 1 1   13   27   20 o   27.031   5.6559   16.479   6.8535   12.264   10.721   19.393   8.9124   24.628   8.5895   29.434   7.3606 -4.805746 11.31185 
1 1 1   13   27   21 o  127.865   2.9255  345.509   15.150  323.082   23.312  361.905   19.933  124.035   4.5570  131.693   3.6698 -7.657951 5.850922 
1 1 1   13   27   22 o   22.622   5.9313   6.6657   7.7334  -0.3888   10.031   17.003   12.143   17.433   7.5550   27.811   9.1458 -10.37812 11.86265 
1 1 1   13   27   23 o   77.218   3.0057  124.415   9.5384  135.952   14.236  115.016   12.849   80.431   4.2913   74.005   4.2097 6.425804 6.011372 
1 1 1   13   27   24 o   21.053   5.4803   7.0832   7.0088  -4.0847   11.470   13.739   8.8544   17.184   7.7285   24.922   7.7720 -7.738560 10.96057 
1 1 1   13   27   25 o   20.092   5.6221   4.9703   6.9550   9.5178   10.630   1.5667   9.1964   22.657   8.4624   17.526   7.4040 5.131233 11.24413 
1 1 1   13   27   26 o  115.920   4.6425  301.995   17.329  308.779   19.408  275.316   38.487  121.205   3.8823  110.635   8.4343 10.57037 9.284953 
1 1 1   13   27   27 o   47.316   4.8347   52.593   8.4942   31.575   12.327   71.599   11.721   36.710   8.3321   57.922   4.9065 -21.21187 9.669405 
1 1 1   13   27   28 o   68.358   4.4888  102.906   11.089  100.932   21.437  103.627   12.958   66.911   7.7678   69.804   4.5007 -2.892456 8.977503 
1 1 1   13   27   29 o   19.578   5.8868   0.8838   8.9626   8.7436   11.215 -13.0054   14.909   22.108   8.5857   17.048   8.0562 5.060589 11.77355 
1 1 1   13   27   30 o   50.673   5.1269   57.060   10.496   52.549   13.365   64.320   16.956   48.458   6.6872   52.888   7.7732 -4.429417 10.25385 
1 1 1   13   27   31 o   43.227   5.9060   41.935   9.7389   35.425   11.900   55.135   16.946   38.777   7.7124   47.676   8.9466 -8.899216 11.81194 
1 1 1   13   27   32 o   41.025   6.6847   44.425   11.185   51.190   14.084   32.873   18.405   47.265   7.2246   34.786   11.249 12.47905 13.36945 
1 1 1   13   27   33 o   25.058   6.8210   14.161   9.9009   16.431   12.187   9.7551   16.980   26.007   9.1529   24.108   10.116 1.898621 13.64205 
1 1 1   13   27   34 o   37.948   6.7377   33.978   10.237   24.566   12.488   53.259   17.875   30.824   9.1559   45.073   9.8872 -14.24929 13.47546 
1 1 1   13   27   35 o   18.266   5.9682  -4.3802   9.4310  -6.5943   11.164   1.1379   17.624   15.361   7.1667   21.171   9.5454 -5.809922 11.93634 
1 1 1   13   27   36 o   22.620   6.5094   9.9325   10.200   16.372   12.217  -4.8872   18.533   25.317   9.1358   19.924   9.2750 5.392851 13.01883 
1 1 1   13   28    0 o  120.612   2.2735  301.394   15.968  301.394   15.968  301.394   15.968  120.612   3.2151  120.612   3.2151 0.000000 0.000000 
1 1 1   13   28    1 o  156.034   2.6676  505.439   17.164  497.932   23.971  513.339   24.588  154.851   3.7532  157.217   3.7919 -2.366119 5.335266 
1 1 1   13   28    2 o   62.265   2.8818   80.650   7.3921   75.862   10.418   85.504   10.491   60.390   4.1827   64.140   3.9655 -3.750893 5.763699 
1 1 1   13   28    3 o   90.780   2.4364  170.982   9.1202  166.370   12.875  175.627   12.921   89.545   3.4861   92.015   3.4046 -2.470345 4.872817 
1 1 1   13   28    4 o   92.262   2.4296  176.481   9.2298  162.760   12.867  191.026   13.248   88.556   3.5227   95.968   3.3469 -7.411583 4.859159 
1 1 1   13   28    5 f   73.345   2.7781  111.578   8.2263   83.108   11.211  144.786   12.108   63.173   4.3029   83.517   3.5151 -20.34443 5.556132 
1 1 1   13   28    6 o   48.332   3.2723   48.292   6.4863   56.062   9.6645   41.924   8.7496   51.850   4.5192   44.814   4.7338 7.036205 6.544667 
1 1 1   13   28    7 o   52.484   3.1838   58.035   6.8189   51.809   10.028   63.390   9.2999   49.787   4.8836   55.181   4.0862 -5.394638 6.367632 
1 1 1   13   28    8 o   64.051   2.9154   86.411   7.6125   75.702   11.152   95.755   10.417   60.235   4.4888   67.868   3.7215 -7.633038 5.830870 
1 1 1   13   28    9 o  175.881   2.7132  634.706   19.345  598.680   24.859  690.030   30.805  169.749   3.5506  182.013   4.1035 -12.26392 5.426372 
1 1 1   13   28   10 o   75.257   2.7119  123.413   7.7883  101.766   13.201  134.969   9.6457   69.815   4.5847   80.699   2.8980 -10.88484 5.423824 
1 1 1   13   28   11 o   98.008   2.4442  204.057   9.3412  184.767   15.639  214.755   11.647   94.201   4.0253  101.815   2.7735 -7.613571 4.888316 
1 1 1   13   28   12 o   71.986   3.5119  109.740   10.307   95.962   15.067  121.859   14.131   67.590   5.4049   76.383   4.4854 -8.793549 7.023700 
1 1 1   13   28   13 f   52.771   3.8431   59.301   7.8732   56.656   13.483   60.669   9.6984   51.672   6.3265   53.870   4.3650 -2.197365 7.686270 
1 1 1   13   28   14 o  104.229   2.7597  224.418   11.725  241.522   18.275  212.452   15.286  107.498   4.1218  100.960   3.6708 6.537613 5.519480 
1 1 1   13   28   15 f   48.721   3.8322   53.374   7.1778   37.820   11.269   63.994   9.3112   42.109   6.4882   55.333   4.0800 -13.22323 7.664375 
1 1 1   13   28   16 o   84.390   2.7451  149.132   9.5261  140.713   13.740  156.924   13.219   82.041   4.0607   86.739   3.6950 -4.698486 5.490180 
1 1 1   13   28   17 o   60.085   3.3767   79.030   8.0066   57.256   11.905   97.014   10.819   52.012   5.5494   68.158   3.8487 -16.14614 6.753384 
1 1 1   13   28   18 o   57.974   3.4197   72.729   7.9211   59.435   12.051   82.842   10.511   53.004   5.5123   62.944   4.0487 -9.939316 6.839441 
1 1 1   13   28   19 o   65.727   3.1858   91.555   8.5237   84.360   12.820   97.255   11.411   63.281   4.9120   68.174   4.0583 -4.893024 6.371649 
1 1 1   13   28   20 o   24.460   5.7093   12.800   6.6141   12.353   10.500   13.093   8.5162   24.473   8.5023   24.447   7.6219 0.2635384E-01 11.41857 
1 1 1   13   28   21 o   27.651   5.7209   16.426   6.8852   22.027   10.975   12.791   8.8416   31.029   8.3789   24.272   7.7915 6.756845 11.44178 
1 1 1   13   28   22 o   37.884   5.1600   33.141   7.6529   25.702   11.897   38.394   9.9957   33.368   8.5924   42.399   5.7160 -9.031635 10.31999 
1 1 1   13   28   23 o   58.270   4.2716   76.664   9.5467   61.179   15.733   85.688   12.010   52.862   7.2162   63.677   4.5731 -10.81456 8.543198 
1 1 1   13   28   24 o   60.212   4.1013   75.887   9.9681   68.800   12.637   87.560   16.218   56.746   5.3993   63.677   6.1750 -6.930908 8.202641 
1 1 1   13   28   25 o   25.958   6.3808   14.691   8.2922   14.660   10.853   14.736   12.853   25.699   8.6519   26.216   9.3809 -0.5167561 12.76153 
1 1 1   13   28   26 o   32.109   6.4094   25.153   8.8764   27.813   11.313   20.892   14.317   34.458   8.0973   29.761   9.9376 4.697027 12.81886 
1 1 1   13   28   27 o   27.642   7.9340   12.630   10.529   11.828   11.282   18.043   29.303   23.909   8.7562   31.375   13.233 -7.466688 15.86809 
1 1 1   13   28   28 o   31.596   7.1788   21.435   9.4867   34.727   19.160   17.118   10.919   36.273   11.451   26.920   8.6604 9.353380 14.35753 
1 1 1   13   28   29 o   23.834   6.5243  -2.8352   8.6998   31.649   18.964 -12.0267   9.7908   34.553   11.433   13.115   6.2892 21.43847 13.04856 
1 1 1   13   28   30 o   44.116   5.7479   43.122   9.9775   34.115   12.424   59.481   16.744   37.664   8.2282   50.569   8.0280 -12.90556 11.49575 
1 1 1   13   28   31 o   22.656   6.4285   5.4200   9.3767  -2.9335   11.841   19.469   15.355   17.241   7.7940   28.072   10.225 -10.83079 12.85693 
1 1 1   13   28   32 f   19.652   6.1280  -5.0316   9.2762 -13.3219   11.147   13.638   16.728   13.834   6.6539   25.471   10.292 -11.63704 12.25600 
1 1 1   13   28   33 o   71.934   4.3274  115.864   12.713  108.845   16.669  125.623   19.656   69.680   5.7999   74.188   6.4238 -4.507622 8.654747 
1 1 1   13   28   34 f   29.027   8.2670   18.005   11.386   14.489   12.262   40.010   30.676   24.414   9.0946   33.640   13.808 -9.226568 16.53397 
1 1 1   13   28   35 o   28.354   8.9497   0.1888   11.408  -6.3337   11.868   79.518   41.390   15.851   7.3933   40.856   16.301 -25.00568 17.89943 
1 1 1   13   29    0 o   50.636   3.3177   54.558   9.6055   54.558   9.6055   54.558   9.6055   50.636   4.6919   50.636   4.6919 0.000000 0.000000 
1 1 1   13   29    1 o   22.743   5.7177   9.0563   7.1217   2.7390   10.423   14.589   9.7539   19.379   8.0115   26.108   8.1598 -6.728546 11.43533 
1 1 1   13   29    2 o   89.828   2.4471  167.449   9.0565  156.865   12.627  178.662   12.996   86.895   3.5233   92.760   3.3970 -5.864784 4.894201 
1 1 1   13   29    3 f  106.162   2.4637  230.849   10.690  211.242   14.014  258.134   16.531  100.870   3.3684  111.453   3.5962 -10.58302 4.927358 
1 1 1   13   29    4 o   72.851   2.6778  110.854   7.9674   92.327   11.175  130.008   11.362   66.586   4.0692   79.117   3.4821 -12.53088 5.355669 
1 1 1   13   29    5 o  147.249   2.3158  450.145   14.014  452.027   19.053  447.926   20.685  147.625   3.1292  146.874   3.4147 0.7517090 4.631667 
1 1 1   13   29    6 o  133.777   2.6049  368.014   14.230  345.250   18.630  399.896   22.047  128.917   3.5037  138.638   3.8557 -9.721100 5.209852 
1 1 1   13   29    7 o   67.953   2.7141   95.865   7.5881   99.271   11.201   92.976   10.316   69.050   3.9330   66.856   3.7412 2.194679 5.428133 
1 1 1   13   29    8 o  154.744   2.3783  496.375   15.098  508.082   22.663  487.035   20.244  156.328   3.5150  153.160   3.2047 3.167465 4.756599 
1 1 1   13   29    9 f   23.623   5.4949   11.719   6.0237   9.7876   10.632   12.632   7.3102   23.193   8.4990   24.053   6.9671 -0.8595829 10.98972 
1 1 1   13   29   10 o   63.253   3.3663   86.861   8.2640   74.490   13.709   93.921   10.357   59.383   5.5974   67.122   3.7412 -7.739426 6.732563 
1 1 1   13   29   11 o   65.073   3.5569   93.348   8.6161   78.582   15.327  100.170   10.418   60.821   6.1099   69.325   3.6437 -8.503815 7.113853 
1 1 1   13   29   12 f   58.820   3.9941   76.409   9.2400   57.998   14.174   90.017   12.185   52.114   6.5942   65.526   4.5087 -13.41217 7.988272 
1 1 1   13   29   13 f   37.691   4.7500   29.636   6.5488   34.040   12.419   27.940   7.7075   38.972   7.9943   36.410   5.1325 2.562729 9.500068 
1 1 1   13   29   14 o   91.935   2.5954  177.524   9.7709  159.323   14.150  194.113   13.509   87.323   3.9287   96.547   3.3925 -9.223373 5.190738 
1 1 1   13   29   15 o   91.283   2.9447  180.310   10.640  148.404   16.657  202.306   13.830   84.006   4.8074   98.560   3.4022 -14.55398 5.889488 
1 1 1   13   29   16 o   42.410   3.8690   37.271   6.6285   41.839   10.723   34.446   8.4327   44.392   5.8565   40.427   5.0574 3.965321 7.737957 
1 1 1   13   29   17 o   18.074   5.0591   1.5279   5.4599   10.181   9.8590  -2.2997   6.5573   22.902   8.2137   13.246   5.9086 9.655664 10.11815 
1 1 1   13   29   18 o   50.635   3.5320   54.078   7.2228   54.982   11.471   53.484   9.2975   50.859   5.4684   50.411   4.4717 0.4480400 7.063955 
1 1 1   13   29   19 o   67.627   3.1454   97.234   8.6693   87.713   12.868  105.147   11.731   64.439   4.8416   70.815   4.0166 -6.376511 6.290804 
1 1 1   13   29   20 o   60.789   3.3011   79.580   8.0965   67.478   12.139   89.279   10.867   56.363   5.2216   65.214   4.0402 -8.851028 6.602153 
1 1 1   13   29   21 o   38.785   5.2080   33.832   8.0196   32.089   11.054   35.769   11.653   37.704   7.3723   39.865   7.3583 -2.161217 10.41609 
1 1 1   13   29   22 o   57.902   3.9038   72.851   8.8198   67.947   14.818   75.542   10.976   56.003   6.4152   59.801   4.4499 -3.797951 7.807515 
1 1 1   13   29   23 o   34.013   5.2774   29.886   7.5778   11.447   12.372   40.957   9.5865   24.299   9.1186   43.727   5.3155 -19.42778 10.55483 
1 1 1   13   29   24 f   27.737   5.7596   18.742   7.7467   6.3327   12.885   25.768   9.6946   21.950   8.9722   33.524   7.2245 -11.57343 11.51929 
1 1 1   13   29   25 o   37.538   5.0709   33.017   7.5004   25.104   11.321   39.208   10.013   32.545   8.3828   42.531   5.7082 -9.986023 10.14173 
1 1 1   13   29   26 o   24.884   5.3656   14.050   6.9052   2.4006   10.706   22.348   9.0358   18.742   7.9571   31.025   7.2001 -12.28298 10.73112 
1 1 1   13   29   27 o   33.846   5.5270   27.558   7.5410   24.419   11.421   29.984   10.041   31.691   8.5434   36.001   7.0145 -4.310175 11.05404 
1 1 1   13   29   28 o   29.038   5.4668   14.674   8.5684  -4.6632   11.283   41.015   13.169   16.431   7.4985   41.645   7.9572 -25.21351 10.93366 
1 1 1   13   29   29 o   78.715   4.5812  142.168   14.414  118.588   21.874  160.268   19.164   71.863   7.3799   85.566   5.4301 -13.70374 9.162361 
1 1 1   13   29   30 o   29.506   4.9986   21.247   7.9208  -2.5520   12.223   38.476   10.400   17.569   7.9327   41.444   6.0842 -23.87524 9.997260 
1 1 1   13   29   31 o   55.027   4.7453   67.747   10.495   62.654   13.244   76.344   17.206   52.795   6.0820   57.259   7.2858 -4.464005 9.490685 
1 1 1   13   29   32 o   21.176   6.3671   3.4000   11.204   14.481   12.024 -69.6275   30.868   24.554   9.0323   17.798   8.9765 6.756083 12.73422 
1 1 1   13   29   33 o   37.582   8.4168   41.617   12.977   39.977   14.300   49.274   30.899   39.031   9.0576   36.133   14.189 2.897694 16.83357 
1 1 1   13   30    0 o   76.841   2.6386  123.256   11.763  123.256   11.763  123.256   11.763   76.841   3.7315   76.841   3.7315 0.000000 0.000000 
1 1 1   13   30    1 o   31.484   4.6152   20.388   7.5677  -5.4459   10.723   46.026   10.682   16.265   7.3790   46.703   5.5455 -30.43780 9.230487 
1 1 1   13   30    2 o   62.015   2.8233   80.279   7.1946   89.629   10.318   71.432   10.037   65.562   3.8159   58.468   4.1620 7.093838 5.646548 
1 1 1   13   30    3 o   53.461   3.0828   59.792   6.7922   63.014   9.6932   56.683   9.5204   54.889   4.2817   52.032   4.4363 2.857101 6.165501 
1 1 1   13   30    4 o   48.674   3.3290   49.929   6.4738   66.969   9.4676   34.966   8.8721   56.619   4.0543   40.730   5.2814 15.88933 6.658066 
1 1 1   13   30    5 o   96.622   2.4327  194.068   9.6854  187.962   13.349  200.854   14.074   95.029   3.4059   98.215   3.4744 -3.186363 4.865337 
1 1 1   13   30    6 o   65.966   2.7709   91.038   7.5219   87.048   10.846   94.735   10.440   64.538   4.0748   67.394   3.7560 -2.856651 5.541803 
1 1 1   13   30    7 o   29.941   4.5763   21.716   5.8067   8.0273   9.0165   31.417   7.5903   21.205   7.8184   38.676   4.7583 -17.47070 9.152520 
1 1 1   13   30    8 o   62.019   3.1422   80.304   7.8041   81.902   12.701   79.334   9.8916   62.397   4.9353   61.641   3.8907 0.7556152 6.284473 
1 1 1   13   30    9 o  101.711   2.9149  218.982   11.924  203.521   18.700  229.574   15.478   98.473   4.6043  104.950   3.5758 -6.477043 5.829735 
1 1 1   13   30   10 o  100.911   2.8806  216.691   11.394  200.306   18.971  225.935   14.249   97.637   4.7111  104.184   3.3161 -6.546692 5.761155 
1 1 1   13   30   11 o   53.561   4.4952   61.411   9.8792   58.766   14.524   63.690   13.477   52.378   6.7229   54.745   5.9690 -2.366390 8.990361 
1 1 1   13   30   12 o   42.019   7.6975   40.352   11.894   39.824   13.489   42.197   25.214   42.194   8.0444   41.845   13.126 0.3497734 15.39499 
1 1 1   13   30   13 o   91.843   3.9135  180.098   14.324  172.186   23.172  184.992   18.224   89.869   6.2514   93.817   4.7096 -3.947670 7.826942 
1 1 1   13   30   14 o   54.054   4.6394   63.649   10.121   49.896   14.484   76.772   14.148   48.002   7.3160   60.106   5.7071 -12.10396 9.278734 
1 1 1   13   30   15 o   60.131   3.0978   75.425   7.6092   80.187   11.731   71.966   9.9978   61.695   4.6102   58.567   4.1389 3.127800 6.195533 
1 1 1   13   30   16 o   41.743   4.0079   37.980   6.5347   34.201   10.845   40.134   8.1881   39.836   6.6006   43.651   4.5481 -3.814613 8.015773 
1 1 1   13   30   17 o   78.773   2.7699  130.546   8.9231  125.754   13.375  134.389   11.978   77.375   4.1912   80.172   3.6225 -2.797264 5.539734 
1 1 1   13   30   18 o   77.343   2.8753  128.249   8.9748  104.039   13.167  149.256   12.265   70.206   4.5473   84.480   3.5201 -14.27391 5.750598 
1 1 1   13   30   19 o   90.435   2.7093  171.477   10.101  176.350   14.548  166.942   14.036   91.668   3.8479   89.202   3.8151 2.465393 5.418599 
1 1 1   13   30   20 o   87.563   2.7521  161.484   9.8870  156.769   14.624  165.454   13.418   86.290   4.1091   88.835   3.6622 -2.545631 5.504244 
1 1 1   13   30   21 o   59.766   3.8588   75.194   9.3420   57.857   12.389   98.049   14.224   51.779   5.8009   67.753   5.0902 -15.97340 7.717546 
1 1 1   13   30   22 o   57.192   3.8829   73.512   8.6005   59.675   13.987   81.924   10.906   52.184   6.4989   62.200   4.2510 -10.01685 7.765747 
1 1 1   13   30   23 o   61.982   3.5394   84.421   8.7446   71.902   13.579   93.291   11.430   57.601   5.7159   66.364   4.1759 -8.763515 7.078803 
1 1 1   13   30   24 o   28.272   5.6816   18.955   6.9146   17.491   10.738   19.992   9.0378   27.286   8.5669   29.258   7.4651 -1.971308 11.36312 
1 1 1   13   30   25 o   68.133   3.3929  100.387   9.2464   97.563   14.873  102.167   11.805   66.982   5.3834   69.284   4.1312 -2.301727 6.785892 
1 1 1   13   30   26 o   28.550   5.3639   20.607   7.0720   8.2990   11.322   28.482   9.0560   21.748   8.5733   35.353   6.4484 -13.60482 10.72771 
1 1 1   13   30   27 o   25.242   5.9551   14.736   7.2054   16.487   11.093   13.458   9.4767   26.326   8.7456   24.158   8.0850 2.168701 11.91021 
1 1 1   13   30   28 o   26.858   5.7835   15.477   7.4616   28.124   11.716   6.8474   9.6781   33.745   8.4399   19.972   7.9096 13.77265 11.56692 
1 1 1   13   30   29 o   18.528   5.7405   0.9476   8.3483  -0.2742   11.277   2.4295   12.419   17.672   7.8230   19.383   8.4031 -1.711445 11.48094 
1 1 1   13   30   30 o   44.466   6.6308   77.314   14.528 -28.7182   39.844   93.573   15.603   24.323   11.899   64.610   5.8551 -40.28616 13.26168 
1 1 1   13   30   31 f   48.750   5.6961   57.258   11.098   48.098   14.672   69.503   16.965   43.708   8.4447   53.792   7.6466 -10.08419 11.39223 
1 1 1   13   30   32 o   36.432   7.8632   37.634   12.095   45.170   22.696   34.645   14.294   37.147   12.512   35.716   9.5277 1.430820 15.72638 
1 1 1   13   31    0 o   31.720   5.1152   24.061   8.2470   24.061   8.2470   24.061   8.2470   31.720   7.2340   31.720   7.2340 0.000000 0.000000 
1 1 1   13   31    1 o   89.078   2.7426  167.285   9.8159  158.349   15.525  173.237   12.670   86.939   4.3296   91.217   3.3677 -4.277489 5.485132 
1 1 1   13   31    2 o  134.052   2.6617  369.680   13.960  358.546   17.096  391.964   24.185  131.303   3.1569  136.801   4.2864 -5.498932 5.323459 
1 1 1   13   31    3 o   56.273   3.0200   66.531   6.9603   57.219   9.7850   76.068   9.9028   52.217   4.5434   60.328   3.9799 -8.110886 6.040025 
1 1 1   13   31    4 o  116.730   2.2723  282.996   10.930  271.297   15.086  295.923   15.858  114.198   3.2029  119.261   3.2239 -5.063522 4.544510 
1 1 1   13   31    5 o  123.763   2.3412  316.606   11.886  298.702   15.843  339.652   17.975  119.825   3.2058  127.701   3.4128 -7.875710 4.682312 
1 1 1   13   31    6 o   75.822   2.5961  120.034   8.1106  116.309   11.606  123.589   11.339   74.648   3.7696   76.996   3.5706 -2.348335 5.192236 
1 1 1   13   31    7 o  108.007   2.7154  246.811   11.664  230.673   18.864  256.798   14.840  104.917   4.3594  111.096   3.2388 -6.178650 5.430822 
1 1 1   13   31    8 o   63.074   3.3017   83.439   8.2130   84.018   13.811   83.123   10.215   63.074   5.3091   63.074   3.9268 0.3051758E-03 6.603466 
1 1 1   13   31    9 o   68.700   3.3106  102.271   8.7535   89.994   14.882  108.765   10.824   65.192   5.5346   72.207   3.6345 -7.015511 6.621288 
1 1 1   13   31   10 o   95.216   2.9377  191.373   11.331  148.767   15.842  236.001   16.213   84.126   4.5657  106.305   3.6979 -22.17898 5.875408 
1 1 1   13   31   11 o   90.331   3.0992  172.962   11.362  181.061   15.021  162.128   17.372   92.995   3.9163   87.667   4.8045 5.328323 6.198428 
1 1 1   13   31   12 o   46.617   7.1871   39.701   10.759   33.176   11.752   73.500   26.749   38.366   7.6943   54.868   12.141 -16.50156 14.37411 
1 1 1   13   31   13 o   39.418   6.1723   34.774   9.6355   41.498   15.300   30.354   12.405   42.437   9.0191   36.399   8.4289 6.038811 12.34467 
1 1 1   13   31   14 o   36.655   4.9564   33.233   6.4268   21.983   11.972   37.787   7.6174   30.928   8.9037   42.382   4.3577 -11.45436 9.912850 
1 1 1   13   31   15 o   57.529   3.5767   65.793   7.8483   82.132   14.733   59.320   9.2736   61.959   5.7654   53.100   4.2344 8.859524 7.153306 
1 1 1   13   31   16 o   32.335   6.3997   24.731   8.8937   21.174   13.861   27.219   11.595   30.334   9.7577   34.335   8.2833 -4.000685 12.79939 
1 1 1   13   31   17 o  129.059   2.9943  347.703   15.845  322.184   21.063  380.973   24.050  123.723   4.1276  134.395   4.3388 -10.67274 5.988546 
1 1 1   13   31   18 o   72.946   3.5147  113.360   10.314  113.835   13.236  112.625   16.457   73.396   4.3725   72.496   5.5040 0.9000092 7.029384 
1 1 1   13   31   19 o  114.860   2.5936  276.521   12.265  255.279   16.902  300.152   17.827  110.182   3.7192  119.538   3.6159 -9.355232 5.187204 
1 1 1   13   31   20 o   46.782   3.9391   48.919   7.2349   40.254   11.484   54.621   9.3160   42.846   6.4986   50.717   4.4536 -7.870903 7.878227 
1 1 1   13   31   21 o   40.761   4.1820   34.906   6.8932   42.823   11.176   30.046   8.7573   44.288   6.1184   37.233   5.7027 7.055584 8.363937 
1 1 1   13   31   22 o   36.757   5.2723   34.365   7.2739   21.999   12.736   40.351   8.8612   30.166   9.3072   43.347   4.9564 -13.18040 10.54467 
1 1 1   13   31   23 o   18.060   5.2209   3.7649   6.3195  -2.2975   10.661   7.0491   7.8468   16.767   7.5027   19.353   7.2622 -2.586208 10.44176 
1 1 1   13   31   24 o   43.241   4.7206   43.778   7.6410   37.077   12.659   47.620   9.5839   39.511   8.0413   46.970   4.9472 -7.458698 9.441225 
1 1 1   13   31   25 o   29.980   5.6302   20.974   6.9112   24.582   11.318   18.829   8.7270   31.753   8.4817   28.208   7.4066 3.545803 11.26039 
1 1 1   13   31   26 o   33.856   6.1308   27.970   9.1138   15.930   12.450   41.870   13.378   25.966   9.2389   41.746   8.0615 -15.78020 12.26154 
1 1 1   13   31   27 o   20.222   6.0381   4.0576   8.7380  -0.1714   11.958   8.9033   12.800   18.172   8.0495   22.273   9.0022 -4.101004 12.07620 
1 1 1   13   31   28 o   30.248   8.0900   22.175   11.466   20.839   12.510   29.194   28.675   28.543   9.2781   31.954   13.256 -3.410738 16.17998 
1 1 1   13   31   29 o   33.140   8.2057   16.159   11.693   70.298   28.620   5.3120   12.810   45.817   13.918   20.464   8.6964 25.35356 16.41144 
1 1 1   13   31   30 o   19.639   6.5646  -4.9880   11.405  -7.0973   25.554  -4.4633   12.745   22.282   10.535   16.997   7.8350 5.284945 13.12912 
1 1 1   13   31   31 o   24.390   7.4252   11.545   11.863   8.5010   27.231   12.258   13.180   25.468   11.633   23.313   9.2310 2.154957 14.85032 
1 1 1   13   32    0 o   77.841   2.5031  126.437   11.312  126.437   11.312  126.437   11.312   77.841   3.5400   77.841   3.5400 0.000000 0.000000 
1 1 1   13   32    1 o   86.412   2.7925  157.229   9.6847  151.480   15.441  160.958   12.435   84.951   4.4070   87.872   3.4310 -2.921341 5.585050 
1 1 1   13   32    2 o   52.546   3.4417   58.020   7.3556   57.152   9.6064   59.250   11.436   52.162   4.4652   52.930   5.2386 -0.7674789 6.883321 
1 1 1   13   32    3 o   45.527   3.4243   44.102   6.3625   37.971   9.1700   49.795   8.8353   42.360   5.2486   48.694   4.3993 -6.333748 6.848503 
1 1 1   13   32    4 o   55.647   2.9682   64.863   6.8009   66.386   9.9577   63.532   9.3106   56.237   4.2931   55.057   4.1001 1.179367 5.936486 
1 1 1   13   32    5 o   40.704   3.6574   35.034   6.1319   35.881   8.9441   34.283   8.4229   41.147   5.2702   40.260   5.0725 0.8866425 7.314729 
1 1 1   13   32    6 o   28.868   5.2508   17.498   5.9946   23.485   10.596   14.680   7.2698   32.108   8.0239   25.627   6.7749 6.481041 10.50160 
1 1 1   13   32    7 o   15.307   4.5983   0.2784   5.2033  -7.0862   9.1994   3.7427   6.3095   14.193   6.5827   16.421   6.4223 -2.227178 9.196573 
1 1 1   13   32    8 f   20.318   5.3116   7.0140   5.5089   9.2149   10.050   6.0687   6.5866   22.325   8.2499   18.311   6.6927 4.014086 10.62324 
1 1 1   13   32    9 o   30.094   4.8441   19.185   5.7224   25.363   9.5959   15.775   7.1286   33.622   7.1404   26.567   6.5478 7.055225 9.688117 
1 1 1   13   32   10 o   61.124   3.5461   78.628   8.7270   76.952   11.142   81.289   14.036   60.450   4.4691   61.799   5.5070 -1.349056 7.092197 
1 1 1   13   32   11 o   51.229   3.9600   56.364   8.0168   57.360   10.062   54.633   13.265   52.111   4.6816   50.346   6.3881 1.764988 7.919937 
1 1 1   13   32   12 o   56.598   6.4734   69.288   11.082   67.155   12.160   79.744   26.923   56.175   5.2483   57.020   11.835 -0.8449593 12.94681 
1 1 1   13   32   13 o   51.140   4.1709   56.250   8.7395   56.913   11.757   55.430   13.065   51.603   5.5241   50.677   6.2507 0.9257584 8.341896 
1 1 1   13   32   14 o   51.145   4.0063   55.910   8.1313   55.536   10.196   56.563   13.477   51.173   4.8309   51.117   6.3924 0.5588913E-01 8.012511 
1 1 1   13   32   15 o   50.571   4.8836   63.507   8.4760   76.050   10.454   39.440   14.481   60.044   4.2213   41.098   8.8079 18.94601 9.767216 
1 1 1   13   32   16 o   64.891   3.3263   95.732   8.2398   67.272   13.061  114.545   10.620   55.877   5.6675   73.905   3.4839 -18.02807 6.652672 
1 1 1   13   32   17 o   62.351   3.7488   87.773   8.5808   73.170   15.497   94.230   10.305   57.791   6.5016   66.912   3.7339 -9.121532 7.497567 
1 1 1   13   32   18 o   29.199   5.8068   14.882   6.2252   32.111   14.127   10.730   6.9348   36.424   9.3546   21.973   6.8824 14.45060 11.61362 
1 1 1   13   32   19 o   39.903   4.6837   38.773   6.8417   25.751   11.149   46.638   8.6650   32.997   8.2221   46.808   4.4883 -13.81065 9.367345 
1 1 1   13   32   20 o   20.539   6.8242  -6.1832   9.3820  -7.5059   10.037   2.9694   26.402   14.605   6.8078   26.473   11.829 -11.86854 13.64834 
1 1 1   13   32   21 o   26.104   5.3945   13.549   6.0631   24.896   10.803   8.3302   7.3258   32.201   8.1320   20.007   7.0904 12.19384 10.78901 
1 1 1   13   32   22 o   18.044   5.5604   0.0908   7.7848  -2.5944   10.564   3.2819   11.516   16.568   7.4371   19.521   8.2681 -2.952778 11.12080 
1 1 1   13   32   23 o   48.829   4.9717   53.928   9.9978   53.053   13.732   54.915   14.585   48.511   6.8633   49.148   7.1949 -0.6368828 9.943397 
1 1 1   13   32   24 o   32.502   6.2643   26.124   8.6280   30.002   12.803   22.897   11.678   34.666   8.9069   30.339   8.8110 4.327244 12.52862 
1 1 1   13   32   25 o   27.199   6.5072   17.834   9.0307   25.030   12.917   10.953   12.631   31.206   9.3213   23.192   9.0822 8.014631 13.01436 
1 1 1   13   32   26 o   28.206   7.9098   15.537   11.423   32.448   25.479   11.283   12.779   33.086   12.915   23.325   9.1352 9.761124 15.81954 
1 1 1   13   32   27 f   20.055   6.5678  -2.2046   10.903  -5.7759   23.728  -1.2486   12.276   22.265   10.408   17.846   8.0134 4.419300 13.13562 
1 1 1   13   32   28 o   35.871   9.7012   45.228   19.861   41.301   26.224   50.510   30.413   34.833   13.230   36.909   14.192 -2.076111 19.40232 
1 1 1   13   32   29 o   20.791   8.7575   6.7266   12.806   0.0000   0.0000   6.7266   12.806  ?   ?    20.791   8.7575      ?      ? 
1 1 1   13   33    0 f   11.282   5.0260   1.4375   6.9872   1.4375   6.9872   1.4375   6.9872   11.282   7.1078   11.282   7.1078 0.000000 0.000000 
1 1 1   13   33    1 o   73.144   2.9776  112.635   8.6764  111.492   14.194  113.317   10.963   72.668   4.7359   73.620   3.6105 -0.9519348 5.955194 
1 1 1   13   33    2 o  114.847   2.5149  276.309   11.660  278.851   15.068  272.515   18.409  115.669   3.1585  114.026   3.9144 1.643417 5.029802 
1 1 1   13   33    3 o   29.557   4.5870   19.780   5.6124   12.743   8.1555   26.111   7.7355   24.068   7.4514   35.047   5.3515 -10.97886 9.173985 
1 1 1   13   33    4 o   56.243   2.9444   66.799   6.7942   61.337   9.8301   71.795   9.4012   53.965   4.4165   58.520   3.8950 -4.555187 5.888721 
1 1 1   13   33    5 o   52.465   3.6093   60.963   7.3596   49.297   11.901   68.187   9.3652   47.932   6.0199   56.999   3.9837 -9.067165 7.218663 
1 1 1   13   33    6 o   33.322   4.5936   23.938   5.9500   28.486   9.7421   21.232   7.5144   35.695   6.8665   30.949   6.1036 4.745996 9.187145 
1 1 1   13   33    7 o   40.938   3.9169   36.541   6.3287   32.926   10.271   38.754   8.0354   39.041   6.3784   42.836   4.5482 -3.795238 7.833874 
1 1 1   13   33    8 o   42.723   3.6666   39.588   6.3147   34.104   9.5504   43.847   8.4173   39.876   5.8069   45.571   4.4783 -5.695591 7.333186 
1 1 1   13   33    9 o   37.329   4.6189   30.571   6.4619   30.924   11.399   30.404   7.8439   36.830   7.7498   37.828   5.0276 -0.9979973 9.237773 
1 1 1   13   33   10 o   29.016   5.8810   19.568   7.5315   23.202   10.166   15.147   11.213   31.787   7.8102   26.245   8.7945 5.542484 11.76192 
1 1 1   13   33   11 o   71.061   3.1636  105.679   8.8075  103.294   10.827  110.346   15.145   70.152   3.7418   71.969   5.1022 -1.816696 6.327183 
1 1 1   13   33   12 o   69.183   5.1305   89.608   10.921   82.315   11.803  132.988   28.788   62.293   4.5941   76.074   9.1752 -13.78131 10.26109 
1 1 1   13   33   13 o   32.913   5.4778   23.059   7.3142   15.159   9.1892   36.717   12.083   25.776   7.8979   40.049   7.5926 -14.27295 10.95558 
1 1 1   13   33   14 o   25.689   5.8298   15.247   7.1600   18.344   9.1380   10.322   11.524   28.128   7.6669   23.250   8.7844 4.877699 11.65962 
1 1 1   13   33   15 o   21.812   4.8132   5.5615   7.0146   21.727   9.0469 -18.8078   11.108   30.685   7.2614   12.938   6.3197 17.74664 9.626339 
1 1 1   13   33   16 f   53.784   3.7043   61.114   7.9763   57.707   10.021   67.007   13.177   52.005   4.6719   55.562   5.7498 -3.557137 7.408593 
1 1 1   13   33   17 o   31.688   5.7350   24.338   7.4299   26.272   9.3213   20.969   12.304   33.845   6.9112   29.530   9.1540 4.315025 11.46999 
1 1 1   13   33   18 o   45.243   3.7097   43.585   6.5981   46.973   11.325   41.843   8.1182   46.244   5.9376   44.243   4.4489 2.000854 7.419435 
1 1 1   13   33   19 o   28.491   7.0929   19.654   10.160   16.334   18.031   21.198   12.298   27.564   10.834   29.417   9.1572 -1.853170 14.18571 
1 1 1   13   33   20 o   27.164   7.8929   13.362   14.793   21.324   18.023  -3.0765   25.897   29.678   11.032   24.651   11.291 5.027037 15.78573 
1 1 1   13   33   21 o   49.185   5.7937   59.692   10.864   43.527   16.546   71.940   14.403   41.428   9.8314   56.941   6.1327 -15.51283 11.58734 
1 1 1   13   33   22 o   47.041   7.6585   59.187   13.042   56.423   26.990   60.029   14.897   42.844   13.598   51.238   7.0491 -8.393841 15.31691 
1 1 1   13   33   23 o   71.869   6.1455  127.181   15.952  119.057   29.818  130.438   18.881   67.379   10.730   76.358   5.9952 -8.979286 12.29110 
1 1 1   13   33   24 o   38.840   8.0508   39.772   12.113   49.082   26.460   37.303   13.624   39.152   13.503   38.528   8.7706 0.6238213 16.10160 
1 1 1   13   33   25 o   32.138   8.2388   22.316   11.820   50.345   26.500   15.355   13.207   39.004   13.510   25.272   9.4336 13.73226 16.47763 
1 1 1   13   33   26 o   34.167   7.5406   36.645   13.020   17.119   25.016   43.901   15.249   27.426   11.908   40.908   9.2542 -13.48234 15.08114 
1 1 1   13   33   27 o   43.262   7.9330   54.867   13.185   55.542   28.337   54.680   14.895   38.968   13.930   47.556   7.5941 -8.588402 15.86591 
1 1 1   13   34    0 o   39.798   3.8954   35.036   8.5482   35.036   8.5482   35.036   8.5482   39.798   5.5090   39.798   5.5090 0.000000 0.000000 
1 1 1   13   34    1 o  102.571   2.6204  221.773   10.833  214.964   17.097  226.340   14.003  101.057   4.1019  104.085   3.2619 -3.028214 5.240769 
1 1 1   13   34    2 o   97.903   2.4420  199.796   9.8402  188.156   13.405  213.399   14.491   94.833   3.4272  100.972   3.4795 -6.139107 4.883914 
1 1 1   13   34    3 o   62.179   3.1557   82.356   7.9446   85.518   10.421   77.967   12.277   63.775   3.9618   60.583   4.9131 3.192307 6.311459 
1 1 1   13   34    4 f   51.238   3.2541   55.734   6.8057   54.514   10.324   56.671   9.0505   50.638   4.9433   51.838   4.2331 -1.199867 6.508101 
1 1 1   13   34    5 o   68.548   2.8804  100.675   7.9901   86.816   11.950  111.880   10.745   64.039   4.5244   73.057   3.5660 -9.017273 5.760801 
1 1 1   13   34    6 o   80.372   2.7157  136.383   8.9641  125.718   12.903  146.331   12.463   77.236   4.0505   83.508   3.6183 -6.272865 5.431332 
1 1 1   13   34    7 o   33.461   4.9298   24.776   6.2388   27.237   11.015   23.614   7.5701   34.272   7.9470   32.650   5.8357 1.621704 9.859519 
1 1 1   13   34    8 o   75.641   2.6755  120.295   8.3227  108.272   11.575  133.165   11.975   71.678   3.9153   79.605   3.6474 -7.926865 5.351039 
1 1 1   13   34    9 o   29.794   5.5435   19.206   6.9754   12.763   8.9039   29.444   11.223   23.964   7.8293   35.625   7.8502 -11.66063 11.08708 
1 1 1   13   34   10 o   86.219   2.9820  146.662   10.177  121.129   12.433  198.502   17.715   75.747   3.9796   96.691   4.4421 -20.94466 5.963990 
1 1 1   13   34   11 o   35.454   4.9450   28.826   6.5883   29.753   7.9885   26.854   11.650   37.218   5.2041   33.690   8.4102 3.528652 9.890095 
1 1 1   13   34   12 o   45.657   6.0748   50.648   10.479   41.954   17.614   55.411   13.037   41.016   10.398   50.298   6.2845 -9.281456 12.14959 
1 1 1   13   34   13 o  105.892   4.2558  261.050   16.221  284.220   19.392  207.062   29.602  115.855   4.0583   95.928   7.4817 19.92651 8.511546 
1 1 1   13   34   14 o   31.145   6.3079   23.368   8.5288   26.212   12.462   20.862   11.698   32.840   8.9539   29.450   8.8872 3.390015 12.61570 
1 1 1   13   34   15 o   55.049   6.9796  105.133   13.323  130.033   15.255   25.080   27.352   77.787   4.7548   32.312   13.124 45.47494 13.95921 
1 1 1   13   34   16 o   55.975   4.5573   70.031   10.199   50.384   14.074   91.755   14.799   47.120   7.2419   64.830   5.5346 -17.70959 9.114665 
1 1 1   13   34   17 o   41.941   5.9097   42.020   9.9700   45.422   13.550   38.006   14.722   44.677   7.3536   39.204   9.2534 5.472954 11.81949 
1 1 1   13   34   18 o   18.019   5.6864  -3.7153   8.7471   4.3296   13.114 -10.1627   11.740   20.820   8.8210   15.218   7.1784 5.602517 11.37275 
1 1 1   13   34   19 o   37.903   7.7928   37.781   11.838   39.686   24.462   37.199   13.528   36.852   12.968   38.953   8.6459 -2.101372 15.58561 
1 1 1   13   34   20 o   25.863   8.1639   5.4655   17.757  -1.8617   24.102   14.164   26.261   23.680   10.864   28.047   12.189 -4.366747 16.32776 
1 1 1   13   34   21 o   17.250   7.7653  -2.1454   11.610   0.0000   0.0000  -2.1454   11.610  ?   ?    17.250   7.7653      ?      ? 
1 1 1   13   34   22 o   29.669   6.8798   24.934   11.572  -6.1195   24.311   34.032   13.158   22.653   10.571   36.686   8.8077 -14.03316 13.75967 
1 1 1   13   34   23 o   24.164   7.3138   8.6342   10.771   17.090   24.092   6.5217   12.042   27.667   11.846   20.660   8.5818 7.006472 14.62760 
1 1 1   13   34   24 o   31.382   7.8486   17.396   11.458   57.069   24.786   6.6146   12.921   41.844   12.996   20.920   8.8037 20.92347 15.69730 
1 1 1   13   34   25 o   26.217   7.7853   10.540   11.706   35.178   26.120   4.3473   13.095   32.423   12.946   20.011   8.6520 12.41265 15.57061 
1 1 1   13   35    0 o   42.143   3.6586   38.934   8.6302   38.934   8.6302   38.934   8.6302   42.143   5.1740   42.143   5.1740 0.000000 0.000000 
1 1 1   13   35    1 o   17.533   5.1171   3.1751   5.7441   2.2421   10.045   3.6284   7.0018   18.326   7.7398   16.740   6.6959 1.586559 10.23422 
1 1 1   13   35    2 o   48.518   3.2605   50.737   6.4345   43.301   9.3733   57.363   8.8488   44.961   5.0547   52.076   4.1198 -7.114929 6.520950 
1 1 1   13   35    3 o   23.220   5.4230   11.813   6.0892   14.020   8.6225   9.6179   8.6003   24.817   7.6582   21.622   7.6803 3.195246 10.84600 
1 1 1   13   35    4 o   45.790   3.4385   43.958   6.4229   50.815   10.031   39.192   8.3621   48.716   4.9922   42.864   4.7299 5.851795 6.877096 
1 1 1   13   35    5 o   29.913   5.3677   18.052   6.2396   29.708   11.695   13.414   7.3774   35.567   8.1471   24.259   6.9910 11.30816 10.73538 
1 1 1   13   35    6 o   48.394   3.2466   49.895   6.4799   49.883   9.2122   49.907   9.1164   48.380   4.6167   48.409   4.5660 -0.2881241E-01 6.493243 
1 1 1   13   35    7 o   56.608   2.8479   67.796   6.6482   67.371   9.4663   68.209   9.3390   56.418   4.0681   56.797   3.9867 -0.3785439 5.695890 
1 1 1   13   35    8 o   36.027   5.1695   31.192   6.7932   33.426   8.0512   25.671   12.656   39.480   4.9445   32.574   9.0800 6.905857 10.33899 
1 1 1   13   35    9 o   41.440   5.3479   40.424   8.7137   27.129   12.404   53.375   12.243   33.496   8.8471   49.384   6.0110 -15.88845 10.69590 
1 1 1   13   35   10 o   51.713   4.2863   58.778   9.1080   65.075   13.006   52.719   12.759   54.577   5.7780   48.848   6.3327 5.728874 8.572536 
1 1 1   13   35   11 o   59.225   4.2190   77.272   10.150   61.539   14.080   94.292   14.645   52.596   6.4907   65.854   5.3918 -13.25818 8.438038 
1 1 1   13   35   12 o   38.712   6.5976   33.446   10.130   53.134   17.703   23.860   12.352   46.308   9.5848   31.117   9.0690 15.19044 13.19522 
1 1 1   13   35   13 o   26.610   6.3602   16.154   8.5237   22.260   12.340   10.584   11.787   30.096   9.1385   23.123   8.8487 6.973257 12.72047 
1 1 1   13   35   14 o   27.496   7.0590   17.983   10.504   9.1132   19.064   21.849   12.587   25.204   10.655   29.788   9.2627 -4.583117 14.11806 
1 1 1   13   35   15 o   17.541   5.6215  -5.8074   9.3930 -38.3350   19.509   4.0082   10.717   15.791   7.8369   19.292   8.0615 -3.500406 11.24306 
1 1 1   13   35   16 f   59.383   6.3044   86.525   13.026   81.383   24.651   88.517   15.343   55.517   11.153   63.250   5.8816 -7.732681 12.60873 
1 1 1   13   35   17 o   60.051   5.7970   83.802   13.356   90.780   23.835   80.608   16.125   60.404   9.5672   59.699   6.5489 0.7047997 11.59392 
1 1 1   13   35   18 o   22.839   6.9537   6.3496   10.310   9.3922   21.563   5.4478   11.739   25.424   11.047   20.254   8.4483 5.170023 13.90747 
1 1 1   13   35   19 o   41.368   7.0422   50.735   11.807   30.128   23.408   57.767   13.674   32.378   12.451   50.357   6.5837 -17.97902 14.08436 
1 1 1   13   35   20 o   30.488   9.4209   24.304   13.044   0.0000   0.0000   24.304   13.044  ?   ?    30.488   9.4209      ?      ? 
1 1 1   13   35   21 o   30.084   7.5289   25.518   11.456   18.764   23.569   27.608   13.109   27.899   11.823   32.270   9.3248 -4.371733 15.05778 
1 1 1   13   35   22 o   20.367   6.6536  -3.1464   10.704   8.6492   22.699  -6.5195   12.138   24.690   11.005   16.045   7.4815 8.645712 13.30721 
1 1 1   13   35   23 o   30.345   7.4393   27.491   11.581   16.429   24.365   30.719   13.163   26.833   11.700   33.856   9.1907 -7.023365 14.87850 
1 1 1   13   36    0 o   50.514   3.2072   54.833   9.2746   54.833   9.2746   54.833   9.2746   50.514   4.5357   50.514   4.5357 0.000000 0.000000 
1 1 1   13   36    1 o   55.760   2.9830   66.447   6.8048   56.683   9.5739   76.416   9.6738   51.479   4.5091   60.041   3.9064 -8.561707 5.965950 
1 1 1   13   36    2 o   69.297   3.3495  103.732   8.8682  101.348   15.703  104.849   10.746   68.172   5.5848   70.422   3.6998 -2.249504 6.699093 
1 1 1   13   36    3 o   67.027   3.0624   96.578   8.2685   99.481   10.716   92.306   12.998   68.545   3.7905   65.509   4.8109 3.036758 6.124745 
1 1 1   13   36    4 o   43.757   4.1064   40.913   6.9637   45.224   12.358   38.907   8.4295   44.992   6.6595   42.523   4.8064 2.469173 8.212809 
1 1 1   13   36    5 o   31.128   4.4076   21.352   5.5367   27.516   8.4293   16.675   7.3428   35.426   5.7691   26.830   6.6653 8.595482 8.815213 
1 1 1   13   36    6 o   37.681   4.7206   28.211   6.6674   43.579   12.841   22.538   7.8016   43.907   7.0907   31.456   6.2337 12.45083 9.441206 
1 1 1   13   36    7 o   15.876   4.7475   1.5368   5.3855 -10.3879   11.310   5.0337   6.1245   14.837   7.0132   16.914   6.4008 -2.077021 9.495059 
1 1 1   13   36    8 o   32.994   6.1991   26.896   9.0167   16.760   12.913   36.541   12.596   26.781   9.4217   39.207   8.0590 -12.42544 12.39828 
1 1 1   13   36    9 o   24.737   6.1972   13.622   7.9901   10.702   11.264   16.581   11.336   22.986   8.6849   26.488   8.8427 -3.501640 12.39439 
1 1 1   13   36   10 o   35.804   6.9208   30.706   10.003   38.878   17.650   26.840   12.140   38.538   10.716   33.070   8.7611 5.467777 13.84152 
1 1 1   13   36   11 o   28.955   6.7009   21.730   9.9504   7.1854   18.368   27.771   11.838   24.198   10.351   33.712   8.5121 -9.514791 13.40174 
1 1 1   13   36   12 o   40.892   6.9403   40.222   10.671   49.273   20.208   36.723   12.566   42.677   11.302   39.108   8.0588 3.569214 13.88068 
1 1 1   13   36   13 o   34.996   6.5485   34.337   10.693   14.330   19.345   43.139   12.831   26.650   10.955   43.342   7.1778 -16.69244 13.09709 
1 1 1   13   36   14 o   28.780   7.3873   18.097   10.653   31.846   19.431   12.187   12.739   33.697   11.574   23.864   9.1829 9.832851 14.77466 
1 1 1   13   36   15 f   48.306   6.5917   55.778   11.704   66.172   22.081   51.717   13.802   49.276   11.128   47.337   7.0694 1.938656 13.18347 
1 1 1   13   36   16 o   27.552   7.1260   19.480   10.759   8.9311   20.797   23.336   12.572   24.979   10.852   30.125   9.2392 -5.146246 14.25208 
1 1 1   13   36   17 o   27.183   7.1604   18.955   11.202   5.0242   21.914   23.883   13.034   24.124   10.778   30.241   9.4294 -6.117245 14.32089 
1 1 1   13   36   18 o   29.710   7.5594   24.324   11.363   19.454   23.663   25.784   12.954   28.193   11.892   31.227   9.3363 -3.034046 15.11882 
1 1 1   13   36   19 o   28.591   8.5743   19.499   17.485   9.5669   22.884   33.433   27.105   25.045   11.113   32.138   13.061 -7.092228 17.14862 
1 1 1   13   36   20 o   38.552   8.8919   38.784   13.850   0.0000   0.0000   38.784   13.850  ?   ?    38.552   8.8919      ?      ? 
1 1 1   13   36   21 o   25.788   7.5200   14.922   11.399   19.792   24.276   13.544   12.911   27.697   11.875   23.880   9.2291 3.816727 15.04001 
1 1 1   13   37    0 o   40.319   5.6139   38.830   11.745   38.830   11.745   38.830   11.745   40.319   7.9393   40.319   7.9393 0.000000 0.000000 
1 1 1   13   37    1 o   50.649   4.1362   56.200   8.5891   59.211   12.990   53.862   11.449   51.712   6.0906   49.586   5.5980 2.126595 8.272442 
1 1 1   13   37    2 o   26.631   6.1268   19.194   7.6918 -24.7100   27.892   22.808   8.0021   21.721   10.467   31.540   6.3707 -9.819227 12.25354 
1 1 1   13   37    3 o   23.059   5.1806   4.2674   6.0404   27.089   11.761  -3.9091   7.0398   33.279   8.5293   12.838   5.8828 20.44128 10.36127 
1 1 1   13   37    4 o   44.719   7.0411   54.579   12.600   63.911   15.601   37.075   21.366   52.987   7.1386   36.451   12.139 16.53629 14.08229 
1 1 1   13   37    5 o   64.214   4.3379   91.903   11.087   90.471   18.057   92.769   14.046   63.171   6.9306   65.257   5.2188 -2.086689 8.675778 
1 1 1   13   37    6 o   24.728   6.6090   12.361   9.2082   18.690   14.368   7.9505   11.995   27.743   9.9194   21.713   8.7361 6.029242 13.21797 
1 1 1   13   37    7 o   56.107   4.9802   70.745   10.992   75.907   18.743   68.039   13.572   56.858   7.9924   55.357   5.9442 1.500751 9.960495 
1 1 1   13   37    8 o   50.042   5.9895   64.172   10.831   49.185   18.603   71.855   13.321   43.070   10.555   57.015   5.6647 -13.94511 11.97892 
1 1 1   13   37    9 o   57.493   5.2930   78.432   11.589   71.840   19.987   81.772   14.225   54.236   8.9350   60.751   5.6772 -6.514648 10.58605 
1 1 1   13   37   10 o   35.823   6.4438   34.976   9.9295   22.493   17.417   40.986   12.086   29.402   10.861   42.244   6.9366 -12.84139 12.88755 
1 1 1   13   37   11 o  100.104   4.5908  217.067   18.954   0.0000   0.0000  217.067   18.954  ?   ?   100.104   4.5908      ?      ? 
1 1 1   13   37   12 o   41.729   6.8232   43.768   10.952   49.670   19.277   40.955   13.309   42.546   10.928   40.911   8.1731 1.634716 13.64638 
1 1 1   13   37   13 o   33.539   6.7432   32.667   10.693   14.667   19.568   40.329   12.767   26.346   10.941   40.732   7.8848 -14.38614 13.48645 
1 1 1   13   37   14 f   31.060   7.4452   26.519   11.145   25.415   19.384   27.064   13.622   30.209   11.398   31.912   9.5817 -1.702290 14.89047 
1 1 1   13   37   15 o   52.851   6.2956   67.915   12.130   77.111   22.616   64.201   14.373   52.992   10.716   52.710   6.6112 0.2816696 12.59121 
1 1 1   13   37   16 o   22.770   6.8714   5.7292   10.243   19.204   19.730   0.7568   11.985   27.339   11.130   18.202   8.0610 9.136921 13.74286 
1 1 1   13   37   17 o   23.429   6.8938   11.164   10.741   2.5929   21.216   14.117   12.455   22.705   10.331   24.154   9.1310 -1.449129 13.78758 
1 1 1   13   37   18 o   22.763   6.9738   8.2515   10.605   7.9416   22.886   8.3363   11.967   24.378   10.944   21.148   8.6459 3.230471 13.94752 
1 1 1   13   38    3 f   40.730   8.4338   38.680   12.887   30.348   14.455   70.944   28.445   33.960   9.7856   47.500   13.739 -13.53952 16.86752 
1 1 1   13   38    4 o   26.095   7.7766   13.346   12.584   14.902   13.881   6.1650   29.812   25.392   9.6298   26.798   12.213 -1.405769 15.55317 
1 1 1   13   38    5 o   44.778   8.6160   58.947   15.019   59.154   16.942   58.185   32.463   48.871   8.7251   40.684   14.860 8.187386 17.23210 
1 1 1   13   38    6 f   28.857   8.1419   20.331   12.882   21.157   14.126   16.253   31.399   28.632   9.8668   29.081   12.954 -0.4487438 16.28378 
1 1 1   13   38    7 o   24.872   8.0023   1.2436   13.612  -3.7146   14.995   24.460   32.448   18.848   8.6181   30.895   13.486 -12.04679 16.00467 
1 1 1   13   38    8 o   28.001   8.4690   13.891   13.879   9.8723   15.316   32.345   32.821   23.405   9.6965   32.598   13.888 -9.192768 16.93809 
1 1 1   13   38    9 o   24.971   7.7622   9.6552   14.647   14.339   16.416  -8.6213   32.430   25.374   10.216   24.568   11.689 0.8056564 15.52450 
1 1 1   13   38   10 o   44.446   8.8443   67.440   17.534   72.897   19.979   49.156   36.574   53.028   9.4832   35.865   14.932 17.16262 17.68870 
1 1 1   13   38   11 o   24.122   10.949   4.5243   23.650   0.0000   0.0000   4.5243   23.650  ?   ?    24.122   10.949      ?      ? 
1 1 1   13   38   12 o   18.731   5.9940  -0.9733   9.8206  -9.3643   17.295   3.0193   11.930   18.466   8.7114   18.995   8.2356 -0.5291004 11.98804 
1 1 1   13   38   13 o   19.617   6.1946   1.8012   9.7039  -1.6018   17.693   3.2653   11.605   20.362   9.3289   18.872   8.1524 1.489653 12.38910 
1 1 1   13   38   14 o   40.391   7.3208   47.636   12.154   40.758   20.957   51.123   14.919   35.838   12.023   44.944   8.3561 -9.105701 14.64153 
1 1 1   13   38   15 o   49.301   6.8289   69.374   12.172   52.812   22.166   76.525   14.565   40.869   12.212   57.734   6.1166 -16.86481 13.65784 
1 1 1   14    0    0 o  375.451   4.1885  2909.94   91.675  2909.94   91.675  2909.94   91.675  375.451   5.9235  375.451   5.9235 0.000000 0.000000 
1 1 1   14    0    1 o  314.507   2.6443  2041.16   48.493  2041.16   48.493  2041.16   48.493  314.507   3.7396  314.507   3.7396 0.000000 0.000000 
1 1 1   14    0    2 o  863.607   5.9068 15401.54  297.482 15401.54  297.482 15401.54  297.482  863.607   8.3535  863.607   8.3535 0.000000 0.000000 
1 1 1   14    0    3 o  147.018   2.0336  446.306   17.424  446.306   17.424  446.306   17.424  147.018   2.8760  147.018   2.8760 0.000000 0.000000 
1 1 1   14    0    4 o  623.988   4.4113  8036.83  160.519  8036.83  160.519  8036.83  160.519  623.988   6.2385  623.988   6.2385 0.000000 0.000000 
1 1 1   14    0    5 o   99.516   2.0829  204.797   12.067  204.797   12.067  204.797   12.067   99.516   2.9457   99.516   2.9457 0.000000 0.000000 
1 1 1   14    0    6 o  272.657   2.4551  1534.13   39.031  1534.13   39.031  1534.13   39.031  272.657   3.4721  272.657   3.4721 0.000000 0.000000 
1 1 1   14    0    7 o  413.188   3.1723  3523.14   76.435  3523.14   76.435  3523.14   76.435  413.188   4.4864  413.188   4.4864 0.000000 0.000000 
1 1 1   14    0    8 o   50.823   2.9486   54.351   8.6055   54.351   8.6055   54.351   8.6055   50.823   4.1699   50.823   4.1699 0.000000 0.000000 
1 1 1   14    0    9 o  377.588   3.4501  2943.00   75.957  2943.00   75.957  2943.00   75.957  377.588   4.8792  377.588   4.8792 0.000000 0.000000 
1 1 1   14    0   10 o  199.719   3.1064  824.107   36.148  824.107   36.148  824.107   36.148  199.719   4.3931  199.719   4.3931 0.000000 0.000000 
1 1 1   14    0   11 o  338.683   3.2016  2367.90   63.222  2367.90   63.222  2367.90   63.222  338.683   4.5278  338.683   4.5278 0.000000 0.000000 
1 1 1   14    0   12 o   59.739   2.7284   74.538   9.4162   74.538   9.4162   74.538   9.4162   59.739   3.8586   59.739   3.8586 0.000000 0.000000 
1 1 1   14    0   13 o  317.987   3.1184  2087.55   57.815  2087.55   57.815  2087.55   57.815  317.987   4.4101  317.987   4.4101 0.000000 0.000000 
1 1 1   14    0   14 f  202.845   2.7719  849.869   32.769  849.869   32.769  849.869   32.769  202.845   3.9201  202.845   3.9201 0.000000 0.000000 
1 1 1   14    0   15 f  219.657   2.6808  996.355   34.324  996.355   34.324  996.355   34.324  219.657   3.7912  219.657   3.7912 0.000000 0.000000 
1 1 1   14    0   16 o   28.455   7.3089   22.254   11.152   22.254   11.152   22.254   11.152   28.455   10.336   28.455   10.336 0.000000 0.000000 
1 1 1   14    0   17 o   93.805   2.7613  182.515   15.049  182.515   15.049  182.515   15.049   93.805   3.9050   93.805   3.9050 0.000000 0.000000 
1 1 1   14    0   18 o  193.956   2.3751  776.879   26.851  776.879   26.851  776.879   26.851  193.956   3.3589  193.956   3.3589 0.000000 0.000000 
1 1 1   14    0   19 o  149.043   3.0321  459.690   26.310  459.690   26.310  459.690   26.310  149.043   4.2881  149.043   4.2881 0.000000 0.000000 
1 1 1   14    0   20 o   67.493   3.7703   95.828   14.630   95.828   14.630   95.828   14.630   67.493   5.3320   67.493   5.3320 0.000000 0.000000 
1 1 1   14    0   21 o  108.542   3.3493  244.644   21.113  244.644   21.113  244.644   21.113  108.542   4.7366  108.542   4.7366 0.000000 0.000000 
1 1 1   14    0   22 o   33.399   6.8890   28.263   11.653   28.263   11.653   28.263   11.653   33.399   9.7425   33.399   9.7425 0.000000 0.000000 
1 1 1   14    0   23 o  198.230   3.4801  813.151   40.183  813.151   40.183  813.151   40.183  198.230   4.9216  198.230   4.9216 0.000000 0.000000 
1 1 1   14    0   25 f   14.462   6.3782   2.6330   10.956   2.6330   10.956   2.6330   10.956   14.462   9.0202   14.462   9.0202 0.000000 0.000000 
1 1 1   14    0   26 o   54.737   4.3979   64.327   13.573   64.327   13.573   64.327   13.573   54.737   6.2195   54.737   6.2195 0.000000 0.000000 
1 1 1   14    0   27 o   84.239   3.1854  147.839   15.549  147.839   15.549  147.839   15.549   84.239   4.5049   84.239   4.5049 0.000000 0.000000 
1 1 1   14    0   28 o  105.701   3.9056  232.923   23.930  232.923   23.930  232.923   23.930  105.701   5.5234  105.701   5.5234 0.000000 0.000000 
1 1 1   14    0   29 o   17.499   7.1899   7.7614   12.054   7.7614   12.054   7.7614   12.054   17.499   10.168   17.499   10.168 0.000000 0.000000 
1 1 1   14    0   30 o   58.499   8.6086   80.039   25.901   80.039   25.901   80.039   25.901   58.499   12.174   58.499   12.174 0.000000 0.000000 
1 1 1   14    0   31 o   70.784   5.9974  108.658   23.821  108.658   23.821  108.658   23.821   70.784   8.4815   70.784   8.4815 0.000000 0.000000 
1 1 1   14    0   32 o   47.537   9.0811   56.576   21.763   56.576   21.763   56.576   21.763   47.537   12.843   47.537   12.843 0.000000 0.000000 
1 1 1   14    0   33 o   10.767   5.5468 -45.4181   20.329 -45.4181   20.329 -45.4181   20.329   10.767   7.8443   10.767   7.8443 0.000000 0.000000 
1 1 1   14    0   34 o   24.598   10.783   11.160   30.837   11.160   30.837   11.160   30.837   24.598   15.249   24.598   15.249 0.000000 0.000000 
1 1 1   14    0   35 f  132.726   4.3415  369.601   33.447  369.601   33.447  369.601   33.447  132.726   6.1398  132.726   6.1398 0.000000 0.000000 
1 1 1   14    0   36 o   66.749   7.1245  100.486   25.870  100.486   25.870  100.486   25.870   66.749   10.076   66.749   10.076 0.000000 0.000000 
1 1 1   14    0   37 o  103.917   4.3325  228.332   26.052  228.332   26.052  228.332   26.052  103.917   6.1271  103.917   6.1271 0.000000 0.000000 
1 1 1   14    0   38 o   12.257   6.2284 -34.4716   21.531 -34.4716   21.531 -34.4716   21.531   12.257   8.8083   12.257   8.8083 0.000000 0.000000 
1 1 1   14    0   39 o   61.488   9.4539   92.989   29.715   92.989   29.715   92.989   29.715   61.488   13.370   61.488   13.370 0.000000 0.000000 
1 1 1   14    0   40 o   63.376   8.2489   95.498   27.447   95.498   27.447   95.498   27.447   63.376   11.666   63.376   11.666 0.000000 0.000000 
1 1 1   14    0   41 o   32.898   11.290   37.407   25.359   37.407   25.359   37.407   25.359   32.898   15.967   32.898   15.967 0.000000 0.000000 
1 1 1   14    0   42 o   23.556   9.7918   17.238   22.790   17.238   22.790   17.238   22.790   23.556   13.848   23.556   13.848 0.000000 0.000000 
1 1 1   14    0   43 o   17.922   8.2567   1.8751   20.935   1.8751   20.935   1.8751   20.935   17.922   11.677   17.922   11.677 0.000000 0.000000 
1 1 1   14    0   44 o   29.166   10.427   30.982   22.033   30.982   22.033   30.982   22.033   29.166   14.746   29.166   14.746 0.000000 0.000000 
1 1 1   14    0   45 o   13.249   6.6398 -22.7686   21.405 -22.7686   21.405 -22.7686   21.405   13.249   9.3901   13.249   9.3901 0.000000 0.000000 
1 1 1   14    0   46 o   47.397   11.492   71.124   28.554   71.124   28.554   71.124   28.554   47.397   16.253   47.397   16.253 0.000000 0.000000 
1 1 1   14    0   47 o   16.193   8.1673 -33.4018   34.313 -33.4018   34.313 -33.4018   34.313   16.193   11.550   16.193   11.550 0.000000 0.000000 
1 1 1   14    1    0 o  128.051   2.0254  338.695   15.111  338.695   15.111  338.695   15.111  128.051   2.8644  128.051   2.8644 0.000000 0.000000 
1 1 1   14    1    1 o  124.189   2.0285  318.150   10.390  315.748   14.712  320.540   14.674  123.722   2.8831  124.657   2.8541 -0.9356232 4.056906 
1 1 1   14    1    2 o  179.441   2.0929  663.877   15.486  680.413   22.191  648.180   21.621  181.618   2.9624  177.264   2.9572 4.353867 4.185794 
1 1 1   14    1    3 o  521.984   3.7943  5624.00   81.687  5623.54  115.483  5624.45  115.562  521.963   5.3643  522.006   5.3675 -0.4217529E-01 7.588535 
1 1 1   14    1    4 o  340.211   2.7745  2387.78   38.927  2405.42   55.527  2370.72   54.588  341.446   3.9429  338.975   3.9045 2.470306 5.549033 
1 1 1   14    1    5 o  482.682   3.5660  4808.46   70.991  4804.71  100.287  4812.22  100.506  482.494   5.0395  482.870   5.0465 -0.3760376 7.131908 
1 1 1   14    1    6 o  291.037   2.5363  1747.47   30.445  1747.25   43.053  1747.70   43.057  291.018   3.5869  291.056   3.5867 -0.3793335E-01 5.072543 
1 1 1   14    1    7 o  285.056   2.5096  1676.22   29.503  1689.63   42.042  1663.22   41.412  286.178   3.5619  283.933   3.5363 2.244354 5.019198 
1 1 1   14    1    8 f  302.649   2.5911  1889.12   32.333  1916.81   46.432  1863.06   45.052  304.800   3.6935  300.498   3.6350 4.301392 5.182204 
1 1 1   14    1    9 o  199.166   2.8364  818.244   22.811  819.970   36.168  817.104   29.395  199.328   4.3993  199.004   3.5814 0.3234100 5.672760 
1 1 1   14    1   10 o  395.521   4.3693  3230.57   71.254  3264.97  102.256  3198.10   99.344  397.561   6.2362  393.481   6.1214 4.079987 8.738530 
1 1 1   14    1   11 o  406.023   3.3862  3400.98   56.051  3387.75   73.798  3419.01   86.168  405.124   4.4166  406.922   5.1341 -1.798645 6.772460 
1 1 1   14    1   12 f  379.109   2.9900  2966.55   46.751  2970.99   66.220  2962.13   66.013  379.391   4.2319  378.826   4.2250 0.5653992 5.979918 
1 1 1   14    1   13 o  190.667   2.2879  750.372   17.479  749.135   28.286  751.135   22.231  190.527   3.5996  190.807   2.8249 -0.2803802 4.575724 
1 1 1   14    1   14 o  238.261   2.4275  1171.47   23.853  1176.29   33.966  1166.79   33.506  238.743   3.4494  237.779   3.4165 0.9645081 4.854990 
1 1 1   14    1   15 o  171.852   3.0788  607.270   21.607  627.133   33.193  592.664   28.463  174.267   4.6182  169.436   4.0729 4.831070 6.157629 
1 1 1   14    1   16 o   84.103   2.8345  146.203   9.7926  163.244   13.980  129.788   13.721   88.925   3.8117   79.282   4.1961 9.643135 5.668921 
1 1 1   14    1   17 o  207.324   2.6798  892.288   22.625  920.669   29.989  854.796   34.468  211.192   3.4429  203.455   4.1076 7.736374 5.359621 
1 1 1   14    1   18 o  159.863   2.3942  527.198   15.778  515.881   21.902  539.408   22.750  158.082   3.3592  161.644   3.4123 -3.561920 4.788359 
1 1 1   14    1   19 o  127.851   3.4624  339.492   17.876  345.754   23.160  330.263   28.115  129.351   4.3411  126.350   5.3951 3.001205 6.924776 
1 1 1   14    1   20 o   68.068   3.4581   97.901   9.4968   79.853   14.025  113.183   12.906   62.125   5.4735   74.012   4.2279 -11.88612 6.916199 
1 1 1   14    1   21 o  228.675   2.4998  1079.20   23.566  1058.97   32.717  1101.02   33.974  226.452   3.5029  230.898   3.5674 -4.445847 4.999688 
1 1 1   14    1   22 o  122.264   3.3238  308.927   16.750  324.941   24.011  293.743   23.379  125.353   4.6441  119.175   4.7564 6.177345 6.647668 
1 1 1   14    1   23 o  207.327   3.4950  889.296   29.886  882.983   42.176  895.662   42.354  206.587   4.9499  208.067   4.9354 -1.479889 6.989958 
1 1 1   14    1   24 o   19.650   5.8039   0.0072   8.1976  -6.8886   11.825   6.3883   11.375   17.089   7.7513   22.210   8.6406 -5.120480 11.60784 
1 1 1   14    1   25 o  253.562   3.6873  1331.26   38.560  1349.35   54.814  1313.53   54.255  255.270   5.2063  251.855   5.2230 3.414658 7.374629 
1 1 1   14    1   26 f  190.782   3.1114  753.116   24.468  757.968   34.088  747.960   35.142  191.427   4.3176  190.137   4.4813 1.290100 6.222770 
1 1 1   14    1   27 o   93.541   3.0011  181.012   11.577  183.042   16.303  178.947   16.442   94.073   4.2018   93.009   4.2861 1.063965 6.002190 
1 1 1   14    1   28 o   79.677   3.3424  131.371   10.969  122.124   15.308  141.131   15.726   76.790   4.8333   82.565   4.6181 -5.775124 6.684891 
1 1 1   14    1   29 o  141.024   3.7725  415.446   21.731  386.986   32.391  438.739   29.304  136.535   5.7520  145.513   4.8826 -8.977356 7.544916 
1 1 1   14    1   30 o  178.708   3.5603  660.869   26.143  644.062   35.285  681.325   38.927  176.233   4.8545  181.183   5.2092 -4.950150 7.120513 
1 1 1   14    1   31 o   86.070   5.7213  152.347   15.466  150.617   17.006  160.621   37.186   85.183   4.8405   86.958   10.368 -1.774864 11.44262 
1 1 1   14    1   32 o  189.852   4.6409  764.168   34.868  712.352   56.999  795.152   44.076  184.250   7.5006  195.454   5.4676 -11.20428 9.281855 
1 1 1   14    1   33 o   72.382   7.1219  118.279   19.170  100.302   32.301  128.053   23.818   66.848   12.164   77.915   7.4116 -11.06663 14.24382 
1 1 1   14    1   34 o   93.655   5.5365  190.796   19.948  199.963   24.561  173.027   34.194   97.579   6.1028   89.730   9.2394 7.848770 11.07295 
1 1 1   14    1   35 o   81.848   5.1173  142.523   17.189  141.189   25.528  143.630   23.250   81.369   7.6067   82.327   6.8473 -0.9579086 10.23457 
1 1 1   14    1   36 o   38.492   8.7154   33.343   15.725   28.877   22.050   37.965   22.432   36.376   12.332   40.607   12.319 -4.230995 17.43074 
1 1 1   14    1   37 o   36.757   8.7145   30.577   15.699   25.109   22.120   36.125   22.283   34.290   12.303   39.225   12.345 -4.935463 17.42893 
1 1 1   14    1   38 o   38.728   9.9583   27.388   18.502   53.463   36.895   18.628   21.386   46.108   15.943   31.348   11.937 14.75999 19.91661 
1 1 1   14    1   39 o   26.052   8.0952  -1.0299   16.907   4.5103   23.517  -6.9559   24.322   27.316   11.700   24.788   11.191 2.528147 16.19044 
1 1 1   14    1   40 o   30.646   8.4107   17.391   15.333   22.349   21.696   12.442   21.674   32.512   12.100   28.781   11.686 3.730894 16.82146 
1 1 1   14    1   41 o   33.585   9.6985   20.352   20.003   24.526   36.174   18.514   24.007   35.860   14.883   31.309   12.439 4.551113 19.39690 
1 1 1   14    1   42 o   26.504   8.5282  -2.7642   19.250   2.2851   22.672 -15.8084   36.441   25.553   11.210   27.456   12.855 -1.902514 17.05644 
1 1 1   14    1   43 o   30.729   8.5209   19.315   16.349   29.249   22.304   7.7803   24.034   34.225   12.345   27.233   11.748 6.992853 17.04173 
1 1 1   14    1   44 o   32.748   8.6146   26.634   15.540   33.075   23.252   21.434   20.892   35.148   12.613   30.348   11.737 4.799345 17.22924 
1 1 1   14    1   45 o   28.326   8.4606   11.055   17.192  -1.0320   22.623   27.577   26.450   23.802   10.766   32.850   13.055 -9.047783 16.92117 
1 1 1   14    1   46 o   18.769   6.5677 -43.9157   18.613 -27.5519   27.097 -58.5344   25.612   20.729   10.067   16.809   8.4375 3.919899 13.13544 
1 1 1   14    1   47 o   35.740   11.031   35.253   28.689   86.625   51.375   11.975   34.583   42.738   17.737   28.742   13.121 13.99622 22.06276 
1 1 1   14    2    0 o  421.211   3.2130  3661.23   78.919  3661.23   78.919  3661.23   78.919  421.211   4.5439  421.211   4.5439 0.000000 0.000000 
1 1 1   14    2    1 o  502.898   3.6818  5219.94   76.366  5221.62  108.071  5218.27  107.926  502.979   5.2095  502.818   5.2042 0.1610718 7.363537 
1 1 1   14    2    2 o  400.249   3.0947  3305.63   51.087  3299.00   72.077  3312.32   72.421  399.846   4.3706  400.652   4.3826 -0.8062439 6.189453 
1 1 1   14    2    3 o  130.982   2.0237  353.877   10.932  351.001   15.396  356.801   15.525  130.446   2.8617  131.519   2.8621 -1.073349 4.047311 
1 1 1   14    2    4 o  191.681   2.1329  757.883   16.862  754.125   23.753  761.699   23.940  191.202   3.0120  192.159   3.0207 -0.9576263 4.265785 
1 1 1   14    2    5 o  212.808   2.2088  934.185   19.386  929.033   27.329  939.403   27.505  212.217   3.1223  213.398   3.1250 -1.181000 4.417541 
1 1 1   14    2    6 o  133.096   2.0581  365.412   11.297  365.394   16.090  365.429   15.864  133.092   2.9312  133.099   2.8898 -0.6942749E-02 4.116194 
1 1 1   14    2    7 o  181.928   2.1155  682.651   15.872  676.082   22.246  689.462   22.652  181.037   2.9793  182.819   3.0041 -1.782150 4.230961 
1 1 1   14    2    8 o  107.631   2.1020  238.882   9.3288  246.626   13.329  231.446   13.061  109.341   2.9556  105.922   2.9897 3.418678 4.204045 
1 1 1   14    2    9 o  175.311   2.5992  637.240   17.724  624.783   30.525  643.576   21.770  173.996   4.2535  176.626   2.9883 -2.629776 5.198334 
1 1 1   14    2   10 o  289.457   3.2747  1734.42   38.499  1700.57   59.590  1758.67   50.439  287.002   5.0341  291.913   4.1894 -4.911713 6.549300 
1 1 1   14    2   11 o  212.674   2.4316  928.004   20.981  905.091   27.162  961.899   33.036  209.448   3.1443  215.900   3.7099 -6.452850 4.863121 
1 1 1   14    2   12 o  261.615   2.4198  1411.51   26.100  1439.07   37.546  1385.74   36.306  264.083   3.4471  259.147   3.3968 4.936737 4.839520 
1 1 1   14    2   13 o  315.748   2.7967  2053.69   35.294  2074.33   57.653  2041.32   44.635  316.980   4.4099  314.516   3.4408 2.464996 5.593420 
1 1 1   14    2   14 o  242.956   2.4398  1218.01   24.446  1228.03   34.899  1208.36   34.253  243.936   3.4687  241.977   3.4321 1.959229 4.879670 
1 1 1   14    2   15 o  430.358   3.3206  3824.86   58.940  3819.67   83.174  3830.09   83.535  430.066   4.6891  430.650   4.7030 -0.5841675 6.641247 
1 1 1   14    2   16 o   55.848   3.9374   62.978   8.9552   51.750   11.744   78.579   13.843   50.035   5.6907   61.661   5.4431 -11.62669 7.874705 
1 1 1   14    2   17 o  236.717   2.6396  1150.75   25.486  1117.60   33.417  1196.83   39.401  232.681   3.4821  240.752   3.9680 -8.071014 5.279250 
1 1 1   14    2   18 o  262.049   2.5706  1417.43   27.773  1402.44   38.672  1433.41   39.910  260.621   3.5977  263.476   3.6726 -2.855225 5.141141 
1 1 1   14    2   19 f  249.102   3.3506  1281.97   33.658  1278.87   43.253  1286.73   53.589  248.785   4.2153  249.420   5.2093 -0.6358337 6.701166 
1 1 1   14    2   20 o  162.511   3.2921  548.645   21.622  531.810   33.891  560.200   28.079  160.357   5.1243  164.664   4.1344 -4.306702 6.584189 
1 1 1   14    2   21 o  237.255   2.5005  1162.39   24.467  1167.97   34.847  1156.96   34.360  237.815   3.5527  236.694   3.5196 1.120499 5.000966 
1 1 1   14    2   22 o  186.026   2.4260  714.747   18.613  708.255   26.311  721.250   26.336  185.180   3.4449  186.873   3.4169 -1.693420 4.852098 
1 1 1   14    2   23 o  105.849   3.0902  232.851   13.396  219.630   19.822  243.965   18.174  103.050   4.6637  108.647   4.0556 -5.597366 6.180472 
1 1 1   14    2   24 o  393.259   3.4196  3196.41   54.869  3227.16   84.159  3173.67   72.364  394.806   5.1684  391.713   4.4791 3.093536 6.839145 
1 1 1   14    2   25 o   73.437   3.6914  113.069   10.969  120.080   14.463  103.575   16.830   76.184   4.6027   70.689   5.7724 5.494690 7.382786 
1 1 1   14    2   26 o  194.277   2.6567  777.413   21.202  809.333   31.675  751.503   28.538  197.863   3.8814  190.692   3.6285 7.170715 5.313309 
1 1 1   14    2   27 o  117.019   4.6914  291.617   22.024  327.014   29.193  244.855   33.554  125.588   5.6359  108.449   7.5016 17.13947 9.382824 
1 1 1   14    2   28 o  111.196   3.0050  256.713   13.714  245.509   20.159  266.365   18.711  108.909   4.4878  113.483   3.9976 -4.574852 6.010090 
1 1 1   14    2   29 o  105.485   4.1066  231.042   17.865  227.879   25.241  234.217   25.290  104.757   5.8418  106.212   5.7730 -1.455269 8.213106 
1 1 1   14    2   30 o   55.090   7.3759   65.858   15.992   67.734   20.575   62.993   25.417   56.789   8.7843   53.392   11.851 3.396328 14.75189 
1 1 1   14    2   31 o   28.824   7.4356   15.243   10.962   18.761   12.571   4.0784   22.393   29.829   9.2536   27.819   11.641 2.010374 14.87119 
1 1 1   14    2   32 o   98.397   3.8376  199.478   14.847  194.892   18.308  208.285   25.373   96.893   4.5813   99.901   6.1579 -3.008118 7.675146 
1 1 1   14    2   33 o   75.299   6.7462  118.826   20.712  139.848   32.395  104.291   26.938   80.758   9.7258   69.840   9.3516 10.91727 13.49238 
1 1 1   14    2   34 o   52.148   8.7308   77.671   20.686  102.057   23.753   1.1007   42.090   69.160   8.3272   35.137   15.348 34.02289 17.46170 
1 1 1   14    2   35 o   68.966   5.6370  102.266   15.940  112.604   22.290   91.446   22.803   72.715   7.4322   65.218   8.4773 7.496529 11.27398 
1 1 1   14    2   36 f   31.152   7.5081   9.2157   14.902 -23.5006   21.123   41.632   21.026   19.909   9.4612   42.395   11.661 -22.48583 15.01614 
1 1 1   14    2   37 o   70.278   5.8653  108.172   16.504   78.092   22.823  141.144   23.895   59.486   9.3024   81.069   7.1465 -21.58276 11.73059 
1 1 1   14    2   38 o   80.927   5.6075  142.997   18.541  148.273   24.913  136.446   27.759   82.932   7.2835   78.923   8.5279 4.009315 11.21498 
1 1 1   14    2   39 o   52.837   7.9557   65.283   16.821   81.342   25.074   52.141   22.683   59.131   10.674   46.543   11.800 12.58803 15.91131 
1 1 1   14    2   40 o   30.332   8.3494   17.087   15.018   18.295   21.641   15.965   20.859   30.896   11.946   29.768   11.668 1.127857 16.69881 
1 1 1   14    2   41 o   31.253   9.0768   14.583   17.396   25.063   31.833   10.120   20.773   35.139   14.199   27.367   11.312 7.772091 18.15368 
1 1 1   14    2   42 o   23.620   7.9939 -21.5565   19.833 -17.6356   23.207 -32.1787   38.197   21.413   10.098   25.826   12.395 -4.412642 15.98774 
1 1 1   14    2   43 o   40.196   8.5677   42.610   15.981   54.174   22.110   29.962   23.124   45.852   11.664   34.539   12.553 11.31303 17.13538 
1 1 1   14    2   44 o   30.818   8.4135   22.375   15.293   17.519   21.867   27.023   21.395   29.048   11.757   32.588   12.038 -3.539719 16.82707 
1 1 1   14    2   45 o   18.989   6.5072 -27.2020   15.938 -18.2500   21.649 -37.7938   23.549   19.884   9.4856   18.093   8.9106 1.791033 13.01446 
1 1 1   14    2   46 o   31.225   9.0318   20.929   21.347   44.211   27.196 -16.4440   34.456   37.674   13.625   24.776   11.859 12.89815 18.06363 
1 1 1   14    2   47 o   35.686   10.980   31.272   28.053   93.613   51.537   5.0242   33.441   44.099   17.976   27.272   12.614 16.82718 21.95964 
1 1 1   14    3    0 o  148.054   2.0414  452.612   17.613  452.612   17.613  452.612   17.613  148.054   2.8869  148.054   2.8869 0.000000 0.000000 
1 1 1   14    3    1 o  245.786   2.3242  1245.31   23.549  1273.70   33.974  1219.06   32.670  248.479   3.3150  243.093   3.2585 5.386551 4.648365 
1 1 1   14    3    2 o  275.850   2.4561  1569.80   27.943  1567.45   39.452  1572.17   39.583  275.643   3.4703  276.057   3.4765 -0.4140320 4.912128 
1 1 1   14    3    3 o  153.777   2.0423  487.775   12.953  482.569   18.261  493.045   18.376  152.952   2.8947  154.603   2.8817 -1.651382 4.084599 
1 1 1   14    3    4 o  231.452   2.2749  1105.09   21.717  1108.26   30.766  1101.95   30.659  231.783   3.2182  231.122   3.2162 0.6611328 4.549854 
1 1 1   14    3    5 o  353.774   2.8466  2582.24   41.534  2571.13   58.430  2593.58   59.051  353.006   4.0132  354.542   4.0382 -1.536407 5.693246 
1 1 1   14    3    6 o  134.872   2.0534  375.243   11.422  376.648   16.103  373.820   16.204  135.126   2.8894  134.618   2.9184 0.5085907 4.106772 
1 1 1   14    3    7 o  419.517   3.2076  3630.61   55.477  3585.54   77.150  3678.86   79.830  416.826   4.4876  422.208   4.5843 -5.382690 6.415184 
1 1 1   14    3    8 o  121.760   2.9848  302.978   14.735  389.934   21.990  232.120   19.850  137.469   3.8784  106.052   4.5381 31.41691 5.969609 
1 1 1   14    3    9 o  196.374   2.6619  798.236   20.348  788.096   35.054  803.389   24.988  195.411   4.3493  197.337   3.0702 -1.926376 5.323747 
1 1 1   14    3   10 o  310.700   2.8645  1983.58   36.091  1946.14   46.729  2038.94   56.819  307.102   3.6893  314.298   4.3831 -7.196136 5.729077 
1 1 1   14    3   11 o  338.937   4.5612  2371.45   63.762  2371.45   63.762   0.0000   0.0000  338.937   4.5612  ?   ?       ?      ? 
1 1 1   14    3   12 o  305.197   2.8464  1909.49   35.099  1860.21   45.029  1985.81   56.032  300.236   3.6363  310.158   4.3801 -9.921997 5.692835 
1 1 1   14    3   13 o  283.552   2.6347  1654.06   29.748  1679.80   49.109  1639.14   37.389  285.260   4.1740  281.844   3.2164 3.415985 5.269496 
1 1 1   14    3   14 o  234.365   2.4217  1133.09   23.401  1150.24   33.614  1116.96   32.598  236.083   3.4521  232.646   3.3972 3.437210 4.843390 
1 1 1   14    3   15 o  275.517   2.5748  1566.69   29.257  1557.66   41.085  1575.99   41.673  274.712   3.6261  276.322   3.6565 -1.609863 5.149657 
1 1 1   14    3   16 o  185.236   2.8466  708.210   21.743  696.418   30.366  720.617   31.149  183.656   4.0088  186.817   4.0426 -3.161652 5.693260 
1 1 1   14    3   17 o  282.531   2.6188  1647.79   30.513  1663.03   43.532  1633.07   42.781  283.814   3.7189  281.249   3.6880 2.564941 5.237509 
1 1 1   14    3   18 o  242.016   3.1210  1216.72   29.287  1229.62   35.868  1190.92   50.729  244.032   3.5637  240.001   5.1248 4.031082 6.242054 
1 1 1   14    3   19 o  141.035   2.6020  408.993   14.937  399.979   19.505  421.778   23.229  139.179   3.3979  142.890   3.9414 -3.710938 5.203912 
1 1 1   14    3   20 o   69.791   4.3987  114.795   11.035   63.922   17.881  146.088   14.024   55.490   7.8130   84.091   4.0435 -28.60155 8.797356 
1 1 1   14    3   21 o  242.740   3.2547  1192.45   31.796  1332.34   52.020  1109.01   40.175  253.818   4.9692  231.663   4.2047 22.15439 6.509362 
1 1 1   14    3   22 o   38.029   7.4709   31.257   12.171   33.989   16.686   28.151   17.790   39.586   10.167   36.472   10.950 3.113544 14.94184 
1 1 1   14    3   23 o   89.102   3.4729  164.718   12.713  170.492   17.415  158.133   18.600   90.793   4.6507   87.410   5.1591 3.382019 6.945890 
1 1 1   14    3   24 o  136.094   2.8827  374.650   15.714  416.696   26.037  350.560   19.708  141.938   4.4476  130.250   3.6686 11.68877 5.765393 
1 1 1   14    3   25 o   39.986   5.9550   34.722   9.5025   37.549   13.139   31.622   13.760   41.798   7.9112   38.174   8.9029 3.623924 11.90999 
1 1 1   14    3   26 o  137.596   3.1997  401.124   17.720  457.885   23.813  330.695   26.525  148.826   3.8794  126.366   5.0893 22.45972 6.399328 
1 1 1   14    3   27 o   70.082   3.6190  101.713   10.453  102.430   15.104  101.053   14.480   70.313   5.2083   69.850   5.0261 0.4629898 7.237984 
1 1 1   14    3   28 o  146.046   2.7196  440.621   16.317  445.907   24.241  436.241   22.063  146.829   4.0029  145.262   3.6825 1.567230 5.439106 
1 1 1   14    3   29 o  125.278   4.1097  324.478   20.875  318.188   27.021  333.789   32.876  123.854   5.2897  126.702   6.2912 -2.847649 8.219437 
1 1 1   14    3   30 o  115.776   3.3994  270.529   15.432  255.244   18.837  301.724   26.910  111.024   4.1136  120.529   5.4132 -9.504921 6.798868 
1 1 1   14    3   31 o  136.310   3.3021  382.388   18.049  372.397   22.844  398.986   29.445  134.052   4.1317  138.568   5.1522 -4.515930 6.604241 
1 1 1   14    3   32 o   34.909   7.8458   23.141   11.207   20.315   12.793   32.466   23.239   30.793   9.2943   39.025   12.643 -8.231775 15.69158 
1 1 1   14    3   33 o   57.656   6.7191   82.725   13.480   99.509   16.476   48.744   23.444   68.973   5.7918   46.339   12.126 22.63459 13.43825 
1 1 1   14    3   34 o   85.326   5.3246  184.733   15.214  234.107   18.773   90.256   25.969  106.048   4.2921   64.605   9.7459 41.44302 10.64917 
1 1 1   14    3   35 o   75.225   5.5069  119.810   17.006  106.740   22.878  135.948   25.422   70.660   7.8501   79.789   7.7252 -9.128380 11.01374 
1 1 1   14    3   36 o   50.226   7.5171   57.919   15.102   49.864   21.448   65.839   21.268   46.385   11.312   54.067   9.9024 -7.681732 15.03413 
1 1 1   14    3   37 o   36.265   8.5473   29.672   15.205   36.395   21.384   22.797   21.624   39.332   12.047   33.198   12.128 6.134117 17.09454 
1 1 1   14    3   38 o   43.427   8.5354   44.397   15.941   35.465   21.433   55.456   23.849   38.773   12.092   48.082   12.050 -9.309814 17.07086 
1 1 1   14    3   39 o   90.448   4.7663  175.568   17.719  156.469   24.486  196.563   25.673   85.166   6.9709   95.730   6.5022 -10.56427 9.532694 
1 1 1   14    3   40 o   20.261   6.8280 -25.5799   15.935 -36.8965   22.311 -13.7956   22.767   18.231   8.9158   22.290   10.344 -4.058376 13.65608 
1 1 1   14    3   41 o   51.546   7.8175   64.199   16.107   69.432   23.543   59.595   22.084   53.592   11.019   49.500   11.092 4.091854 15.63492 
1 1 1   14    3   42 o   29.523   8.9308   10.764   18.867   8.4256   24.017   14.533   30.492   27.702   11.843   31.345   13.371 -3.643330 17.86167 
1 1 1   14    3   43 o   35.864   8.6129   32.714   15.756   21.860   22.563   43.045   22.013   31.300   12.171   40.429   12.189 -9.129086 17.22580 
1 1 1   14    3   44 o   56.427   7.4109   80.132   16.749   72.253   24.378   87.177   23.051   52.437   11.581   60.418   9.2502 -7.981125 14.82183 
1 1 1   14    3   45 o   35.906   9.1890   36.702   19.879   6.5328   34.111   52.217   24.462   28.983   13.153   42.829   12.835 -13.84609 18.37804 
1 1 1   14    3   46 o   28.429   8.6648   14.186   18.912   2.2002   26.799   26.076   26.692   25.425   11.585   31.432   12.888 -6.007381 17.32969 
1 1 1   14    3   47 o   23.263   8.1612 -41.4190   27.756 -53.8394   49.942 -35.8684   33.386   24.737   12.320   21.790   10.707 2.946754 16.32232 
1 1 1   14    3   48 o   32.482   14.021   36.867   34.276   0.0000   0.0000   36.867   34.276  ?   ?    32.482   14.021      ?      ? 
1 1 1   14    4    0 o  172.048   2.0838  611.049   20.898  611.049   20.898  611.049   20.898  172.048   2.9469  172.048   2.9469 0.000000 0.000000 
1 1 1   14    4    1 o  688.100   4.8062  9778.43  136.400  9794.23  193.354  9762.77  192.446  688.652   6.8075  687.549   6.7864 1.103638 9.612355 
1 1 1   14    4    2 o  490.284   3.6086  4961.04   72.968  4942.94  102.630  4979.54  103.765  489.381   5.0847  491.187   5.1220 -1.805573 7.217251 
1 1 1   14    4    3 o  747.674   5.1795 11547.65  159.719 11579.96  226.803 11515.85  224.961  748.708   7.3446  746.639   7.3052 2.068787 10.35901 
1 1 1   14    4    4 o   88.811   2.1827  162.599   7.9924  157.329   11.149  168.170   11.463   87.331   3.0954   90.290   3.0782 -2.958969 4.365372 
1 1 1   14    4    5 o  270.134   2.4339  1505.29   27.115  1517.26   38.647  1493.69   38.052  271.192   3.4552  269.077   3.4287 2.114410 4.867702 
1 1 1   14    4    6 o  412.456   3.1669  3510.62   53.872  3498.68   75.862  3522.76   76.514  411.749   4.4671  413.162   4.4901 -1.413086 6.333715 
1 1 1   14    4    7 o  284.208   2.5016  1666.30   29.320  1652.63   41.086  1680.48   41.854  283.021   3.5197  285.395   3.5557 -2.374084 5.003129 
1 1 1   14    4    8 o  332.215   3.3634  2276.97   43.369  2281.39   75.424  2274.78   53.009  332.404   5.5014  332.025   3.8709 0.3794556 6.726795 
1 1 1   14    4    9 o  225.824   2.7790  1056.08   24.462  1041.00   42.009  1063.82   30.090  224.573   4.5354  227.074   3.2128 -2.500580 5.558038 
1 1 1   14    4   10 o  502.547   3.9842  5217.74   81.775  5228.04  108.404  5204.15  124.568  503.175   5.2235  501.918   6.0174 1.257538 7.968315 
1 1 1   14    4   11 o  129.107   2.6172  349.053   13.004  358.609   15.887  329.649   22.638  131.841   2.9216  126.372   4.3432 5.468414 5.234444 
1 1 1   14    4   12 o  344.264   3.0561  2448.98   43.087  2426.16   64.742  2467.12   57.729  342.802   4.5790  345.726   4.0485 -2.924591 6.112118 
1 1 1   14    4   13 o   73.078   2.8591  114.699   8.2156   92.718   13.012  129.272   10.595   67.008   4.7081   79.149   3.2454 -12.14142 5.718263 
1 1 1   14    4   14 o  461.447   3.7478  4404.25   70.893  4349.82  105.937  4448.40   95.405  458.814   5.5982  464.080   4.9844 -5.265442 7.495576 
1 1 1   14    4   15 o  123.611   2.4440  315.364   12.460  315.003   17.570  315.729   17.672  123.540   3.4482  123.682   3.4643 -0.1419601 4.887946 
1 1 1   14    4   16 o  122.251   2.4292  308.488   12.249  308.074   17.277  308.906   17.368  122.169   3.4288  122.333   3.4421 -0.1644669 4.858483 
1 1 1   14    4   17 o  209.933   2.8631  909.595   24.778  926.823   35.723  893.623   34.398  211.845   4.0886  208.022   4.0092 3.823105 5.726259 
1 1 1   14    4   18 o  250.630   3.1758  1305.31   30.757  1319.02   37.548  1277.36   53.623  252.735   3.6021  248.526   5.2313 4.208359 6.351532 
1 1 1   14    4   19 o  226.723   2.6987  1062.22   24.902  1064.75   32.687  1058.74   38.441  227.073   3.4902  226.372   4.1172 0.7008667 5.397490 
1 1 1   14    4   20 o  171.655   3.7589  608.582   26.612   0.0000   0.0000  608.582   26.612  ?   ?   171.655   3.7589      ?      ? 
1 1 1   14    4   21 o   72.726   3.3963  109.324   10.146  109.932   15.062  108.820   13.727   72.902   5.0092   72.550   4.5876 0.3521271 6.792561 
1 1 1   14    4   22 o  248.509   2.5649  1275.69   26.287  1268.72   36.925  1282.85   37.432  247.823   3.6126  249.196   3.6420 -1.373001 5.129793 
1 1 1   14    4   23 o  131.992   2.7446  361.737   14.797  346.693   22.278  373.613   19.794  129.503   4.1710  134.481   3.5687 -4.977264 5.489297 
1 1 1   14    4   24 o  211.253   2.6200  922.857   22.746  914.627   33.539  929.867   30.952  210.361   3.8657  212.145   3.5374 -1.784180 5.239901 
1 1 1   14    4   25 o  121.041   3.4836  301.275   16.916  311.829   27.516  294.862   21.449  122.683   5.4380  119.398   4.3555 3.285561 6.967175 
1 1 1   14    4   26 o  242.000   2.8935  1212.18   28.402  1204.67   44.312  1217.41   37.002  241.302   4.4524  242.698   3.6965 -1.395508 5.786908 
1 1 1   14    4   27 o  127.848   3.6445  338.598   19.215  346.687   27.346  330.709   27.006  129.360   5.1253  126.337   5.1828 3.022758 7.289068 
1 1 1   14    4   28 o  233.721   3.3193  1143.28   31.484  1211.43   41.759  1053.51   47.927  241.977   4.1842  225.466   5.1539 16.51146 6.638500 
1 1 1   14    4   29 o   75.780   5.1863  125.481   13.637  130.906   15.734  109.106   27.337   79.476   4.8001   72.083   9.1951 7.392738 10.37260 
1 1 1   14    4   30 o   66.529   4.8999   91.573   12.151   90.508   14.349   94.272   22.846   66.019   5.2696   67.040   8.2624 -1.021263 9.799820 
1 1 1   14    4   31 o  125.153   3.7361  322.890   19.191  298.521   25.638  353.947   28.943  119.846   5.1867  130.460   5.3789 -10.61411 7.472255 
1 1 1   14    4   32 o   27.485   7.6218   8.8400   10.975   6.5702   12.531   16.318   22.744   22.882   9.0197   32.088   12.289 -9.205429 15.24354 
1 1 1   14    4   33 o   28.639   6.8683   17.357   10.044   23.291   11.442  -2.5606   20.965   32.505   8.4549   24.773   10.826 7.731373 13.73662 
1 1 1   14    4   34 o   38.475   7.4802   29.312   10.926   24.810   12.543   43.473   22.248   33.401   8.9319   43.549   12.001 -10.14763 14.96037 
1 1 1   14    4   35 o   39.505   8.3246   35.880   11.522   37.805   12.131   18.134   36.837   42.211   6.9678   36.800   15.121 5.410515 16.64922 
1 1 1   14    4   36 o   59.162   6.5820   76.386   16.032   73.176   21.884   80.104   23.552   57.875   9.1679   60.448   9.4467 -2.573048 13.16398 
1 1 1   14    4   37 o   22.303   7.2547 -12.9870   15.340  -6.4867   22.561 -18.5764   20.921   24.093   10.837   20.513   9.6477 3.579155 14.50937 
1 1 1   14    4   38 o   66.012   6.0351   95.942   16.313   84.631   23.296  106.824   22.850   61.897   9.1254   70.127   7.9003 -8.229637 12.07013 
1 1 1   14    4   39 o   34.965   7.9705   24.179   15.248   48.939   21.704   0.0478   21.426   45.001   11.615   24.930   10.918 20.07154 15.94107 
1 1 1   14    4   40 o   31.892   9.3859   15.221   20.187 -11.5452   40.703   23.952   23.247   30.359   13.997   33.424   12.508 -3.064571 18.77186 
1 1 1   14    4   41 o   38.683   8.6464   37.043   15.900   47.112   22.240   26.517   22.740   43.369   12.018   33.997   12.434 9.372044 17.29276 
1 1 1   14    4   42 o   36.503   8.7739   33.650   16.171   24.683   23.384   41.868   22.388   32.819   12.486   40.187   12.330 -7.368031 17.54781 
1 1 1   14    4   43 o   33.963   8.1345   25.092   15.521   2.6836   21.649   48.790   22.263   24.842   10.925   43.084   12.055 -18.24128 16.26897 
1 1 1   14    4   44 o   25.255   7.8876  -0.8698   16.486 -15.5684   21.773   18.884   25.240   20.464   9.6903   30.046   12.448 -9.582054 15.77513 
1 1 1   14    4   45 o   31.732   8.3981   21.834   16.756   43.663   23.368  -1.2640   24.038   39.210   12.675   24.255   11.021 14.95552 16.79626 
1 1 1   14    4   46 o   31.510   9.3226   26.003   19.801   25.997   24.400   26.017   33.888   31.163   12.487   31.857   13.846 -0.6949177 18.64527 
1 1 1   14    4   47 o   40.002   11.003   65.638   29.914   26.545   52.288   84.657   36.472   32.436   15.254   47.568   15.861 -15.13146 22.00567 
1 1 1   14    4   48 o   21.156   10.363 -27.4703   30.509   0.0000   0.0000 -27.4703   30.509  ?   ?    21.156   10.363      ?      ? 
1 1 1   14    5    0 o  222.256   2.2362  1019.48   28.977  1019.48   28.977  1019.48   28.977  222.256   3.1625  222.256   3.1625 0.000000 0.000000 
1 1 1   14    5    1 o  672.833   4.7123  9349.07  130.767  9332.37  184.416  9365.97  185.453  672.230   6.6514  673.436   6.6769 -1.205383 9.424541 
1 1 1   14    5    2 o  108.085   2.0668  240.969   9.2132  242.934   13.090  239.040   12.970  108.522   2.9245  107.648   2.9212 0.8733826 4.133541 
1 1 1   14    5    3 o  191.850   2.1306  759.146   16.858  749.329   23.665  769.258   24.020  190.592   3.0106  193.109   3.0158 -2.517776 4.261261 
1 1 1   14    5    4 o  664.840   4.6632  9128.69  127.868  9141.77  181.178  9115.70  180.489  665.314   6.6026  664.367   6.5868 0.9470825 9.326342 
1 1 1   14    5    5 o   84.576   2.2187  147.411   7.7327  139.035   10.763  156.347   11.117   82.095   3.1788   87.057   3.0961 -4.962036 4.437383 
1 1 1   14    5    6 o  287.239   2.5141  1702.21   29.784  1695.02   41.938  1709.53   42.305  286.627   3.5476  287.851   3.5633 -1.223297 5.028159 
1 1 1   14    5    7 o  478.591   3.8359  4725.81   74.815  4750.14  115.176  4708.06   98.401  479.613   5.8225  477.569   4.9957 2.043915 7.671894 
1 1 1   14    5    8 o  203.695   2.6829  861.890   21.359  838.171   36.352  874.395   26.396  201.519   4.3737  205.870   3.1087 -4.351212 5.365885 
1 1 1   14    5    9 f  165.943   2.2850  568.790   15.464  563.880   23.660  572.452   20.431  165.311   3.4701  166.576   2.9739 -1.264297 4.570072 
1 1 1   14    5   10 o   92.945   2.9419  179.869   10.787  183.859   13.502  172.828   17.936   94.394   3.4681   91.495   4.7531 2.899292 5.883816 
1 1 1   14    5   11 o  302.811   2.8187  1896.37   34.958  1926.66   46.960  1858.71   52.354  305.545   3.7264  300.077   4.2301 5.468597 5.637369 
1 1 1   14    5   12 o  193.206   2.3959  769.464   18.947  777.098   28.681  763.553   25.239  194.047   3.5836  192.364   3.1811 1.683289 4.791809 
1 1 1   14    5   13 o  212.719   3.1999  899.621   27.300  1083.22   45.517  796.456   34.119  229.023   4.8186  196.415   4.2117 32.60805 6.399799 
1 1 1   14    5   14 o   55.851   3.3546   65.196   7.3575   61.835   12.312   67.062   9.1761   54.705   5.4569   56.997   3.9034 -2.292435 6.709226 
1 1 1   14    5   15 o  118.177   2.6544  288.818   12.722  291.164   16.583  285.463   19.832  118.773   3.3852  117.582   4.0894 1.191261 5.308742 
1 1 1   14    5   16 o  148.295   2.5447  455.606   15.419  441.390   23.256  466.759   20.598  146.212   3.8564  150.378   3.3211 -4.166397 5.089323 
1 1 1   14    5   17 o   63.740   3.4845   83.559   9.1375   90.378   13.506   77.804   12.409   66.126   4.9520   61.355   4.9035 4.770733 6.968988 
1 1 1   14    5   18 o  103.854   3.4695  217.457   13.265  211.025   15.468  235.331   25.787  101.082   3.7103  106.625   5.8638 -5.543259 6.939048 
1 1 1   14    5   19 o  189.621   2.9080  742.150   22.732  713.141   31.616  773.193   32.706  185.788   4.1260  193.454   4.0990 -7.666656 5.816000 
1 1 1   14    5   20 o  232.578   3.4987  1118.54   33.561  1117.28   47.412  1119.80   47.514  232.447   4.9454  232.709   4.9504 -0.2617798 6.997403 
1 1 1   14    5   21 f  233.453   3.2059  1122.28   28.282  1138.25   51.828  1115.50   33.749  234.511   5.3584  232.395   3.5210 2.115784 6.411748 
1 1 1   14    5   22 o   96.427   3.0843  193.147   12.178  183.519   18.080  201.143   16.477   94.200   4.6535   98.654   4.0494 -4.453583 6.168690 
1 1 1   14    5   23 o  225.427   2.5032  1049.86   23.273  1051.27   32.950  1048.45   32.878  225.579   3.5415  225.275   3.5385 0.3032074 5.006310 
1 1 1   14    5   24 o  192.030   2.8914  764.542   22.811  688.455   32.321  840.053   32.198  182.459   4.2949  201.601   3.8723 -19.14261 5.782835 
1 1 1   14    5   25 o   57.061   4.0023   67.292   9.3799   76.398   13.642   59.127   12.918   60.722   5.4472   53.399   5.8652 7.322742 8.004514 
1 1 1   14    5   26 o  127.183   2.9924  333.641   15.604  326.465   20.860  342.758   23.513  125.652   4.0252  128.713   4.4291 -3.061096 5.984879 
1 1 1   14    5   27 o   58.725   4.0080   71.582   9.6968   67.709   13.717   75.452   13.710   57.126   5.8218   60.323   5.5104 -3.196976 8.016077 
1 1 1   14    5   28 o  105.052   3.4595  228.544   13.997  228.401   16.990  228.846   24.695  105.087   3.9200  105.018   5.7013 0.6816864E-01 6.918902 
1 1 1   14    5   29 o   81.464   4.4110  144.525   13.221  153.677   15.806  123.198   24.129   86.134   4.4491   76.794   7.6180 9.339958 8.821997 
1 1 1   14    5   30 o  190.206   4.2966  774.251   31.352  693.411   54.001  815.353   38.506  182.144   7.1883  198.267   4.7088 -16.12283 8.593246 
1 1 1   14    5   31 o  106.741   4.0644  237.552   17.851  242.201   24.563  232.349   25.987  107.889   5.5201  105.592   5.9671 2.296242 8.128820 
1 1 1   14    5   32 o   39.553   7.8011   29.504   12.001   22.923   13.882   48.968   23.875   32.509   9.6527   46.597   12.258 -14.08871 15.60215 
1 1 1   14    5   33 o  110.006   3.5388  248.839   14.869  243.167   17.831  261.786   26.941  108.200   3.9956  111.812   5.8419 -3.612465 7.077579 
1 1 1   14    5   34 o   29.770   7.2151   18.847   10.658   23.471   12.285   4.7693   21.435   32.500   8.9024   27.040   11.357 5.459812 14.43015 
1 1 1   14    5   35 o   90.018   6.0672  197.039   16.073  209.815   17.811  141.007   37.301  100.320   4.3047   79.715   11.345 20.60423 12.13431 
1 1 1   14    5   36 o   64.149   5.2966   90.666   12.051   93.105   14.007   83.719   23.643   66.546   5.1034   61.753   9.2827 4.793053 10.59311 
1 1 1   14    5   37 o   52.970   7.1445   65.996   12.113   67.597   13.551   59.633   27.014   56.465   5.8189   49.474   13.051 6.990120 14.28907 
1 1 1   14    5   38 o   66.204   5.8340   95.381   15.910   89.874   21.895  101.542   23.158   64.175   8.2721   68.233   8.2290 -4.058250 11.66806 
1 1 1   14    5   39 o   25.601   7.6501   2.6097   14.501   14.782   20.495  -9.5918   20.520   29.248   11.533   21.953   10.054 7.294634 15.30029 
1 1 1   14    5   40 o   27.888   9.0512 -12.3678   20.233   12.781   40.304 -20.8416   23.395   34.511   15.048   21.264   10.062 13.24723 18.10247 
1 1 1   14    5   41 o   45.054   8.3817   50.995   15.951   42.632   22.916   58.856   22.216   41.065   12.450   49.043   11.226 -7.978615 16.76334 
1 1 1   14    5   42 o   39.010   8.4501   37.333   16.130   58.989   23.542   18.173   22.144   47.926   11.951   30.095   11.950 17.83059 16.90023 
1 1 1   14    5   43 o   44.692   8.7994   56.588   17.446   65.972   21.565   38.817   29.678   51.618   10.487   37.765   14.133 13.85289 17.59883 
1 1 1   14    5   44 o   25.691   7.9928   3.0246   16.650  -8.0953   22.505   16.473   24.749   22.226   10.304   29.156   12.222 -6.930014 15.98569 
1 1 1   14    5   45 o   20.443   6.8971 -20.9456   16.536 -35.9521   23.926  -7.2230   22.880   18.439   9.0613   22.448   10.401 -4.009407 13.79413 
1 1 1   14    5   46 o   27.703   8.9576   6.3905   23.100  -3.3877   32.696   16.136   32.640   25.942   12.156   29.465   13.160 -3.522938 17.91523 
1 1 1   14    5   47 o   28.947   9.3828   12.770   26.465 -24.4164   49.721   27.470   31.261   26.699   13.109   31.194   13.428 -4.494444 18.76558 
1 1 1   14    5   48 o   24.624   11.722  -4.3914   32.706   0.0000   0.0000  -4.3914   32.706  ?   ?    24.624   11.722      ?      ? 
1 1 1   14    6    0 o  187.066   2.1192  722.315   23.109  722.315   23.109  722.315   23.109  187.066   2.9969  187.066   2.9969 0.000000 0.000000 
1 1 1   14    6    1 o  473.611   3.5088  4629.62   68.540  4628.41   96.890  4630.83   96.971  473.549   4.9607  473.672   4.9636 -0.1231995 7.017586 
1 1 1   14    6    2 o  558.524   4.0133  6439.16   92.431  6492.71  132.314  6388.13  129.178  560.787   5.7206  556.262   5.6304 4.524780 8.026664 
1 1 1   14    6    3 o   97.726   2.0856  197.017   8.4044  197.195   11.760  196.832   12.015   97.772   2.9163   97.681   2.9823 0.9070587E-01 4.171216 
1 1 1   14    6    4 f  236.930   2.2907  1158.09   22.384  1159.71   31.674  1156.47   31.638  237.095   3.2391  236.764   3.2399 0.3314972 4.581301 
1 1 1   14    6    5 o  104.527   2.0756  225.368   8.9465  224.220   12.522  226.565   12.787  104.255   2.9121  104.799   2.9583 -0.5431290 4.151129 
1 1 1   14    6    6 o  312.816   2.6373  2019.12   34.027  2017.90   48.107  2020.34   48.135  312.721   3.7298  312.911   3.7297 -0.1892700 5.274640 
1 1 1   14    6    7 o  250.871   2.5414  1299.72   26.058  1290.38   39.534  1306.90   34.650  250.063   3.8332  251.678   3.3381 -1.614792 5.082893 
1 1 1   14    6    8 o  137.638   2.5372  382.324   13.372  413.848   24.299  368.629   16.016  141.604   4.1605  133.672   2.9050 7.932098 5.074302 
1 1 1   14    6    9 o  259.400   2.6062  1382.28   27.428  1422.81   43.122  1354.73   35.545  262.565   3.9820  256.235   3.3634 6.330597 5.212306 
1 1 1   14    6   10 o  259.672   3.1549  1386.51   32.929  1368.01   41.957  1416.17   53.136  257.454   3.9513  261.889   4.9193 -4.434631 6.309702 
1 1 1   14    6   11 o   86.496   2.9373  155.537   10.364  163.055   13.877  146.055   15.584   88.884   3.7854   84.109   4.4923 4.774834 5.874568 
1 1 1   14    6   12 o  227.213   2.8637  1057.22   25.365  1091.53   44.048  1040.19   31.025  229.913   4.6451  224.512   3.3505 5.400131 5.727355 
1 1 1   14    6   13 o  245.463   3.3209  1237.89   33.526  1159.45   45.383  1332.11   49.742  236.952   4.6438  253.975   4.7486 -17.02263 6.641798 
1 1 1   14    6   14 o  252.403   2.5308  1311.75   25.546  1328.05   41.692  1301.96   32.325  253.628   3.9855  251.178   3.1202 2.449677 5.061661 
1 1 1   14    6   15 o  134.272   2.3679  371.747   13.106  383.755   18.920  360.671   18.172  136.354   3.3643  132.190   3.3330 4.163513 4.735778 
1 1 1   14    6   16 o  222.847   2.5801  1022.56   23.536  1046.92   35.722  1003.87   31.288  225.172   3.8464  220.521   3.4401 4.650650 5.160291 
1 1 1   14    6   17 o  158.107   3.1962  520.287   20.534  540.440   27.128  493.249   31.423  161.749   4.0664  154.464   4.9324 7.284271 6.392485 
1 1 1   14    6   18 o  220.752   2.7002  1012.96   24.368  1064.29   32.883  950.436   36.292  227.021   3.5119  214.483   4.1026 12.53879 5.400407 
1 1 1   14    6   19 o  190.665   2.6321  745.357   20.247  725.511   25.895  776.574   32.476  187.451   3.3493  193.880   4.0613 -6.428665 5.264238 
1 1 1   14    6   20 o   96.669   3.2370  197.017   12.235  180.636   20.460  206.137   15.266   93.439   5.3089   99.900   3.7050 -6.461304 6.473944 
1 1 1   14    6   21 o  100.341   3.1290  209.119   12.418  204.764   20.630  211.594   15.552   99.481   5.0279  101.202   3.7258 -1.720909 6.257936 
1 1 1   14    6   22 o   46.049   5.5171   48.959   9.4181   32.309   15.228   59.272   11.985   38.593   9.6051   53.505   5.4310 -14.91214 11.03419 
1 1 1   14    6   23 o  252.342   3.0870  1316.19   32.120  1286.85   44.789  1347.25   46.087  249.451   4.3533  255.234   4.3780 -5.783386 6.173987 
1 1 1   14    6   24 o  125.174   2.5759  323.778   13.299  323.572   18.816  323.983   18.798  125.134   3.6458  125.214   3.6399 -0.7989502E-01 5.151739 
1 1 1   14    6   25 o  181.440   2.6293  681.569   19.626  661.834   28.546  699.259   27.027  178.928   3.8681  183.952   3.5622 -5.023285 5.258533 
1 1 1   14    6   26 o   48.208   4.9639   47.230   9.4649   36.896   12.231   62.655   14.943   41.496   7.4188   54.919   6.5972 -13.42255 9.927826 
1 1 1   14    6   27 o  211.230   2.5680  922.348   22.371  934.144   31.685  910.623   31.590  212.579   3.6138  209.880   3.6493 2.698364 5.135914 
1 1 1   14    6   28 o   59.097   5.5686   66.510   12.084   59.790   13.892   87.393   24.491   53.636   6.2800   64.559   9.1977 -10.92315 11.13715 
1 1 1   14    6   29 o  127.991   3.6210  338.260   19.033  323.286   25.546  356.944   28.535  124.847   4.9610  131.136   5.2759 -6.289032 7.242017 
1 1 1   14    6   30 o   93.688   3.7918  179.045   13.567  173.684   16.239  191.434   24.688   91.540   4.3011   95.836   6.2460 -4.295471 7.583669 
1 1 1   14    6   31 o   75.329   5.3147  119.965   16.314  140.578   23.032   99.210   23.112   81.989   6.8111   68.670   8.1604 13.31900 10.62932 
1 1 1   14    6   32 o  103.573   4.7304  225.652   20.057  221.171   30.084  229.238   26.910  102.526   7.1144  104.620   6.2364 -2.094170 9.460841 
1 1 1   14    6   33 o   58.059   5.4308   72.050   11.530   72.787   13.543   70.107   21.979   58.978   5.5673   57.140   9.3262 1.838390 10.86154 
1 1 1   14    6   34 o   84.857   4.4575  163.117   13.766  179.880   16.582  125.942   24.694   92.896   4.3280   76.818   7.7939 16.07793 8.914970 
1 1 1   14    6   35 o   94.307   5.0357  187.872   19.526  203.869   29.031  174.655   26.387   97.925   7.1878   90.688   7.0547 7.237587 10.07141 
1 1 1   14    6   36 o  111.360   3.7451  265.568   15.981  273.332   19.489  249.632   27.921  114.357   4.1320  108.362   6.2473 5.994995 7.490119 
1 1 1   14    6   37 o   83.533   4.7245  142.801   14.298  136.013   16.486  163.415   28.727   80.378   4.9728   86.688   8.0345 -6.310394 9.448941 
1 1 1   14    6   38 o   56.318   6.0421   67.660   12.089   64.645   14.047   76.266   23.737   55.091   6.1820   57.544   10.383 -2.452332 12.08429 
1 1 1   14    6   39 o   27.537   7.2818   15.084   10.482   17.669   11.928   6.3199   21.963   28.160   9.0508   26.913   11.410 1.246632 14.56365 
1 1 1   14    6   40 o   27.163   7.9511   6.2182   15.422  -8.7250   22.168   20.233   21.469   22.926   10.481   31.400   11.960 -8.473688 15.90229 
1 1 1   14    6   41 o   30.036   7.9195   12.127   15.725   36.732   21.470 -16.3431   23.095   38.345   12.124   21.728   10.192 16.61702 15.83907 
1 1 1   14    6   42 o   33.260   8.6718   26.584   15.686   27.693   22.544   25.544   21.841   33.732   12.374   32.788   12.153 0.9439049 17.34358 
1 1 1   14    6   43 o   28.134   8.4872   11.197   16.622   10.179   20.395   13.212   28.686   26.449   11.092   29.819   12.849 -3.369932 16.97447 
1 1 1   14    6   44 o   42.710   9.1246   51.876   17.425   50.942   24.291   52.865   25.011   42.398   12.810   43.021   12.998 -0.6222343 18.24915 
1 1 1   14    6   45 o   31.749   8.8232   25.858   16.995   29.813   23.889   21.805   24.182   33.139   12.617   30.358   12.337 2.780746 17.64632 
1 1 1   14    6   46 o   30.044   9.0712   18.685   21.496  -6.6042   33.082   37.166   28.281   25.492   12.033   34.595   13.578 -9.102371 18.14230 
1 1 1   14    6   47 o   39.936   9.3395   54.465   27.408 -56.3500   50.535  100.646   32.623   24.309   12.151   55.562   14.186 -31.25228 18.67907 
1 1 1   14    6   48 o   44.963   11.953   89.217   28.838  126.971   49.459   69.769   35.497   49.253   18.281   40.674   15.406 8.578766 23.90687 
1 1 1   14    7    0 o  168.649   2.0704  587.170   20.353  587.170   20.353  587.170   20.353  168.649   2.9280  168.649   2.9280 0.000000 0.000000 
1 1 1   14    7    1 o  385.337   3.0117  3063.67   47.856  3038.52   66.936  3089.97   68.447  383.721   4.2294  386.953   4.2887 -3.231415 6.023352 
1 1 1   14    7    2 o  237.711   2.2949  1165.73   22.499  1160.64   31.698  1170.91   31.940  237.188   3.2402  238.235   3.2506 -1.047226 4.589702 
1 1 1   14    7    3 o  364.283   2.8999  2738.41   43.570  2733.96   61.466  2742.90   61.770  363.986   4.0944  364.580   4.1079 -0.5940857 5.799891 
1 1 1   14    7    4 o  372.677   2.9455  2865.47   45.263  2897.09   64.909  2835.54   63.149  374.675   4.2003  370.678   4.1305 3.996857 5.891016 
1 1 1   14    7    5 o  153.665   2.0641  486.991   13.080  495.932   18.691  478.410   18.311  155.047   2.9229  152.283   2.9153 2.763611 4.128217 
1 1 1   14    7    6 o  443.204   3.8540  4054.52   70.417  4111.29  101.418  4001.68   97.847  446.191   5.5110  440.216   5.3891 5.974487 7.707983 
1 1 1   14    7    7 o  291.760   2.7379  1758.36   32.667  1743.81   49.423  1769.65   43.531  290.674   4.1224  292.847   3.6041 -2.173462 5.475763 
1 1 1   14    7    8 o  364.951   3.5946  2733.19   50.351  2796.43   89.925  2704.30   60.770  367.923   5.9260  361.978   4.0705 5.945190 7.189272 
1 1 1   14    7    9 o  141.825   2.0792  414.949   12.161  418.172   17.319  411.815   17.080  142.367   2.9495  141.282   2.9312 1.085846 4.158342 
1 1 1   14    7   10 o  302.824   2.8148  1894.17   34.816  1902.73   46.195  1882.91   52.972  303.636   3.6887  302.012   4.2526 1.623993 5.629519 
1 1 1   14    7   11 o  241.805   2.5775  1208.57   25.605  1184.83   37.723  1228.86   34.868  239.590   3.8174  244.020   3.4644 -4.430084 5.155084 
1 1 1   14    7   12 o  112.229   2.9274  248.838   13.084  303.022   22.282  220.320   16.165  121.143   4.4595  103.314   3.7936 17.82798 5.854748 
1 1 1   14    7   13 o   47.715   4.9464   48.274   8.3462   46.861   16.007   48.801   9.7809   46.823   8.6059   48.606   4.8789 -1.783127 9.892715 
1 1 1   14    7   14 f   92.335   3.6982  176.213   14.075  168.474   19.830  184.071   19.982   90.288   5.3251   94.382   5.1332 -4.094040 7.396374 
1 1 1   14    7   15 o  102.253   2.5439  215.846   10.729  217.227   15.205  214.477   15.140  102.579   3.5938  101.927   3.6014 0.6516876 5.087837 
1 1 1   14    7   16 o  165.708   2.3325  566.766   15.939  561.571   22.338  572.155   22.751  164.935   3.2838  166.480   3.3134 -1.545471 4.664938 
1 1 1   14    7   17 o  192.060   3.0195  774.221   22.409  798.068   27.506  727.151   38.643  196.598   3.3922  187.522   4.9964 9.075729 6.039069 
1 1 1   14    7   18 o  101.688   3.3376  214.116   13.975  204.388   20.027  223.349   19.510   99.425   4.8839  103.952   4.5505 -4.527359 6.675284 
1 1 1   14    7   19 o  126.154   2.4807  328.697   12.903  330.726   18.050  326.576   18.452  126.555   3.4581  125.754   3.5576 0.8013687 4.961354 
1 1 1   14    7   20 o  170.047   2.4123  597.182   16.919  595.777   23.945  598.582   23.908  169.847   3.4182  170.247   3.4049 -0.4002838 4.824655 
1 1 1   14    7   21 o   31.539   7.1331   21.431   9.8918   8.1610   21.861   24.847   11.092   29.184   11.775   33.894   8.0536 -4.710827 14.26613 
1 1 1   14    7   22 o   58.873   3.9048   71.931   9.4363   70.164   13.949   73.422   12.813   58.191   5.8119   59.555   5.2165 -1.363403 7.809611 
1 1 1   14    7   23 o   74.310   3.2016  114.006   9.8028  120.449   14.221  108.173   13.531   76.307   4.5186   72.313   4.5368 3.993813 6.403155 
1 1 1   14    7   24 o   52.952   4.0053   57.963   8.7318   63.033   12.683   53.396   12.039   55.151   5.5758   50.753   5.7515 4.398739 8.010562 
1 1 1   14    7   25 o  275.473   3.1266  1569.59   35.503  1644.54   50.624  1497.05   49.803  281.956   4.3532  268.989   4.4891 12.96640 6.253176 
1 1 1   14    7   26 o  154.674   2.8421  492.490   17.872  481.729   23.267  507.978   27.913  152.656   3.6954  156.692   4.3191 -4.035416 5.684245 
1 1 1   14    7   27 o  106.495   3.7970  233.853   16.621  220.274   22.404  250.475   24.787  103.086   5.2694  109.904   5.4683 -6.818352 7.593948 
1 1 1   14    7   28 o  119.215   3.6586  286.182   16.178  275.770   18.929  314.401   31.161  115.447   3.9754  122.984   6.1432 -7.537262 7.317245 
1 1 1   14    7   29 o  197.423   3.5246  812.841   28.549  739.071   41.142  881.346   39.647  188.665   5.2873  206.182   4.6622 -17.51692 7.049209 
1 1 1   14    7   30 o   25.845   7.1700   9.5292   10.392   12.809   11.830  -1.5618   21.755   25.931   9.0239   25.759   11.145 0.1717415 14.33992 
1 1 1   14    7   31 o  201.506   3.7420  843.623   31.068  816.091   42.777  874.359   45.197  198.051   5.2368  204.961   5.3465 -6.910233 7.483963 
1 1 1   14    7   32 o   83.540   4.2236  145.988   13.266  145.834   15.804  146.354   24.410   83.722   4.5768   83.357   7.0999 0.3649826 8.447178 
1 1 1   14    7   33 o   86.702   4.0372  154.339   13.282  149.519   15.818  165.861   24.457   84.714   4.5272   88.690   6.6859 -3.976517 8.074484 
1 1 1   14    7   34 o  119.788   3.9045  300.424   19.253  288.633   26.249  314.154   28.325  117.288   5.4262  122.288   5.6159 -5.000931 7.809068 
1 1 1   14    7   35 o   96.591   4.2071  211.606   14.996  237.359   18.331  159.485   26.078  106.697   4.1654   86.485   7.3108 20.21275 8.414186 
1 1 1   14    7   36 o   60.143   8.2956  111.183   13.927  121.884   15.038   46.696   36.915   76.176   4.7862   44.110   15.886 32.06591 16.59129 
1 1 1   14    7   37 o  113.135   4.2690  272.137   19.911  261.370   27.970  283.197   28.350  110.820   6.1195  115.451   5.9538 -4.630150 8.537922 
1 1 1   14    7   38 o  159.530   4.0111  546.250   26.035  487.408   38.699  594.903   35.189  151.147   6.2078  167.913   5.0811 -16.76605 8.022116 
1 1 1   14    7   39 o   54.525   7.3645   81.632   13.799   95.136   16.136   44.889   26.617   66.745   5.8616   42.304   13.512 24.44103 14.72898 
1 1 1   14    7   40 o   87.202   5.0153  165.687   17.994  150.482   24.901  182.304   26.031   82.892   7.2834   91.512   6.8969 -8.620872 10.03068 
1 1 1   14    7   41 o   18.944   6.2667  -7.2468   10.025  -4.9539   11.192 -16.5519   22.547   16.569   7.5251   21.318   10.023 -4.749605 12.53337 
1 1 1   14    7   42 o   22.608   6.9043   4.3916   9.8145   5.1081   10.895   1.3076   22.605   20.232   8.2579   24.984   11.067 -4.751455 13.80854 
1 1 1   14    7   43 o   36.872   9.4508   39.143   21.098   52.296   23.862  -7.9680   45.160   43.762   12.562   29.982   14.123 13.77979 18.90159 
1 1 1   14    7   44 f   27.867   8.4719   7.4098   17.597  -5.6096   22.634   27.303   27.979   22.803   10.486   32.930   13.309 -10.12702 16.94382 
1 1 1   14    7   45 o   26.699   8.1629   10.753   16.501   12.868   23.356   8.6454   23.315   27.289   11.673   26.110   11.414 1.179707 16.32579 
1 1 1   14    7   46 o   29.029   9.0994   15.084   21.177   25.616   33.642   8.1713   27.255   31.479   13.737   26.579   11.937 4.899572 18.19880 
1 1 1   14    7   47 o   29.119   9.3600   15.680   26.713 -31.3610   49.559   34.943   31.715   25.691   12.704   32.546   13.749 -6.855494 18.71995 
1 1 1   14    7   48 o   26.215   8.9676  -3.7931   26.894   12.704   49.038 -10.8897   32.163   28.923   13.923   23.507   11.306 5.415524 17.93523 
1 1 1   14    8    0 o  618.174   4.3747  7889.39  157.705  7889.39  157.705  7889.39  157.705  618.174   6.1868  618.174   6.1868 0.000000 0.000000 
1 1 1   14    8    1 o  222.704   2.4230  1019.89   21.934  1003.62   28.578  1043.20   34.218  220.559   3.1415  224.848   3.6898 -4.289246 4.845989 
1 1 1   14    8    2 o  374.064   3.1886  2889.75   48.738  2900.24   64.735  2876.02   74.052  374.871   4.1869  373.257   4.8102 1.614502 6.377164 
1 1 1   14    8    3 o  547.438   4.2720  6184.69   95.258  6226.21  146.962  6154.60  125.095  548.952   6.4909  545.924   5.5557 3.028137 8.543911 
1 1 1   14    8    4 o  263.034   2.5921  1428.79   27.865  1419.32   42.290  1436.06   37.043  262.252   3.9098  263.816   3.4044 -1.564240 5.184272 
1 1 1   14    8    5 o  303.584   2.5943  1901.82   32.484  1897.53   45.883  1906.13   45.996  303.241   3.6685  303.927   3.6693 -0.6860352 5.188667 
1 1 1   14    8    6 o  168.271   2.2444  584.560   15.437  581.572   23.427  586.852   20.522  167.885   3.3832  168.657   2.9502 -0.7717133 4.488832 
1 1 1   14    8    7 o  373.337   3.6214  2878.21   52.532  2877.95   91.113  2878.33   64.295  373.242   5.9187  373.432   4.1744 -0.1903381 7.242723 
1 1 1   14    8    8 o  167.905   2.6054  581.024   16.874  584.021   29.727  579.600   20.496  168.203   4.2851  167.608   2.9649 0.5949402 5.210825 
1 1 1   14    8    9 o  292.535   2.5535  1764.00   30.778  1810.83   44.751  1721.96   42.398  296.212   3.6630  288.859   3.5587 7.353455 5.107043 
1 1 1   14    8   10 o   62.663   3.1187   81.489   8.0166   75.638   11.683   86.695   11.020   60.522   4.6803   64.804   4.1231 -4.282600 6.237404 
1 1 1   14    8   11 o  119.390   2.6982  293.014   13.162  285.781   17.366  302.779   20.177  117.672   3.5781  121.108   4.0395 -3.435631 5.396303 
1 1 1   14    8   12 o  257.236   2.5266  1367.04   26.123  1359.97   41.889  1371.54   33.417  256.666   3.9570  257.805   3.1428 -1.139465 5.053230 
1 1 1   14    8   13 o  100.048   2.5893  206.768   10.603  205.460   15.988  207.796   14.167   99.759   3.8858  100.337   3.4234 -0.5781937 5.178691 
1 1 1   14    8   14 o  182.157   2.6084  683.790   19.566  664.431   26.785  705.938   28.649  179.402   3.6199  184.913   3.7565 -5.511261 5.216771 
1 1 1   14    8   15 o  147.879   2.7035  454.536   16.377  488.667   22.479  415.925   23.909  153.848   3.5426  141.910   4.0849 11.93845 5.407056 
1 1 1   14    8   16 o  151.709   3.2555  475.685   19.875  475.616   25.456  475.792   31.807  151.732   4.0677  151.685   5.0841 0.4708862E-01 6.511098 
1 1 1   14    8   17 o  188.334   2.9617  726.752   21.159  717.480   25.282  748.432   38.661  186.415   3.2883  190.253   4.9269 -3.838303 5.923403 
1 1 1   14    8   18 o   30.599   5.6786   20.056   7.3131   23.897   10.497   16.433   10.195   33.270   7.7871   27.928   8.2671 5.341835 11.35714 
1 1 1   14    8   19 o  379.924   3.0828  2982.01   48.284  2943.49   67.097  3023.38   69.535  377.390   4.3107  382.458   4.4081 -5.068054 6.165522 
1 1 1   14    8   20 o  140.524   2.4104  407.866   13.969  409.625   19.676  406.077   19.837  140.831   3.3874  140.217   3.4301 0.6139832 4.820804 
1 1 1   14    8   21 o  268.575   3.4579  1458.07   35.895  1589.66   64.166  1398.13   43.306  277.056   5.6153  260.095   4.0369 16.96078 6.915782 
1 1 1   14    8   22 o  174.987   2.6182  627.619   18.599  660.929   29.317  605.181   24.062  178.814   3.9752  171.160   3.4085 7.654373 5.236381 
1 1 1   14    8   23 f  141.259   2.4885  411.711   14.487  426.966   20.997  397.848   20.015  143.752   3.5413  138.767   3.4971 4.985077 4.977033 
1 1 1   14    8   24 o   51.445   4.2325   55.307   8.8825   46.055   12.582   64.501   12.542   47.098   6.4770   55.792   5.4503 -8.693897 8.465071 
1 1 1   14    8   25 o  131.176   3.6452  355.169   19.563  366.005   29.802  346.965   25.932  132.895   5.4371  129.457   4.8567 3.438721 7.290402 
1 1 1   14    8   26 o   34.396   6.0749   25.549   8.6705   31.185   12.507   20.333   12.031   37.939   8.2295   30.854   8.9381 7.084658 12.14972 
1 1 1   14    8   27 f   87.810   9.5064  196.389   15.682  201.154   16.280  135.164   58.361   98.612   4.0029   77.009   18.587 21.60297 19.01288 
1 1 1   14    8   28 o  161.496   3.3288  540.548   22.172  542.078   31.296  539.007   31.416  161.728   4.6918  161.264   4.7233 0.4640045 6.657504 
1 1 1   14    8   29 o  128.086   3.7802  340.853   19.966  350.951   28.356  330.925   28.117  129.978   5.2894  126.195   5.4021 3.782608 7.560449 
1 1 1   14    8   30 o   84.501   4.0709  147.938   12.891  146.893   15.293  150.502   23.959   84.158   4.4058   84.845   6.8468 -0.6868210 8.141839 
1 1 1   14    8   31 o  109.159   3.9100  245.394   16.677  239.046   20.413  258.138   28.921  107.246   4.6149  111.072   6.3131 -3.825935 7.819983 
1 1 1   14    8   32 o  221.199   3.4994  1023.54   31.810  959.672   45.983  1082.16   44.052  214.434   5.1992  227.963   4.6853 -13.52885 6.998826 
1 1 1   14    8   33 o   60.872   5.8131   86.198   12.300   94.660   14.716   66.586   22.404   67.242   5.3062   54.503   10.345 12.73966 11.62625 
1 1 1   14    8   34 o   34.440   7.5723   23.162   10.468   19.938   11.931   33.938   21.815   30.111   8.9505   38.769   12.217 -8.657829 15.14467 
1 1 1   14    8   35 o   39.020   7.4599   33.883   10.970   33.273   12.498   35.931   22.897   38.617   8.1052   39.423   12.526 -0.8066864 14.91985 
1 1 1   14    8   36 o   73.190   9.7178  120.854   15.458  119.339   16.090  139.010   55.713   75.246   5.1845   71.133   18.731 4.112595 19.43556 
1 1 1   14    8   37 o   27.280   7.4736   10.690   10.195   8.3660   11.487   19.308   22.118   22.727   8.7263   31.832   12.136 -9.104944 14.94728 
1 1 1   14    8   38 o   36.877   6.9516   35.035   10.829   40.815   12.298   15.093   22.845   43.506   6.8539   30.249   12.096 13.25696 13.90315 
1 1 1   14    8   39 o   19.450   6.4906  -9.6896   10.511  -8.3965   11.643 -15.3877   24.440   16.023   7.4219   22.877   10.650 -6.854229 12.98117 
1 1 1   14    8   40 o   18.840   6.4288 -27.2975   14.999 -29.0203   21.026 -25.5125   21.403   18.455   8.9408   19.225   9.2402 -0.7694588 12.85768 
1 1 1   14    8   41 o   54.995   6.9202   82.849   13.030   97.975   15.554   47.258   23.859   67.479   5.5887   42.512   12.662 24.96693 13.84038 
1 1 1   14    8   42 o   29.517   7.6624   18.513   10.695   17.560   12.047   22.057   23.231   27.544   9.1124   31.490   12.321 -3.946432 15.32486 
1 1 1   14    8   43 o   36.729   7.0159   39.875   12.431   49.191   13.949   3.9286   27.400   46.637   7.2517   26.820   12.013 19.81656 14.03178 
1 1 1   14    8   44 o   22.711   6.9517   5.3173   11.199   10.502   12.281 -20.2791   27.286   23.239   8.9956   22.184   10.601 1.054735 13.90331 
1 1 1   14    8   45 o   41.715   8.2038   52.324   14.066   55.342   15.390   37.014   34.660   48.681   7.6651   34.748   14.507 13.93321 16.40762 
1 1 1   14    8   46 o   60.931   8.3704  122.575   16.593  136.226   18.692   71.825   36.040   78.104   5.8024   43.758   15.703 34.34571 16.74084 
1 1 1   14    8   47 o   30.204   9.4107   23.632   23.265   42.513   33.919   6.8566   31.972   33.996   14.283   26.413   12.257 7.583431 18.82132 
1 1 1   14    9    0 o  364.450   2.9027  2741.27   61.687  2741.27   61.687  2741.27   61.687  364.450   4.1050  364.450   4.1050 0.000000 0.000000 
1 1 1   14    9    1 o  118.710   2.2141  291.979   10.721  299.707   14.255  281.915   16.268  120.530   2.8675  116.889   3.3743 3.641182 4.428170 
1 1 1   14    9    2 o  487.875   3.8850  4915.12   77.344  4911.87  102.190  4919.47  118.342  487.738   5.0799  488.012   5.8795 -0.2744141 7.770080 
1 1 1   14    9    3 f  324.652   3.2971  2178.85   41.695  2166.73   71.862  2184.99   51.192  323.914   5.3790  325.390   3.8145 -1.475891 6.594248 
1 1 1   14    9    4 o  302.812   3.1741  1893.53   37.359  1890.81   64.732  1894.89   45.746  302.599   5.1866  303.026   3.6602 -0.4272156 6.348106 
1 1 1   14    9    5 o  124.366   2.3715  319.122   12.163  317.508   17.068  320.787   17.338  124.047   3.3360  124.685   3.3714 -0.6381073 4.742922 
1 1 1   14    9    6 o  174.810   2.4338  630.586   17.547  630.867   24.718  630.300   24.914  174.850   3.4275  174.770   3.4563 0.7937622E-01 4.867660 
1 1 1   14    9    7 o  100.602   2.3480  207.037   9.5895  218.756   15.126  199.162   12.400  102.957   3.5621   98.247   3.0600 4.710037 4.695994 
1 1 1   14    9    8 o  175.188   2.2976  633.185   16.397  634.104   25.254  632.515   21.560  175.289   3.4931  175.086   2.9856 0.2027435 4.595207 
1 1 1   14    9    9 o   53.777   2.9339   60.285   6.3891   74.232   9.1044   46.752   8.9684   59.972   3.6808   47.583   4.5698 12.38865 5.867778 
1 1 1   14    9   10 o   61.844   3.2440   78.902   8.2701   75.674   11.502   82.357   11.900   60.536   4.6066   63.153   4.5686 -2.617332 6.487940 
1 1 1   14    9   11 o  205.533   3.0105  871.251   25.271  879.305   38.608  865.213   33.426  206.346   4.5365  204.720   3.9588 1.625870 6.020922 
1 1 1   14    9   12 o  293.179   2.8408  1770.73   34.046  1804.03   51.934  1745.63   45.086  295.569   4.2602  290.789   3.7593 4.779846 5.681638 
1 1 1   14    9   13 o  290.714   2.7971  1745.30   33.272  1743.41   50.307  1746.77   44.360  290.551   4.1980  290.877   3.6976 -0.3260803 5.594210 
1 1 1   14    9   14 o  108.813   2.6125  243.350   11.665  280.679   17.085  210.756   15.965  116.599   3.5527  101.027   3.8314 15.57117 5.225079 
1 1 1   14    9   15 o  165.364   3.2254  565.047   21.995  559.445   30.808  570.872   31.413  164.530   4.5400  166.198   4.5826 -1.668488 6.450760 
1 1 1   14    9   16 o  160.079   2.5041  527.535   16.376  517.647   21.622  540.838   25.080  158.339   3.3109  161.819   3.7577 -3.479828 5.008258 
1 1 1   14    9   17 o   26.789   6.3706   12.584   8.1072   8.8858   10.052   19.466   13.712   22.818   8.2790   30.759   9.6849 -7.940836 12.74124 
1 1 1   14    9   18 o  136.600   2.3968  385.267   13.503  390.699   19.196  379.947   18.997  137.553   3.3836  135.647   3.3955 1.906509 4.793521 
1 1 1   14    9   19 o  224.948   2.4681  1045.13   22.898  1043.35   32.188  1046.96   32.580  224.756   3.4723  225.140   3.5086 -0.3847046 4.936276 
1 1 1   14    9   20 o  184.599   2.3786  703.677   18.108  689.366   25.442  718.368   25.779  182.697   3.3764  186.502   3.3513 -3.805588 4.757275 
1 1 1   14    9   21 o  270.794   3.4283  1536.45   37.730  1377.65   56.578  1663.63   50.632  257.942   5.3181  283.647   4.3279 -25.70468 6.856638 
1 1 1   14    9   22 f  208.554   2.6134  898.404   22.377  902.985   33.312  894.636   30.208  209.018   3.8641  208.089   3.5197 0.9286652 5.226841 
1 1 1   14    9   23 o  112.471   2.7763  259.299   12.758  277.032   19.671  246.424   16.762  115.749   4.1205  109.194   3.7219 6.554573 5.552552 
1 1 1   14    9   24 o  129.341   3.3417  346.253   17.827  347.580   25.241  344.932   25.181  129.589   4.7224  129.094   4.7294 0.4951935 6.683496 
1 1 1   14    9   25 o   64.342   4.9003   93.619   11.558   68.022   20.141  106.187   14.113   57.069   8.5569   71.615   4.7782 -14.54600 9.800581 
1 1 1   14    9   26 o   30.380   6.1161   18.984   8.3010   27.459   12.284   11.862   11.261   35.553   8.4937   25.207   8.8025 10.34601 12.23222 
1 1 1   14    9   27 o  150.704   6.1016  505.955   27.780  521.910   30.591  430.921   66.341  158.726   4.6729  142.683   11.273 16.04274 12.20318 
1 1 1   14    9   28 o  120.395   3.6533  297.748   18.047  268.089   24.119  335.476   27.203  113.656   5.1452  127.134   5.1878 -13.47774 7.306587 
1 1 1   14    9   29 o   61.157   5.1835   76.515   11.815   74.223   13.894   82.502   22.454   59.726   5.6401   62.588   8.6984 -2.861866 10.36693 
1 1 1   14    9   30 o   49.995   6.5666   59.117   11.466   65.244   13.489   43.167   21.765   55.951   5.8453   44.040   11.761 11.91135 13.13313 
1 1 1   14    9   31 o   41.776   6.1986   20.079   10.422   3.9739   11.674   83.306   23.130   21.017   8.5595   62.535   8.9679 -41.51862 12.39713 
1 1 1   14    9   32 o   56.738   6.8909   72.036   15.376   87.140   21.226   55.361   22.303   64.018   8.0389   49.457   11.194 14.56072 13.78185 
1 1 1   14    9   33 o   82.430   4.4281  148.768   13.832  158.884   16.915  128.349   24.032   87.221   4.7020   77.639   7.5050 9.581238 8.856279 
1 1 1   14    9   34 o   50.182   6.0867   49.084   11.098   42.130   12.832   69.733   22.110   44.553   6.9829   55.810   9.9714 -11.25703 12.17332 
1 1 1   14    9   35 o   19.447   6.3584  -7.8022   9.7082  -8.2109   10.947  -6.2962   21.013   15.584   7.2109   23.311   10.475 -7.727356 12.71674 
1 1 1   14    9   36 o   38.106   9.6280   29.558   12.316   30.177   12.671   18.984   52.394   36.470   8.5688   39.741   17.244 -3.271019 19.25608 
1 1 1   14    9   37 o   84.827   4.1077  144.825   13.209  133.773   15.587  172.987   24.881   79.780   4.7369   89.874   6.7123 -10.09445 8.215373 
1 1 1   14    9   38 o   29.745   7.3213   19.428   10.316   21.312   11.766   13.162   21.458   30.520   8.8383   28.970   11.674 1.549845 14.64266 
1 1 1   14    9   39 o   38.281   7.5069   33.638   10.762   32.877   12.110   36.498   23.474   38.006   7.9793   38.555   12.718 -0.5490074 15.01382 
1 1 1   14    9   40 o   26.152   7.6587  -0.4789   15.267 -23.9090   21.301   24.274   21.893   19.405   9.2980   32.899   12.173 -13.49447 15.31748 
1 1 1   14    9   41 o   54.115   6.9602   82.358   13.066   99.533   15.648   42.810   23.745   67.946   5.5838   40.284   12.751 27.66251 13.92048 
1 1 1   14    9   42 o   30.730   7.7611   19.685   10.906   16.439   12.434   30.513   22.710   26.868   9.2571   34.592   12.460 -7.724234 15.52223 
1 1 1   14    9   43 o   43.885   7.9782   43.364   12.701   35.860   14.403   69.606   26.935   38.056   9.2636   49.714   12.992 -11.65818 15.95632 
1 1 1   14    9   44 o   50.056   9.9593   49.159   13.375   42.880   13.926  123.902   48.046   42.302   8.2779   57.810   18.117 -15.50813 19.91855 
1 1 1   14    9   45 o   53.616   8.5337   83.890   15.369   85.702   17.033   75.951   35.655   61.286   6.7385   45.947   15.681 15.33949 17.06734 
1 1 1   14    9   46 f   22.220   7.4683  -7.1730   11.475 -10.7522   12.274   17.692   32.350   15.232   7.2308   29.209   13.070 -13.97675 14.93652 
1 1 1   14    9   47 f   27.180   8.7704   10.404   22.638  -9.5299   33.195   27.735   30.953   24.078   11.556   30.282   13.196 -6.203506 17.54085 
1 1 1   14   10    0 o  627.121   4.4351  8120.98  162.196  8120.98  162.196  8120.98  162.196  627.121   6.2722  627.121   6.2722 0.000000 0.000000 
1 1 1   14   10    1 o   84.154   2.7824  144.808   9.4621  139.722   12.120  152.745   15.141   82.285   3.5713   86.022   4.2676 -3.736992 5.564778 
1 1 1   14   10    2 o  230.753   2.2770  1098.46   21.668  1113.94   30.907  1083.50   30.387  232.350   3.2251  229.155   3.2151 3.195877 4.553925 
1 1 1   14   10    3 o  117.402   2.1960  282.283   10.556  268.110   13.968  301.152   16.118  113.995   2.9710  120.810   3.2347 -6.815002 4.391999 
1 1 1   14   10    4 o  202.644   2.1749  846.735   18.171  867.053   26.140  827.737   25.276  204.994   3.0918  200.293   3.0597 4.700516 4.349818 
1 1 1   14   10    5 o  152.419   2.2345  481.405   13.932  461.855   20.845  497.191   18.731  149.604   3.3783  155.234   2.9256 -5.630280 4.468970 
1 1 1   14   10    6 o  286.441   2.9087  1690.34   34.307  1638.23   46.928  1750.17   50.280  281.714   4.0389  291.169   4.1868 -9.455170 5.817379 
1 1 1   14   10    7 o  367.883   3.3828  2793.77   51.307  2756.78   71.383  2833.29   73.795  365.371   4.7369  370.396   4.8305 -5.025238 6.765546 
1 1 1   14   10    8 o  188.422   2.3343  724.229   17.789  774.323   28.467  692.135   22.786  193.696   3.5633  183.148   3.0164 10.54715 4.668644 
1 1 1   14   10    9 o  139.764   2.2588  399.439   12.833  423.995   20.170  382.741   16.633  143.333   3.4120  136.194   2.9611 7.138519 4.517659 
1 1 1   14   10   10 o   71.575   2.7385  105.908   7.8338  105.150   12.742  106.369   9.9327   71.359   4.3294   71.790   3.3546 -0.4315643 5.476918 
1 1 1   14   10   11 f  169.108   2.4013  589.764   16.676  595.620   24.820  584.946   22.514  169.866   3.5427  168.350   3.2425 1.515823 4.802570 
1 1 1   14   10   12 o   56.513   3.5518   66.908   8.1544   59.188   12.182   73.175   10.977   53.507   5.5199   59.520   4.4714 -6.012863 7.103655 
1 1 1   14   10   13 o  183.681   2.3664  697.887   17.766  685.520   26.868  707.496   23.683  182.219   3.5750  185.143   3.1014 -2.923950 4.732824 
1 1 1   14   10   14 o  181.475   3.4468  683.670   25.624  708.847   34.678  653.389   38.031  185.200   4.5398  177.750   5.1876 7.450607 6.893538 
1 1 1   14   10   15 o  236.474   2.5987  1155.76   25.256  1144.43   37.223  1165.43   34.382  235.383   3.8341  237.564   3.5090 -2.181427 5.197473 
1 1 1   14   10   16 o  121.081   3.3825  299.759   16.558  287.153   21.204  319.462   26.510  117.880   4.3612  124.282   5.1716 -6.402489 6.765044 
1 1 1   14   10   17 o  210.603   2.4089  915.848   20.923  923.935   29.638  907.814   29.542  211.530   3.3972  209.675   3.4161 1.854996 4.817721 
1 1 1   14   10   18 o  188.165   2.3549  731.169   18.275  730.865   25.678  731.482   26.013  188.127   3.3094  188.203   3.3512 -0.7617188E-01 4.709878 
1 1 1   14   10   19 o  222.852   2.5944  1025.92   23.716  1026.55   35.445  1025.41   31.911  222.893   3.8557  222.810   3.4724 0.8287048E-01 5.188825 
1 1 1   14   10   20 o  260.535   2.7725  1404.81   29.569  1385.88   44.475  1419.81   39.583  258.924   4.1647  262.146   3.6610 -3.221893 5.545056 
1 1 1   14   10   21 f  141.152   2.8522  409.670   16.344  424.106   25.672  399.832   21.194  143.203   4.3465  139.100   3.6943 4.103928 5.704347 
1 1 1   14   10   22 o  139.357   3.0921  401.676   17.762  383.613   24.982  420.141   25.259  136.181   4.4479  142.532   4.2967 -6.350845 6.184254 
1 1 1   14   10   23 o   91.938   3.0415  174.743   11.473  175.723   17.145  173.949   15.439   92.157   4.5107   91.718   4.0813 0.4388580 6.083008 
1 1 1   14   10   24 o  109.451   2.7488  247.667   12.409  249.102   17.583  246.243   17.514  109.767   3.8839  109.135   3.8910 0.6321945 5.497674 
1 1 1   14   10   25 o  255.341   2.9353  1348.62   30.911  1360.50   44.056  1337.11   43.381  256.446   4.1652  254.237   4.1371 2.208679 5.870650 
1 1 1   14   10   26 o   62.950   4.6799   79.925   11.523   75.003   14.017   90.187   20.239   60.122   5.6527   65.778   7.4600 -5.655853 9.359763 
1 1 1   14   10   27 o  101.486   7.0712  175.166   15.845  168.444   16.380  273.088   62.520   90.180   4.4039  112.793   13.439 -22.61327 14.14238 
1 1 1   14   10   28 o  126.505   3.5665  332.254   18.532  332.616   25.109  331.820   27.467  126.619   4.8080  126.391   5.2690 0.2277679 7.132981 
1 1 1   14   10   29 o  158.693   3.3379  520.784   21.753  502.893   29.233  542.984   32.563  155.687   4.5525  161.700   4.8826 -6.013245 6.675700 
1 1 1   14   10   30 o   98.797   5.0789  205.333   20.496  202.496   31.091  207.514   27.258   98.062   7.6871   99.531   6.6399 -1.469261 10.15773 
1 1 1   14   10   31 o   73.203   4.6452  119.374   12.371  128.768   14.776   97.353   22.624   78.663   4.5543   67.743   8.0975 10.92091 9.290380 
1 1 1   14   10   32 o   32.824   8.1563   20.081   14.253   9.2394   19.708   31.973   20.639   27.746   11.186   37.902   11.874 -10.15630 16.31261 
1 1 1   14   10   33 o  102.696   3.7195  211.427   14.941  192.689   18.098  251.528   26.475   96.068   4.5676  109.323   5.8716 -13.25523 7.439021 
1 1 1   14   10   34 o   78.512   5.3282  131.648   17.126  111.417   23.626  154.053   24.862   72.003   7.9555   85.021   7.0900 -13.01741 10.65642 
1 1 1   14   10   35 o   60.085   6.4338   83.774   12.435   86.569   14.125   74.151   26.213   64.051   5.3470   56.118   11.704 7.933262 12.86756 
1 1 1   14   10   36 o   26.818   7.3706   8.9131   9.8995   5.5824   11.136   21.466   21.618   21.088   8.4409   32.549   12.085 -11.46163 14.74127 
1 1 1   14   10   37 o   36.513   6.8191   35.111   10.686   41.892   12.043   10.014   23.168   44.205   6.6053   28.820   11.932 15.38463 13.63821 
1 1 1   14   10   38 o   28.978   7.6773   16.157   11.062   16.171   12.582   16.109   23.214   27.374   9.3153   30.582   12.206 -3.208309 15.35460 
1 1 1   14   10   39 o   41.460   7.2020   43.605   11.375   47.247   12.995   31.660   23.531   46.638   6.7555   36.281   12.721 10.35756 14.40390 
1 1 1   14   10   40 o   25.614   7.6038  -1.1675   15.410   22.066   21.370 -26.3340   22.242   31.738   11.970   19.490   9.3809 12.24790 15.20763 
1 1 1   14   10   41 o   28.561   7.6076   13.689   10.697   8.9635   12.211   29.277   22.178   22.823   8.9322   34.298   12.317 -11.47462 15.21513 
1 1 1   14   10   42 o   52.386   7.3844   83.402   13.335   96.786   15.261   40.197   27.420   66.785   5.5405   37.987   13.690 28.79818 14.76879 
1 1 1   14   10   43 o   35.705   7.6506   36.024   12.471   40.898   14.143   18.982   26.443   41.171   8.6058   30.238   12.652 10.93346 15.30117 
1 1 1   14   10   44 o   55.382   8.2732  117.296   15.779  127.414   16.657   28.806   49.260   76.390   5.2867   34.374   15.679 42.01695 16.54647 
1 1 1   14   10   45 o   29.973   8.4422   21.731   13.149   21.305   14.290   24.079   33.573   28.771   9.9235   31.176   13.660 -2.404964 16.88443 
1 1 1   14   10   46 o   28.375   7.8987   21.497   13.214   24.687   14.738   8.4246   29.835   30.145   10.083   26.605   12.161 3.540571 15.79749 
1 1 1   14   10   47 o   22.706   7.6931 -23.6236   21.883 -66.2650   31.747   14.976   30.204   18.099   9.1250   27.313   12.388 -9.214197 15.38622 
1 1 1   14   11    0 o   66.274   2.4730   91.365   9.4992   91.365   9.4992   91.365   9.4992   66.274   3.4974   66.274   3.4974 0.000000 0.000000 
1 1 1   14   11    1 o  239.345   2.3037  1182.09   22.741  1186.69   32.251  1177.53   32.071  239.808   3.2608  238.882   3.2551 0.9268951 4.607394 
1 1 1   14   11    2 o  359.223   2.8724  2663.71   42.557  2656.86   59.977  2670.64   60.396  358.759   4.0533  359.687   4.0711 -0.9274597 5.744894 
1 1 1   14   11    3 o  312.894   2.6387  2020.44   34.050  2004.83   47.755  2036.57   48.562  311.666   3.7150  314.121   3.7483 -2.455200 5.277449 
1 1 1   14   11    4 o  334.457   2.9610  2310.36   40.475  2301.51   61.461  2317.14   53.784  333.866   4.4633  335.047   3.8920 -1.180969 5.921943 
1 1 1   14   11    5 o   55.514   2.9809   63.167   6.7807   67.475   10.314   59.887   8.9987   57.167   4.3743   53.861   4.0508 3.306049 5.961863 
1 1 1   14   11    6 o   37.740   3.9910   29.765   5.9480   22.632   8.1066   38.082   8.7541   32.541   6.2674   42.939   4.9430 -10.39785 7.982056 
1 1 1   14   11    7 o  117.664   2.3906  280.675   11.498  333.706   17.636  241.470   15.164  127.160   3.3627  108.168   3.3989 18.99249 4.781236 
1 1 1   14   11    8 o  136.650   2.0678  385.268   11.653  389.773   16.589  380.879   16.374  137.438   2.9264  135.861   2.9221 1.576996 4.135505 
1 1 1   14   11    9 o  272.089   2.5760  1514.86   27.741  1575.22   46.705  1481.96   34.482  276.204   4.0998  267.974   3.1199 8.230164 5.151917 
1 1 1   14   11   10 o  221.508   2.6031  1007.26   23.677  1071.06   35.558  956.437   31.735  227.767   3.7851  215.248   3.5746 12.51904 5.206254 
1 1 1   14   11   11 o  103.820   3.0248  222.536   12.535  222.285   15.842  222.958   20.500  103.762   3.7018  103.879   4.7849 -0.1167526 6.049623 
1 1 1   14   11   12 o  366.482   3.4329  2771.22   51.769  2711.10   70.531  2841.44   76.225  362.202   4.7214  370.762   4.9847 -8.559784 6.865745 
1 1 1   14   11   13 o  207.517   2.3456  892.347   19.615  873.622   31.095  904.724   25.280  205.675   3.6655  209.359   2.9276 -3.683487 4.691198 
1 1 1   14   11   14 o  338.027   3.0341  2363.64   42.035  2338.00   62.903  2384.33   56.502  336.330   4.5346  339.725   4.0325 -3.395813 6.068250 
1 1 1   14   11   15 o  209.237   3.0654  890.984   25.158  861.920   30.864  948.529   43.429  204.290   3.6630  214.183   4.9162 -9.892822 6.130779 
1 1 1   14   11   16 o  223.681   2.6477  1037.91   24.178  1067.75   32.252  999.627   36.533  227.394   3.4389  219.967   4.0269 7.427048 5.295415 
1 1 1   14   11   17 o  205.535   2.3913  872.455   20.270  876.115   28.547  868.733   28.788  205.971   3.3604  205.098   3.4032 0.8733215 4.782651 
1 1 1   14   11   18 o  174.664   2.3601  630.051   17.001  629.575   23.937  630.536   24.151  174.598   3.3241  174.729   3.3512 -0.1311646 4.720143 
1 1 1   14   11   19 o  275.583   2.6158  1568.89   29.728  1556.82   41.654  1581.43   42.441  274.505   3.6791  276.660   3.7194 -2.154846 5.231601 
1 1 1   14   11   20 o   47.703   4.6907   49.269   8.7073   37.967   12.840   58.893   11.848   42.082   7.6806   53.325   5.3871 -11.24250 9.381433 
1 1 1   14   11   21 o  168.946   2.7313  589.198   18.626  593.628   29.602  586.294   23.965  169.432   4.2361  168.460   3.4491 0.9722290 5.462666 
1 1 1   14   11   22 o   66.492   4.0933   92.394   10.541   89.516   18.241   93.838   12.917   65.645   6.7372   67.339   4.6508 -1.693817 8.186545 
1 1 1   14   11   23 o  323.069   3.0762  2160.65   40.635  2147.59   61.551  2170.73   54.101  322.137   4.6327  324.002   4.0484 -1.865662 6.152348 
1 1 1   14   11   24 o   93.489   3.0507  181.749   11.686  171.362   17.244  190.570   15.891   90.985   4.5953   95.992   4.0138 -5.006691 6.101411 
1 1 1   14   11   25 o  249.697   2.9117  1289.54   29.982  1272.61   41.970  1307.19   42.846  248.026   4.1028  251.368   4.1327 -3.342239 5.823366 
1 1 1   14   11   26 o   92.774   3.9894  173.604   13.848  166.980   16.291  190.850   26.289   89.799   4.3986   95.750   6.6568 -5.950668 7.978801 
1 1 1   14   11   27 o  213.060   3.0534  944.167   26.683  983.258   36.350  898.494   39.292  217.921   4.0443  208.200   4.5757 9.721054 6.106800 
1 1 1   14   11   28 o  111.908   4.7819  284.927   16.661  299.300   18.586  226.136   37.590  120.232   3.7480  103.583   8.7988 16.64880 9.563769 
1 1 1   14   11   29 o  100.898   3.6185  203.938   13.847  192.892   16.400  231.367   25.843   96.458   4.1222  105.339   5.9482 -8.881554 7.236986 
1 1 1   14   11   30 o  105.977   3.7906  222.377   15.764  198.373   19.115  273.408   27.871   97.628   4.7472  114.326   5.9109 -16.69798 7.581163 
1 1 1   14   11   31 o   52.217   5.5745   53.590   11.011   47.799   12.908   69.061   21.099   47.655   6.5671   56.778   9.0096 -9.123005 11.14901 
1 1 1   14   11   32 o  146.104   3.4677  446.784   20.844  454.210   28.630  438.408   30.406  147.475   4.7069  144.732   5.0936 2.743240 6.935428 
1 1 1   14   11   33 o   66.917   4.9759   99.155   12.301  105.299   14.761   85.188   22.256   70.922   5.0462   62.911   8.5775 8.011066 9.951778 
1 1 1   14   11   34 o   76.901   4.6165  128.088   13.338  131.456   16.017  120.470   24.091   79.110   4.9089   74.693   7.8199 4.416786 9.233000 
1 1 1   14   11   35 o   93.613   5.0744  185.301   19.425  162.701   25.566  216.164   29.876   87.003   7.1246  100.224   7.2275 -13.22150 10.14871 
1 1 1   14   11   36 o   72.957   4.8257  115.746   12.959  117.957   15.331  110.211   24.256   74.849   4.9661   71.064   8.2758 3.784729 9.651457 
1 1 1   14   11   37 o  116.940   5.6040  280.148   26.046  203.411   32.659  414.256   43.174   96.090   8.2405  137.790   7.5969 -41.70037 11.20796 
1 1 1   14   11   38 o   80.950   4.7893  132.186   14.544  119.917   16.994  165.764   28.115   75.057   5.4897   86.843   7.8494 -11.78617 9.578626 
1 1 1   14   11   39 o   27.900   7.1487   16.938   10.425   20.920   11.815   2.9276   22.159   30.070   8.8995   25.731   11.190 4.338858 14.29735 
1 1 1   14   11   40 o   43.125   6.6987   56.788   11.974   71.355   13.791   12.162   24.138   57.468   5.8183   28.782   12.068 28.68645 13.39747 
1 1 1   14   11   41 o   29.179   7.5293   19.273   10.961   20.560   12.512   15.025   22.733   29.420   9.2493   28.938   11.883 0.4815636 15.05860 
1 1 1   14   11   42 o   60.429   7.3075   97.571   14.669  105.600   17.095   75.151   28.568   69.305   5.9805   51.552   13.335 17.75277 14.61491 
1 1 1   14   11   43 o   27.282   7.8710   12.131   11.510   9.2023   12.815   24.349   26.176   22.812   9.0804   31.751   12.859 -8.938425 15.74207 
1 1 1   14   11   44 o   57.910   7.0033   76.781   16.727   76.781   16.727   0.0000   0.0000   57.910   7.0033  ?   ?       ?      ? 
1 1 1   14   11   45 o   33.386   8.4883   31.698   13.664   32.487   14.990   27.823   33.221   34.955   9.9310   31.818   13.769 3.136385 16.97666 
1 1 1   14   11   46 o   20.065   8.7466   3.5139   13.607   3.5139   13.607   0.0000   0.0000   20.065   8.7466  ?   ?       ?      ? 
1 1 1   14   11   47 o   32.824   10.253   41.692   27.134   37.880   48.638   43.415   32.694   31.841   14.890   33.807   14.100 -1.965757 20.50673 
1 1 1   14   12    0 o   78.729   2.2895  128.511   10.473  128.511   10.473  128.511   10.473   78.729   3.2378   78.729   3.2378 0.000000 0.000000 
1 1 1   14   12    1 o  536.011   3.8788  5936.25   85.750  5933.27  121.183  5939.24  121.355  535.876   5.4829  536.145   5.4879 -0.2687378 7.757552 
1 1 1   14   12    2 o  313.210   2.6354  2024.78   34.043  2016.67   47.915  2033.05   48.376  312.578   3.7166  313.843   3.7372 -1.265015 5.270708 
1 1 1   14   12    3 o  497.070   3.6527  5100.85   74.823  5180.74  108.376  5028.08  103.430  500.773   5.2472  493.367   5.0829 7.406403 7.305388 
1 1 1   14   12    4 o  262.625   2.5865  1426.16   27.817  1401.49   41.719  1445.91   37.325  260.561   3.8820  264.688   3.4190 -4.127228 5.172940 
1 1 1   14   12    5 o  400.184   3.3436  3307.22   54.611  3310.75   83.500  3304.58   72.192  400.327   5.0572  400.041   4.3754 0.2850342 6.687236 
1 1 1   14   12    6 o  163.046   2.2641  550.332   15.083  535.495   22.783  561.910   20.126  161.074   3.4294  165.017   2.9570 -3.942886 4.528238 
1 1 1   14   12    7 o  224.725   2.4448  1044.30   22.472  1027.18   33.899  1057.73   30.014  223.065   3.6846  226.386   3.2145 -3.321289 4.889672 
1 1 1   14   12    8 f  206.632   2.3070  882.614   19.136  875.269   30.766  887.248   24.438  205.910   3.6226  207.355   2.8575 -1.445038 4.613949 
1 1 1   14   12    9 o  629.181   5.3188  8162.16  123.590  8291.58  235.401  8112.91  145.213  631.959   9.0314  626.402   5.6207 5.557251 10.63756 
1 1 1   14   12   10 o   79.919   2.5621  129.795   8.1912  140.195   13.546  123.801   10.284   82.393   3.9863   77.445   3.2197 4.948204 5.124147 
1 1 1   14   12   11 o  247.299   2.7739  1262.94   28.281  1256.00   39.394  1270.31   40.626  246.604   3.8732  247.995   3.9719 -1.391357 5.547710 
1 1 1   14   12   12 o   84.324   2.7009  147.075   9.3792  141.955   13.488  151.869   13.051   82.897   3.9451   85.752   3.6900 -2.854988 5.401831 
1 1 1   14   12   13 o  139.301   2.2229  400.664   12.449  400.318   19.972  400.884   15.920  139.235   3.4778  139.367   2.7696 -0.1320496 4.445864 
1 1 1   14   12   14 o   71.705   2.7208  106.188   7.8351  106.262   12.609  106.142   9.9999   71.712   4.2632   71.698   3.3816 0.1418304E-01 5.441574 
1 1 1   14   12   15 o  237.053   3.1711  1166.04   30.021  1180.15   38.098  1142.94   48.759  239.020   3.8646  235.085   5.0288 3.935226 6.342213 
1 1 1   14   12   16 o  278.525   3.1522  1607.99   34.364  1617.24   42.441  1590.39   58.554  279.802   3.6777  277.247   5.1207 2.554230 6.304471 
1 1 1   14   12   17 o   59.647   3.8156   73.525   9.0515   73.177   11.371   74.127   14.955   59.485   4.6346   59.809   6.0625 -0.3246498 7.631112 
1 1 1   14   12   18 o  181.380   2.6195  677.763   19.235  669.712   24.854  689.785   30.372  180.072   3.3465  182.688   4.0308 -2.616058 5.238921 
1 1 1   14   12   19 o  176.998   2.5468  648.498   18.424  638.105   27.879  656.558   24.550  175.712   3.8469  178.283   3.3386 -2.570755 5.093640 
1 1 1   14   12   20 o   49.667   4.1371   51.124   8.4687   48.534   11.875   53.804   12.080   48.383   5.9510   50.951   5.7486 -2.568100 8.274114 
1 1 1   14   12   21 o  197.811   2.4300  808.324   19.824  818.711   28.251  798.249   27.823  199.062   3.4410  196.559   3.4320 2.502304 4.859943 
1 1 1   14   12   22 o  142.124   2.8180  416.654   16.064  421.846   26.014  413.454   20.423  142.796   4.4171  141.452   3.5006 1.343521 5.635994 
1 1 1   14   12   23 o  337.332   3.1300  2356.08   43.294  2341.84   64.720  2367.61   58.244  336.345   4.6654  338.319   4.1741 -1.974182 6.260087 
1 1 1   14   12   24 o  255.297   2.8246  1349.66   29.526  1334.35   44.383  1361.80   39.546  253.950   4.2374  256.644   3.7360 -2.693344 5.649175 
1 1 1   14   12   25 o   79.306   3.2028  130.348   10.451  119.204   14.692  141.764   14.870   75.859   4.6957   82.753   4.3567 -6.893356 6.405558 
1 1 1   14   12   26 o   86.581   4.2895  158.495   13.903  162.264   16.613  149.689   25.395   88.489   4.5519   84.673   7.2718 3.815720 8.578991 
1 1 1   14   12   27 o   30.941   6.9155   11.979   9.8956   2.3671   11.573   38.109   19.082   20.313   8.4234   41.569   10.970 -21.25624 13.83104 
1 1 1   14   12   28 o  149.140   3.9064  459.737   19.399  457.576   21.742  468.172   42.956  148.680   3.5455  149.599   6.9619 -0.9185944 7.812744 
1 1 1   14   12   29 o   89.055   3.9987  157.995   14.139  139.858   17.391  193.351   24.282   81.950   5.1454   96.161   6.1224 -14.21091 7.997383 
1 1 1   14   12   30 o   30.504   6.5289   21.668   10.185   30.936   11.776  -5.8473   20.290   37.559   7.8542   23.449   10.432 14.10959 13.05774 
1 1 1   14   12   31 o  104.439   3.5924  230.208   14.486  234.459   17.722  221.645   25.150  106.165   4.0472  102.714   5.9366 3.451469 7.184897 
1 1 1   14   12   32 o   34.583   8.2762   24.635   14.408   15.605   19.923   34.534   20.861   30.176   11.514   38.989   11.891 -8.813396 16.55231 
1 1 1   14   12   33 o   29.785   7.1954   11.054   10.273   2.4346   11.951   35.444   20.104   20.330   8.5058   39.239   11.608 -18.90851 14.39080 
1 1 1   14   12   34 o   67.592   5.1058  100.324   12.794  103.431   15.257   92.963   23.485   70.032   5.2820   65.152   8.7395 4.879906 10.21169 
1 1 1   14   12   35 o   33.273   7.5478   23.658   10.415   22.742   11.823   26.828   22.000   31.665   8.7583   34.882   12.295 -3.216595 15.09563 
1 1 1   14   12   36 o   73.848   5.8683  119.544   17.652   97.307   24.529  143.429   25.422   66.356   8.9626   81.340   7.5777 -14.98416 11.73667 
1 1 1   14   12   37 o   44.875   8.6271   50.747   13.489   52.532   14.456   38.731   37.509   49.196   7.1243   40.555   15.715 8.640743 17.25426 
1 1 1   14   12   38 o   55.538   6.2682   72.881   12.030   76.286   14.129   63.904   22.940   59.700   5.7379   51.377   11.146 8.323257 12.53636 
1 1 1   14   12   39 o   18.945   6.3076  -8.9166   9.6189  -9.1509   10.659  -7.8887   22.325   14.863   6.9569   23.026   10.523 -8.163081 12.61517 
1 1 1   14   12   40 o   48.127   6.9427   59.391   11.807   63.863   13.731   46.699   23.132   54.148   6.1481   42.107   12.450 12.04142 13.88546 
1 1 1   14   12   41 o   29.944   8.4007   17.469   15.792   7.8826   21.555   28.576   23.202   26.166   11.204   33.722   12.520 -7.556023 16.80145 
1 1 1   14   12   42 o   28.461   7.8877   7.8615   11.386  -0.0840   12.655   41.644   26.093   18.942   8.3411   37.980   13.390 -19.03789 15.77540 
1 1 1   14   12   43 o   46.751   7.3326   67.524   13.118   78.258   14.981   32.251   27.157   59.388   6.1162   34.114   13.329 25.27459 14.66530 
1 1 1   14   12   44 o   31.338   10.036   25.896   14.675   25.896   14.675   0.0000   0.0000   31.338   10.036  ?   ?       ?      ? 
1 1 1   14   12   45 o   28.871   8.4988   16.067   13.223   11.463   14.530   38.262   31.903   23.755   9.5949   33.987   14.031 -10.23145 16.99767 
1 1 1   14   12   46 o   37.608   7.5894   48.880   14.762   59.335   16.733   12.191   31.347   48.157   8.7470   27.060   12.405 21.09705 15.17874 
1 1 1   14   13    0 o  360.265   2.8771  2679.21   60.442  2679.21   60.442  2679.21   60.442  360.265   4.0689  360.265   4.0689 0.000000 0.000000 
1 1 1   14   13    1 o  131.297   2.0386  355.397   11.034  340.209   15.362  371.579   15.857  128.402   2.9008  134.192   2.8651 -5.790237 4.077178 
1 1 1   14   13    2 o  105.544   2.2819  227.616   9.8027  243.510   15.355  216.682   12.736  108.618   3.4275  102.470   3.0134 6.147766 4.563833 
1 1 1   14   13    3 o  300.768   2.7794  1870.92   34.230  1839.80   51.366  1895.77   45.910  298.493   4.1723  303.043   3.6731 -4.550842 5.558794 
1 1 1   14   13    4 o   68.550   2.6241   96.897   7.3363   97.747   11.270   96.273   9.6640   68.805   3.9715   68.294   3.4309 0.5103683 5.248213 
1 1 1   14   13    5 f  150.066   2.0617  464.717   12.761  461.723   18.017  467.732   18.076  149.581   2.9203  150.551   2.9111 -0.9705505 4.123481 
1 1 1   14   13    6 o  199.291   2.3519  822.027   19.163  802.069   28.896  837.696   25.602  197.113   3.5543  201.469   3.0811 -4.355942 4.703830 
1 1 1   14   13    7 f  155.737   2.2601  501.571   14.357  493.957   21.912  507.299   19.004  154.689   3.4344  156.785   2.9389 -2.096191 4.520180 
1 1 1   14   13    8 o  142.539   2.2004  422.491   12.653  403.617   19.858  435.392   16.417  139.825   3.4434  145.253   2.7404 -5.428299 4.400795 
1 1 1   14   13    9 o  197.638   2.2781  804.149   18.032  815.546   29.329  797.222   22.865  198.737   3.5781  196.539   2.8206 2.197754 4.556197 
1 1 1   14   13   10 o  179.742   2.2521  670.352   16.330  650.292   25.741  683.864   21.126  177.458   3.5169  182.025   2.8140 -4.566895 4.504121 
1 1 1   14   13   11 o  457.988   3.7237  4342.60   69.845  4305.63  104.946  4372.00   93.580  456.152   5.5781  459.825   4.9343 -3.672302 7.447328 
1 1 1   14   13   12 o  152.702   2.3713  480.536   14.871  491.101   22.179  471.907   20.045  154.216   3.4870  151.187   3.2146 3.028671 4.742603 
1 1 1   14   13   13 o  310.213   2.7519  1992.16   34.311  1968.26   54.922  2007.46   43.942  308.625   4.3147  311.801   3.4169 -3.176758 5.503788 
1 1 1   14   13   14 o  166.691   2.6509  576.264   17.325  566.397   29.371  581.529   21.454  165.549   4.3015  167.832   3.0994 -2.283234 5.301815 
1 1 1   14   13   15 o   98.029   3.9701  201.837   15.041  207.509   18.453  190.610   25.962  100.183   4.4658   95.875   6.5654 4.307861 7.940273 
1 1 1   14   13   16 o   96.966   3.2274  201.115   11.990  214.298   14.757  175.513   20.565  101.856   3.5128   92.076   5.4152 9.779961 6.454792 
1 1 1   14   13   17 o  164.180   2.5085  555.980   16.848  550.272   22.390  563.432   25.582  163.227   3.3258  165.133   3.7561 -1.905777 5.016908 
1 1 1   14   13   18 o  192.005   2.3834  761.480   18.873  773.803   26.810  749.374   26.573  193.546   3.3586  190.464   3.3827 3.081879 4.766839 
1 1 1   14   13   19 o  118.249   2.7792  289.780   13.517  275.310   19.529  303.087   18.729  115.396   4.1032  121.102   3.7497 -5.706924 5.558480 
1 1 1   14   13   20 o   98.817   2.7336  201.606   11.127  197.309   15.288  206.447   16.225   97.703   3.7938   99.931   3.9367 -2.227951 5.467199 
1 1 1   14   13   21 o   87.940   2.9518  159.727   10.696  155.497   14.732  164.441   15.553   86.714   4.1192   89.167   4.2291 -2.452492 5.903645 
1 1 1   14   13   22 o   96.086   3.3761  188.970   13.064  200.984   21.150  181.559   16.613   98.492   5.2065   93.681   4.2995 4.811256 6.752291 
1 1 1   14   13   23 o   67.787   4.2033   95.790   11.032   96.597   13.490   94.158   19.172   68.297   4.7889   67.277   6.9093 1.020340 8.406621 
1 1 1   14   13   24 o   90.456   3.7416  167.277   13.603  159.587   17.215  180.060   22.196   87.775   4.7552   93.137   5.7781 -5.362144 7.483202 
1 1 1   14   13   25 o  150.585   3.1022  472.630   19.100  443.315   28.421  496.774   25.793  146.249   4.7117  154.920   4.0367 -8.670883 6.204416 
1 1 1   14   13   26 o  221.047   3.0553  1016.25   27.744  1070.67   38.266  955.948   40.282  227.366   4.0806  214.728   4.5484 12.63809 6.110622 
1 1 1   14   13   27 o  106.503   3.9993  236.646   17.523  220.124   24.989  252.630   24.579  102.795   5.8940  110.211   5.4072 -7.416519 7.998596 
1 1 1   14   13   28 o  105.847   4.9368  229.696   15.998  227.196   17.475  242.634   39.751  104.674   4.0478  107.020   9.0057 -2.345497 9.873563 
1 1 1   14   13   29 o  115.613   4.5514  282.033   21.453  269.235   32.471  291.947   28.578  113.103   6.9608  118.122   5.8659 -5.019760 9.102801 
1 1 1   14   13   30 o   43.744   6.2736   35.334   10.554   24.039   12.479   63.718   19.781   32.940   8.9515   54.549   8.7923 -21.60918 12.54726 
1 1 1   14   13   31 o   86.672   4.0937  162.506   13.420  170.345   16.283  145.906   23.695   90.384   4.3680   82.960   6.9250 7.423653 8.187478 
1 1 1   14   13   32 o   46.410   6.4386   46.310   11.139   44.559   13.272   50.482   20.484   45.807   7.0251   47.013   10.792 -1.206188 12.87715 
1 1 1   14   13   33 o   77.320   5.0994  128.048   16.182  111.692   22.353  146.060   23.456   72.007   7.5264   82.633   6.8824 -10.62599 10.19875 
1 1 1   14   13   34 o   27.632   7.5889   12.527   10.906   12.356   12.386   13.116   23.011   25.337   9.1904   29.926   12.079 -4.588854 15.17782 
1 1 1   14   13   35 o   38.193   6.9418   36.517   10.678   41.378   12.236   20.997   21.865   43.950   6.7502   32.436   12.132 11.51385 13.88368 
1 1 1   14   13   36 o   28.822   7.5398   14.286   10.152   11.737   11.443   23.715   22.004   24.446   8.8386   33.198   12.218 -8.752501 15.07964 
1 1 1   14   13   37 o   53.220   7.2553   74.874   13.356   84.845   15.618   47.732   25.768   62.940   6.0162   43.500   13.205 19.44034 14.51050 
1 1 1   14   13   38 o   56.537   6.1492   74.746   12.081   77.467   14.203   67.624   22.975   60.121   5.7276   52.953   10.883 7.167789 12.29836 
1 1 1   14   13   39 o   51.511   6.6767   59.917   12.006   57.533   13.819   67.255   24.244   51.318   6.5291   51.704   11.648 -0.3855705 13.35344 
1 1 1   14   13   40 o   42.486   7.1098   46.733   11.504   50.358   13.355   36.309   22.646   47.744   6.7821   37.229   12.498 10.51482 14.21967 
1 1 1   14   13   41 o   73.583   9.9162  145.181   22.812  141.608   25.337  160.476   52.420   78.640   7.8116   68.525   18.229 10.11507 19.83245 
1 1 1   14   13   42 o   21.939   7.0450  -0.3910   11.156  -0.5536   12.390   0.3057   25.646   18.603   8.2194   25.275   11.444 -6.672279 14.09007 
1 1 1   14   13   43 o   28.837   8.1012   13.137   11.452   7.7119   12.606   38.754   27.394   21.815   8.8909   35.860   13.545 -14.04501 16.20241 
1 1 1   14   13   44 o   20.647   6.8868  -4.7043   12.448  -0.8144   13.549 -25.7671   31.528   18.907   8.4593   22.388   10.870 -3.480822 13.77361 
1 1 1   14   13   45 o   31.961   13.878   32.766   33.985   32.766   33.985   0.0000   0.0000   31.961   13.878  ?   ?       ?      ? 
1 1 1   14   13   46 o   23.412   7.5318   2.4655   12.555  -2.0740   13.985   21.318   28.500   18.359   8.3666   28.465   12.526 -10.10579 15.06365 
1 1 1   14   14    0 o   40.712   3.3951   35.613   7.7678   35.613   7.7678   35.613   7.7678   40.712   4.8014   40.712   4.8014 0.000000 0.000000 
1 1 1   14   14    1 o   98.433   2.1231  199.953   8.6188  196.846   12.154  203.096   12.224   97.663   3.0173   99.202   2.9876 -1.539093 4.246162 
1 1 1   14   14    2 o   79.629   2.4047  130.934   7.8133  130.564   11.947  131.211   10.328   79.525   3.6423   79.733   3.1407 -0.2080154 4.809429 
1 1 1   14   14    3 o  397.708   3.3304  3267.05   54.037  3274.57   82.782  3261.46   71.330  398.052   5.0423  397.364   4.3523 0.6879883 6.660876 
1 1 1   14   14    4 o  281.541   2.6790  1639.12   30.863  1616.79   46.503  1656.70   41.259  279.801   4.0296  283.280   3.5313 -3.479126 5.357975 
1 1 1   14   14    5 o  162.458   2.0726  544.655   13.887  550.455   19.744  538.978   19.535  163.313   2.9313  161.602   2.9309 1.711487 4.145160 
1 1 1   14   14    6 o  167.086   2.2679  578.077   15.463  563.672   23.497  589.080   20.536  165.231   3.4478  168.941   2.9472 -3.709412 4.535846 
1 1 1   14   14    7 o   83.975   2.4418  145.484   8.2148  146.120   13.320  145.094   10.436   84.111   3.8395   83.840   3.0180 0.2709503 4.883649 
1 1 1   14   14    8 o   98.663   2.2941  200.633   9.1029  202.522   14.626  199.438   11.630   99.029   3.5810   98.297   2.8685 0.7322311 4.588242 
1 1 1   14   14    9 o   88.206   2.3643  158.721   8.3982  169.323   13.607  152.197   10.674   90.547   3.6436   85.866   3.0139 4.681374 4.728580 
1 1 1   14   14   10 o  138.530   2.2071  397.239   12.321  391.116   19.561  401.265   15.863  137.627   3.4461  139.434   2.7584 -1.806564 4.414133 
1 1 1   14   14   11 o  231.852   2.5241  1110.85   24.002  1102.82   35.821  1117.40   32.334  231.074   3.7586  232.630   3.3700 -1.556534 5.048166 
1 1 1   14   14   12 o  178.258   2.3932  655.594   17.515  661.724   26.103  650.574   23.622  179.005   3.5355  177.511   3.2264 1.493698 4.786431 
1 1 1   14   14   13 o   39.599   4.2264   34.261   6.3445   28.550   10.318   37.733   8.0453   36.477   7.1136   42.721   4.5661 -6.243580 8.452895 
1 1 1   14   14   14 o  154.644   2.3224  491.377   14.588  507.948   22.865  480.001   18.945  156.814   3.5353  152.473   3.0126 4.340805 4.644780 
1 1 1   14   14   15 o  178.962   2.9385  665.334   21.107  677.023   27.038  647.101   33.771  181.033   3.6213  176.890   4.6288 4.142761 5.877028 
1 1 1   14   14   16 o  271.603   2.8019  1526.42   31.018  1536.62   40.925  1512.66   47.548  272.717   3.6384  270.489   4.2620 2.227875 5.603783 
1 1 1   14   14   17 o  153.609   2.3186  487.328   14.689  493.870   20.888  480.928   20.660  154.628   3.2752  152.589   3.2827 2.040054 4.637172 
1 1 1   14   14   18 f   99.218   2.8209  203.131   11.421  206.024   17.529  200.996   15.056   99.814   4.2579   98.622   3.7014 1.192398 5.641814 
1 1 1   14   14   19 o  358.476   3.4143  2659.52   50.466  2675.56   72.343  2644.31   70.434  359.515   4.8788  357.437   4.7777 2.078094 6.828521 
1 1 1   14   14   20 o  143.005   2.6617  423.229   15.556  418.788   23.584  426.649   20.697  142.317   4.0178  143.692   3.4923 -1.375763 5.323430 
1 1 1   14   14   21 f   61.804   3.8758   81.283   9.6058   67.157   14.560   92.171   12.783   56.878   6.2063   66.731   4.6444 -9.852257 7.751688 
1 1 1   14   14   22 o   81.588   3.7861  136.930   12.272  141.925   20.461  134.124   15.337   82.686   5.9996   80.489   4.6200 2.197159 7.572269 
1 1 1   14   14   23 o  178.819   2.5201  661.009   18.585  658.634   26.088  663.456   26.483  178.495   3.5436  179.143   3.5843 -0.6472931 5.040252 
1 1 1   14   14   24 o  209.787   2.8517  891.525   23.778  842.478   29.527  982.024   40.109  201.838   3.5469  217.735   4.4662 -15.89742 5.703322 
1 1 1   14   14   25 o   68.777   3.8528   98.437   10.893   96.148   15.963  100.433   14.902   68.004   5.6913   69.550   5.1948 -1.546013 7.705626 
1 1 1   14   14   26 o   90.929   4.3141  174.066   16.000  148.329   23.027  198.091   22.248   84.278   6.6247   97.580   5.5281 -13.30178 8.628214 
1 1 1   14   14   27 o   91.461   3.8415  181.505   13.531  198.204   16.882  151.511   22.626   97.765   4.1868   85.156   6.4421 12.60935 7.683069 
1 1 1   14   14   28 o   55.287   5.8461   67.084   11.447   68.836   13.505   62.612   21.572   57.394   5.7052   53.181   10.206 4.212460 11.69229 
1 1 1   14   14   29 o   67.233   8.4344   74.673   19.256   56.560   21.239  158.273   45.631   50.217   10.588   84.249   13.132 -34.03203 16.86882 
1 1 1   14   14   30 o   43.856   6.3713   53.471   10.921   69.933   13.043   14.876   19.972   57.749   5.4763   29.963   11.506 27.78560 12.74251 
1 1 1   14   14   31 o  102.698   4.1800  220.148   17.631  200.029   23.696  245.100   26.390   97.492   5.8931  107.905   5.9297 -10.41243 8.360030 
1 1 1   14   14   32 o   73.489   4.3322  105.657   12.086   93.589   14.196  137.454   23.042   66.729   5.1581   80.249   6.9618 -13.52089 8.664473 
1 1 1   14   14   33 o   46.735   8.0373   51.523   15.343   51.162   21.583   51.891   21.815   46.579   11.341   46.891   11.392 -0.3127556 16.07459 
1 1 1   14   14   34 f   67.760   5.5394  100.455   13.154  101.283   15.136   97.900   26.592   69.253   5.2990   66.268   9.7293 2.985725 11.07873 
1 1 1   14   14   35 o   46.388   6.9730   55.984   11.781   63.897   13.752   34.152   22.842   54.740   6.0909   38.035   12.546 16.70534 13.94599 
1 1 1   14   14   36 o   54.101   6.2400   68.992   11.574   72.430   13.531   59.620   22.342   58.317   5.6255   49.885   11.140 8.432159 12.48003 
1 1 1   14   14   37 o   54.949   6.0156   56.694   11.938   46.591   13.504   92.835   25.542   46.205   7.0862   63.692   9.7230 -17.48724 12.03129 
1 1 1   14   14   38 o   64.085   9.2080  113.057   20.256  121.660   23.245   85.906   41.295   74.145   7.6011   54.026   16.774 20.11942 18.41592 
1 1 1   14   14   39 o   32.147   7.3154   26.855   11.249   31.839   12.623   7.6185   24.800   36.743   8.4985   27.551   11.909 9.191355 14.63075 
1 1 1   14   14   40 o   48.494   6.8703   52.718   11.809   48.542   13.552   65.886   24.067   46.655   7.0429   50.334   11.798 -3.679085 13.74055 
1 1 1   14   14   41 o   28.432   8.3125   9.2012   17.025 -10.3685   22.862   33.567   25.510   21.931   10.240   34.934   13.097 -13.00290 16.62500 
1 1 1   14   14   42 o   21.979   7.1487  -6.8931   11.609 -11.8029   12.974   12.831   26.004   15.752   7.4652   28.205   12.194 -12.45296 14.29731 
1 1 1   14   14   43 o   50.097   8.2340   73.313   14.993   76.348   16.981   62.575   31.936   57.483   7.1622   42.711   14.829 14.77225 16.46796 
1 1 1   14   14   44 o   51.669   8.5069   67.503   15.402   58.820   17.408   98.796   33.049   48.182   9.0933   55.157   14.380 -6.975189 17.01389 
1 1 1   14   14   45 o   21.972   9.2449   8.1331   14.246   8.1331   14.246   0.0000   0.0000   21.972   9.2449  ?   ?       ?      ? 
1 1 1   14   15    0 o  146.807   2.0281  445.152   17.352  445.152   17.352  445.152   17.352  146.807   2.8682  146.807   2.8682 0.000000 0.000000 
1 1 1   14   15    1 o  276.352   2.4609  1576.73   28.047  1588.35   39.990  1565.47   39.347  277.353   3.4958  275.351   3.4646 2.001862 4.921836 
1 1 1   14   15    2 o  372.831   3.1800  2870.98   48.346  2883.49   74.237  2861.77   63.707  373.478   4.8194  372.185   4.1501 1.292755 6.360022 
1 1 1   14   15    3 o  168.545   2.2283  587.891   15.352  575.163   23.181  597.837   20.491  166.903   3.3674  170.187   2.9192 -3.283585 4.456569 
1 1 1   14   15    4 o   79.577   2.2387  130.676   7.3443  132.510   10.579  128.969   10.204   80.115   3.2016   79.039   3.1301 1.075630 4.477473 
1 1 1   14   15    5 f   52.313   2.9477   56.666   6.2797   55.745   9.6382   57.346   8.2780   51.934   4.4997   52.691   3.8091 -0.7571716 5.895426 
1 1 1   14   15    6 o  211.782   2.7120  922.261   22.149  938.181   39.149  914.766   26.862  213.061   4.4551  210.503   3.0939 2.557068 5.424019 
1 1 1   14   15    7 o  262.114   2.5118  1417.35   26.336  1424.64   42.877  1412.93   33.373  262.612   3.9586  261.617   3.0929 0.9946899 5.023595 
1 1 1   14   15    8 o   92.477   2.3094  175.303   8.5470  181.715   13.998  171.492   10.792   93.803   3.6182   91.150   2.8707 2.652771 4.618708 
1 1 1   14   15    9 o   65.766   2.7948   91.863   7.2693   79.485   11.638   99.783   9.3087   62.013   4.5501   69.520   3.2465 -7.506802 5.589535 
1 1 1   14   15   10 o   74.806   2.5359  115.871   7.5874  114.318   12.298  116.826   9.6412   74.387   4.0083   75.225   3.1074 -0.8386688 5.071745 
1 1 1   14   15   11 o  128.138   2.3412  339.527   12.330  333.032   18.118  345.129   16.827  126.987   3.4594  129.289   3.1556 -2.301437 4.682381 
1 1 1   14   15   12 o  165.456   2.3523  565.117   15.981  567.906   23.777  562.819   21.582  165.817   3.4766  165.095   3.1696 0.7226105 4.704560 
1 1 1   14   15   13 o  244.532   2.7720  1235.76   27.953  1244.47   39.267  1226.82   39.802  245.411   3.8795  243.654   3.9607 1.756821 5.544100 
1 1 1   14   15   14 o  113.852   2.3027  266.920   10.538  271.112   16.981  264.293   13.439  114.559   3.5939  113.144   2.8799 1.414627 4.605432 
1 1 1   14   15   15 o  241.481   2.8282  1203.76   28.091  1184.98   38.201  1225.87   41.452  239.451   3.8680  243.511   4.1272 -4.059586 5.656479 
1 1 1   14   15   16 o  190.830   3.2373  777.980   24.417  859.759   31.450  653.879   38.742  203.969   3.7384  177.692   5.2863 26.27663 6.474584 
1 1 1   14   15   17 o  255.407   2.7659  1347.46   28.707  1342.92   37.487  1353.91   44.637  254.937   3.5652  255.876   4.2296 -0.9394836 5.531754 
1 1 1   14   15   18 o  168.058   2.6790  584.199   18.520  577.875   27.115  589.731   25.357  167.190   3.9321  168.926   3.6395 -1.736435 5.357951 
1 1 1   14   15   19 o  115.243   2.5767  275.228   12.211  295.641   17.124  254.104   17.419  119.615   3.4709  110.872   3.8093 8.743195 5.153463 
1 1 1   14   15   20 o   96.116   2.6838  190.918   10.637  194.633   15.231  187.380   14.863   97.028   3.8059   95.204   3.7852 1.823784 5.367692 
1 1 1   14   15   21 o   34.184   5.6395   25.514   7.8552   20.628   11.251   30.161   10.972   30.947   8.5370   37.421   7.3712 -6.474796 11.27899 
1 1 1   14   15   22 o  102.775   3.3021  217.398   13.410  223.417   22.595  214.126   16.661  103.807   5.2775  101.743   3.9704 2.063080 6.604266 
1 1 1   14   15   23 o   39.716   5.2964   33.647   8.4628   31.821   12.391   35.243   11.586   38.303   8.0969   41.128   6.8299 -2.824894 10.59284 
1 1 1   14   15   24 o   46.271   4.6126   44.799   8.7403   51.087   12.397   38.583   12.324   49.545   6.0666   42.996   6.9498 6.548954 9.225149 
1 1 1   14   15   25 o   85.671   4.1229  150.202   13.987  143.844   17.328  162.092   23.696   83.216   5.0487   88.125   6.5195 -4.909035 8.245839 
1 1 1   14   15   26 o   86.748   3.9125  154.620   13.695  147.353   17.456  166.253   22.087   84.203   5.0264   89.294   5.9971 -5.091148 7.824934 
1 1 1   14   15   27 o  118.224   3.6905  293.399   17.863  321.862   24.715  262.268   25.847  124.363   4.8184  112.085   5.5912 12.27795 7.380931 
1 1 1   14   15   28 o   93.704   5.3837  188.133   20.531  162.401   30.030  210.718   28.133   87.374   8.3332  100.034   6.8189 -12.65904 10.76749 
1 1 1   14   15   29 o   30.332   8.6810   20.256   11.411   20.256   11.411   0.0000   0.0000   30.332   8.6810  ?   ?       ?      ? 
1 1 1   14   15   30 o  107.278   3.4540  236.803   14.382  229.462   17.466  252.260   25.344  104.977   4.0341  109.579   5.6077 -4.602379 6.907935 
1 1 1   14   15   31 o   43.790   6.6232   42.007   10.444   41.471   12.069   43.604   20.842   44.216   6.6181   43.365   11.475 0.8509865 13.24647 
1 1 1   14   15   32 o   88.511   3.9021  158.955   13.291  148.145   15.902  184.016   24.211   84.045   4.5874   92.977   6.3137 -8.931511 7.804276 
1 1 1   14   15   33 o   32.875   8.0964   21.845   15.170   36.866   19.557  -0.8391   24.034   39.536   11.380   26.213   11.520 13.32216 16.19282 
1 1 1   14   15   34 o   37.526   7.5092   32.078   10.779   32.097   12.157   32.010   23.309   37.772   8.0499   37.279   12.679 0.4923630 15.01845 
1 1 1   14   15   35 o   29.237   7.7735   13.756   10.401   11.000   11.519   25.931   24.209   24.032   8.8405   34.442   12.789 -10.41033 15.54705 
1 1 1   14   15   36 o   29.316   7.4818   18.919   12.714   27.811   13.554 -46.1622   36.670   34.507   9.3092   24.125   11.715 10.38245 14.96368 
1 1 1   14   15   37 o   74.380   8.0792  123.082   24.785   0.0000   0.0000  123.082   24.785  ?   ?    74.380   8.0792      ?      ? 
1 1 1   14   15   38 o   29.558   8.5655   14.851   11.423   14.905   11.969   14.299   38.249   26.066   9.0766   33.051   14.529 -6.984716 17.13101 
1 1 1   14   15   39 o   25.726   7.3391   11.266   10.891   11.530   12.545   10.456   21.947   24.217   9.1617   27.235   11.468 -3.017620 14.67822 
1 1 1   14   15   40 o   38.267   8.0513   30.142   16.269   1.1054   20.905   74.739   25.908   23.727   10.569   52.808   12.148 -29.08126 16.10251 
1 1 1   14   15   41 o   51.224   8.0812   67.042   17.516   40.657   23.166  102.257   26.763   38.034   12.639   64.413   10.074 -26.37903 16.16234 
1 1 1   14   15   42 o   50.017   7.5454   69.052   13.019   72.333   14.792   57.772   27.426   56.796   6.3146   43.237   13.706 13.55937 15.09075 
1 1 1   14   15   43 o   32.632   7.0478   31.717   13.749   46.563   15.652 -18.4408   28.769   42.894   9.1276   22.369   10.741 20.52545 14.09565 
1 1 1   14   15   44 o   28.128   8.1083   20.002   13.709   20.282   15.640   19.072   28.478   27.723   10.282   28.534   12.540 -0.8116932 16.21667 
1 1 1   14   15   45 o   75.190   6.1890  130.041   19.193  130.041   19.193   0.0000   0.0000   75.190   6.1890  ?   ?       ?      ? 
1 1 1   14   16    0 o  231.290   2.2653  1104.44   30.547  1104.44   30.547  1104.44   30.547  231.290   3.2036  231.290   3.2036 0.000000 0.000000 
1 1 1   14   16    1 o  468.599   3.7771  4531.59   71.871  4603.92  112.329  4481.45   93.520  471.635   5.7746  465.564   4.8703 6.071381 7.554183 
1 1 1   14   16    2 o  112.417   2.2052  261.222   10.128  258.445   15.377  263.350   13.460  111.880   3.3323  112.954   2.8892 -1.073723 4.410460 
1 1 1   14   16    3 o   94.966   2.2572  185.918   8.7398  187.980   13.450  184.411   11.498   95.414   3.4178   94.519   2.9495 0.8949051 4.514491 
1 1 1   14   16    4 o   40.694   3.4054   34.444   5.6373   32.890   8.6114   35.609   7.4573   39.876   5.2359   41.511   4.3557 -1.634361 6.810774 
1 1 1   14   16    5 o  149.796   2.5282  467.816   14.702  450.081   25.289  476.871   18.070  147.594   4.1543  151.997   2.8824 -4.403336 5.056318 
1 1 1   14   16    6 o   40.848   4.0959   33.653   6.3197   36.731   11.788   32.412   7.4866   42.097   6.7892   39.599   4.5839 2.498329 8.191765 
1 1 1   14   16    7 f  133.271   2.4587  364.847   12.313  371.437   22.810  362.137   14.628  134.079   4.1247  132.463   2.6774 1.616272 4.917481 
1 1 1   14   16    8 o  109.251   2.2595  249.662   9.8886  232.036   15.696  261.262   12.733  105.994   3.5904  112.507   2.7441 -6.512398 4.518959 
1 1 1   14   16    9 o   88.601   2.4771  166.855   8.7866  135.029   13.270  191.704   11.725   80.838   3.9799   96.364   2.9502 -15.52520 4.954130 
1 1 1   14   16   10 o  135.360   2.1853  375.340   11.843  390.536   19.393  366.304   14.955  137.509   3.4195  133.212   2.7219 4.297272 4.370511 
1 1 1   14   16   11 o   81.004   2.6390  135.940   8.7864  129.998   12.794  141.244   12.088   79.316   3.9108   82.691   3.5443 -3.374329 5.277900 
1 1 1   14   16   12 o  308.603   2.8852  1964.90   36.341  1991.99   55.727  1944.86   47.936  310.403   4.3529  306.802   3.7883 3.600433 5.770469 
1 1 1   14   16   13 o  118.097   2.5831  288.189   12.566  288.674   17.353  287.653   18.222  118.207   3.5593  117.987   3.7445 0.2205963 5.166224 
1 1 1   14   16   14 o  189.120   2.4447  738.378   18.978  744.175   28.306  733.644   25.578  189.778   3.6164  188.462   3.2906 1.315933 4.889391 
1 1 1   14   16   15 o  211.973   2.7436  929.014   23.928  932.918   32.754  924.546   35.040  212.468   3.7377  211.478   4.0173 0.9901428 5.487174 
1 1 1   14   16   16 o   58.549   3.7703   71.021   8.9507   71.079   11.642   70.937   13.998   58.602   4.8165   58.496   5.8019 0.1066742 7.540633 
1 1 1   14   16   17 o   48.533   4.4374   47.965   8.7839   42.929   11.429   55.231   13.729   45.489   6.0920   51.577   6.4536 -6.088718 8.874779 
1 1 1   14   16   18 o  300.235   3.5255  1884.63   43.128  1726.17   64.559  2012.34   57.958  288.615   5.4234  311.856   4.5061 -23.24088 7.051095 
1 1 1   14   16   19 o  162.777   2.4965  544.898   16.686  520.803   22.373  575.098   25.047  158.753   3.4169  166.800   3.6408 -8.046860 4.993023 
1 1 1   14   16   20 o  189.364   2.4098  741.070   18.821  742.656   26.613  739.484   26.621  189.567   3.4038  189.161   3.4121 0.4062500 4.819587 
1 1 1   14   16   21 o   76.549   3.3282  121.690   10.361  119.362   15.966  123.383   13.618   75.886   5.1011   77.212   4.2762 -1.325722 6.656328 
1 1 1   14   16   22 o  145.546   2.8650  437.045   16.680  444.227   27.226  432.730   21.104  146.437   4.5078  144.656   3.5373 1.781708 5.729963 
1 1 1   14   16   23 o   94.335   3.6715  192.944   13.240  161.249   22.477  209.786   16.385   88.006   6.1924  100.665   3.9464 -12.65891 7.343024 
1 1 1   14   16   24 o   75.732   3.3171  119.432   10.323  128.403   14.411  109.975   14.795   78.688   4.4403   72.775   4.9291 5.912415 6.634184 
1 1 1   14   16   25 o  105.821   3.4653  231.590   14.946  226.136   19.580  239.205   23.135  104.388   4.5477  107.253   5.2298 -2.865417 6.930571 
1 1 1   14   16   26 o   87.104   3.0720  157.730   11.027  152.427   15.727  162.859   15.465   85.647   4.4521   88.561   4.2340 -2.914429 6.143929 
1 1 1   14   16   27 o  149.688   3.0734  462.035   18.254  451.892   22.772  480.273   30.535  147.570   3.7414  151.805   4.8769 -4.234787 6.146709 
1 1 1   14   16   28 o   46.717   6.7235   55.780   11.847   68.892   14.401   28.335   20.835   57.242   6.0998   36.191   11.984 21.05165 13.44707 
1 1 1   14   16   29 o   86.525   6.0389  175.230   14.791  181.664   16.118  140.900   37.232   93.373   4.1852   79.678   11.330 13.69476 12.07784 
1 1 1   14   16   30 o   76.813   4.2796  120.344   12.426  114.536   14.705  134.843   23.234   73.993   4.8186   79.633   7.0739 -5.640099 8.559118 
1 1 1   14   16   31 o   75.962   4.2277  115.063   12.341  103.529   14.671  142.971   22.821   70.138   5.0715   81.785   6.7655 -11.64640 8.455338 
1 1 1   14   16   32 o   36.879   7.2863   27.264   10.759   20.435   12.687   44.754   20.304   30.222   9.2834   43.536   11.233 -13.31368 14.57252 
1 1 1   14   16   33 o   43.511   12.020   33.882   26.347   23.763   29.616   72.280   57.692   35.414   13.896   51.608   19.617 -16.19451 24.04049 
1 1 1   14   16   34 o   61.096   6.2870   84.156   13.227   84.579   15.339   82.929   26.120   62.961   5.9069   59.230   11.100 3.730400 12.57391 
1 1 1   14   16   35 o   53.145   6.4952   57.369   12.283   50.240   14.075   80.142   25.156   48.105   7.0939   58.185   10.882 -10.08008 12.99039 
1 1 1   14   16   36 f   20.736   6.7076  -4.9244   11.247  -3.1782   12.884 -10.5152   23.053   18.540   8.2753   22.932   10.559 -4.391811 13.41517 
1 1 1   14   16   37 o   45.674   8.5308   52.913   16.234   55.307   24.379   51.007   21.760   46.322   12.480   45.026   11.634 1.296211 17.06169 
1 1 1   14   16   38 o   45.303   8.9932   45.737   12.685   42.789   13.460   69.157   37.937   43.074   7.8664   47.531   16.175 -4.457249 17.98648 
1 1 1   14   16   39 o   26.851   7.5091   12.080   10.675   9.1806   12.153   21.877   22.339   22.742   8.9080   30.959   12.091 -8.217314 15.01819 
1 1 1   14   16   40 o   23.204   7.0836   6.3524   10.983   9.5719   12.093  -8.8068   26.240   22.717   8.8894   23.691   11.031 -0.9733486 14.16719 
1 1 1   14   16   41 o   51.033   7.6017   88.701   14.473  102.893   16.133   30.186   32.760   68.385   5.7200   33.681   14.086 34.70401 15.20347 
1 1 1   14   16   42 o   30.909   8.3352   23.735   13.030   21.564   14.743   31.478   27.849   28.936   10.074   32.881   13.283 -3.945744 16.67043 
1 1 1   14   16   43 o   28.341   8.2818   17.015   13.126   14.005   14.612   29.599   29.878   24.915   9.7654   31.766   13.379 -6.851412 16.56355 
1 1 1   14   16   44 o   24.354   7.6206   7.2806   12.583   3.6690   14.184   20.628   27.268   20.318   8.8915   28.391   12.379 -8.072842 15.24118 
1 1 1   14   17    0 o  446.846   3.3578  4124.27   87.496  4124.27   87.496  4124.27   87.496  446.846   4.7487  446.846   4.7487 0.000000 0.000000 
1 1 1   14   17    1 o  194.598   2.3026  781.789   18.285  782.377   27.970  781.350   24.163  194.645   3.4841  194.551   3.0113 0.9411621E-01 4.605101 
1 1 1   14   17    2 o  350.513   3.0500  2539.03   43.641  2538.56   66.646  2539.39   57.744  350.431   4.6111  350.594   3.9933 -0.1626587 6.099907 
1 1 1   14   17    3 o   98.482   2.0837  200.199   8.4623  200.712   12.075  199.704   11.863   98.605   2.9690   98.358   2.9243 0.2465210 4.167323 
1 1 1   14   17    4 o  254.063   2.8315  1332.46   26.985  1336.50   49.951  1330.79   32.067  254.235   4.7637  253.891   3.0623 0.3444824 5.663067 
1 1 1   14   17    5 o   45.407   3.9355   44.155   6.5163   39.473   12.245   46.004   7.6966   43.627   6.8054   47.186   3.9548 -3.559486 7.871024 
1 1 1   14   17    6 o  161.947   2.5477  553.705   16.190  500.888   26.764  584.183   20.331  155.677   4.1684  168.217   2.9304 -12.54025 5.095312 
1 1 1   14   17    7 o   85.249   2.6816  149.474   8.6199  151.827   15.863  148.488   10.268   85.691   4.4884   84.807   2.9356 0.8837357 5.363119 
1 1 1   14   17    8 o  175.243   2.5307  636.843   16.701  628.334   30.582  640.459   19.936  174.345   4.2530  176.142   2.7442 -1.796646 5.061488 
1 1 1   14   17    9 o  222.859   2.3649  1027.20   21.182  1019.19   33.949  1032.31   27.105  222.109   3.7059  223.609   2.9390 -1.499954 4.729849 
1 1 1   14   17   10 o  125.404   2.2312  328.788   11.267  304.552   17.611  345.582   14.660  121.423   3.5165  129.386   2.7472 -7.962936 4.462365 
1 1 1   14   17   11 o  123.777   2.3854  316.824   12.147  310.944   17.730  322.026   16.675  122.685   3.5038  124.868   3.2378 -2.183205 4.770745 
1 1 1   14   17   12 o  274.317   2.9181  1554.30   32.965  1530.49   45.237  1581.26   48.137  272.095   4.0309  276.538   4.2204 -4.443176 5.836135 
1 1 1   14   17   13 o  139.689   2.5328  402.031   14.569  383.205   19.923  423.671   21.359  136.187   3.5469  143.192   3.6166 -7.004837 5.065646 
1 1 1   14   17   14 o  179.867   2.4136  668.506   17.807  667.117   26.596  669.635   23.974  179.680   3.5888  180.053   3.2283 -0.3730011 4.827120 
1 1 1   14   17   15 o  117.785   2.4504  287.481   11.869  306.915   16.584  267.075   16.994  121.888   3.2989  113.682   3.6244 8.206467 4.900870 
1 1 1   14   17   16 o  101.198   2.5303  211.598   10.560  206.712   14.832  216.619   15.037  100.013   3.5958  102.383   3.5610 -2.370537 5.060683 
1 1 1   14   17   17 o   77.471   3.4797  123.646   11.087  112.040   15.119  137.144   16.306   73.554   4.9837   81.387   4.8576 -7.832542 6.959428 
1 1 1   14   17   18 f  157.369   2.8309  509.073   17.577  501.680   21.802  522.804   29.712  155.810   3.3926  158.928   4.5328 -3.117325 5.661791 
1 1 1   14   17   19 o  152.119   3.0202  478.829   18.949  480.757   26.760  476.890   26.835  152.428   4.2566  151.810   4.2858 0.6178131 6.040452 
1 1 1   14   17   20 o  130.506   2.4459  352.043   13.164  354.769   18.768  349.402   18.469  131.002   3.4736  130.010   3.4443 0.9920044 4.891747 
1 1 1   14   17   21 o   65.501   3.3979   88.579   9.1587   94.466   13.519   83.586   12.451   67.500   4.8561   63.501   4.7540 3.999008 6.795749 
1 1 1   14   17   22 o   92.600   2.8722  177.520   10.964  179.082   15.794  176.067   15.231   92.988   4.1182   92.213   4.0048 0.7753296 5.744362 
1 1 1   14   17   23 o  115.139   3.1516  276.348   14.284  270.166   23.965  279.755   17.790  114.036   5.0953  116.243   3.7105 -2.207520 6.303205 
1 1 1   14   17   24 o  140.654   2.6826  410.405   15.533  422.755   21.532  397.002   22.431  142.886   3.6536  138.421   3.9290 4.464615 5.365228 
1 1 1   14   17   25 o  100.360   2.9110  209.153   12.038  206.804   17.348  211.336   16.719   99.801   4.2145  100.920   4.0168 -1.118980 5.822088 
1 1 1   14   17   26 o   77.042   3.4619  125.560   10.808  111.024   16.275  137.031   14.457   72.902   5.4126   81.181   4.3178 -8.279221 6.923846 
1 1 1   14   17   27 o   22.309   6.1967   3.4132   9.7022   14.538   11.759 -20.3075   17.171   26.716   9.0059   17.902   8.5142 8.814159 12.39342 
1 1 1   14   17   28 o  124.571   3.9351  324.000   20.160  297.876   27.345  355.106   29.839  119.101   5.5667  130.041   5.5634 -10.94017 7.870216 
1 1 1   14   17   29 o   37.848   5.9117   40.230   10.297   56.892   12.147  -2.3334   19.414   52.022   5.6611   23.674   10.380 28.34825 11.82349 
1 1 1   14   17   30 o   34.420   7.7922   29.206   11.336   33.286   12.009  -4.1965   34.362   38.654   7.8013   30.187   13.491 8.467495 15.58440 
1 1 1   14   17   31 o   76.166   4.3403  123.978   12.870  125.311   15.853  121.401   22.041   77.163   4.9812   75.169   7.1092 1.994247 8.680561 
1 1 1   14   17   32 o   21.049   6.4767   1.0144   9.5247   3.5986   10.899  -7.3412   19.597   19.969   8.2173   22.129   10.013 -2.159973 12.95330 
1 1 1   14   17   33 o   43.640   6.6008   35.981   11.450   21.058   13.652   71.383   21.027   30.569   9.6681   56.712   8.9896 -26.14266 13.20168 
1 1 1   14   17   34 o   44.309   7.9991   46.582   15.105   64.842   22.356   31.244   20.489   52.338   10.717   36.281   11.878 16.05656 15.99819 
1 1 1   14   17   35 o   33.211   7.4851   18.740   11.115   8.9837   12.976   45.629   21.541   23.523   9.2072   42.898   11.804 -19.37511 14.97024 
1 1 1   14   17   36 o   57.122   6.5532   76.368   12.677   77.572   14.631   72.741   25.390   60.034   5.9091   54.210   11.699 5.823708 13.10648 
1 1 1   14   17   37 o   26.034   6.8781   13.737   10.707   20.826   12.407  -6.9438   21.192   29.694   9.1904   22.374   10.236 7.320076 13.75616 
1 1 1   14   17   38 o   55.690   6.5764   77.834   12.396   83.044   14.499   63.672   23.903   61.878   5.6810   49.502   11.863 12.37669 13.15275 
1 1 1   14   17   39 o   36.699   7.5293   37.647   12.476   43.596   14.719   22.465   23.513   42.506   8.6893   30.891   12.299 11.61509 15.05855 
1 1 1   14   17   40 o   22.010   6.8003   2.7622   11.642   9.0323   13.479 -15.6520   23.100   22.993   9.2573   21.027   9.9640 1.965181 13.60069 
1 1 1   14   17   41 o   46.072   7.3951   55.028   12.538   54.562   14.534   56.382   24.788   48.631   7.2460   43.512   12.894 5.119366 14.79024 
1 1 1   14   17   42 o   17.434   6.2190 -31.7265   12.354 -35.4337   13.716 -15.7833   28.444   12.279   6.1653   22.589   10.803 -10.30965 12.43810 
1 1 1   14   17   43 o   39.349   8.5435   41.071   13.529   33.323   15.522   65.570   27.600   34.644   10.186   44.053   13.719 -9.408360 17.08701 
1 1 1   14   17   44 f   29.390   8.4319   14.493   13.400   4.3346   14.995   54.764   29.856   20.818   9.1253   37.963   14.181 -17.14574 16.86371 
1 1 1   14   18    0 o  146.112   2.9424  441.830   25.031  441.830   25.031  441.830   25.031  146.112   4.1612  146.112   4.1612 0.000000 0.000000 
1 1 1   14   18    1 o  220.793   2.4014  1007.72   21.662  1000.45   32.915  1013.27   28.770  220.067   3.6264  221.520   3.1489 -1.452667 4.802723 
1 1 1   14   18    2 f  321.360   2.8831  2136.40   37.893  2118.53   57.299  2150.29   50.516  320.118   4.3398  322.603   3.7966 -2.484955 5.766155 
1 1 1   14   18    3 o  241.082   2.3868  1207.19   23.282  1163.88   36.311  1237.42   30.340  237.352   3.7092  244.811   3.0048 -7.459625 4.773572 
1 1 1   14   18    4 o  157.563   2.4820  511.753   14.640  515.311   27.221  510.305   17.365  157.895   4.1799  157.232   2.6777 0.6622314 4.964026 
1 1 1   14   18    5 o   88.109   2.6636  157.689   8.9639  167.527   16.295  153.420   10.734   90.017   4.3890   86.201   3.0192 3.815872 5.327145 
1 1 1   14   18    6 o  126.512   2.4703  331.391   11.799  328.646   21.539  332.567   14.104  126.096   4.1414  126.929   2.6940 -0.8336029 4.940573 
1 1 1   14   18    7 o  216.207   2.7229  979.119   23.246  918.781   38.315  1014.27   29.244  210.796   4.4070  221.618   3.1994 -10.82179 5.445880 
1 1 1   14   18    8 o  169.930   2.5399  602.310   16.379  581.864   29.430  611.484   19.714  167.759   4.2534  172.102   2.7772 -4.343674 5.079824 
1 1 1   14   18    9 o  177.012   2.5341  638.799   16.769  667.687   31.534  627.409   19.801  179.696   4.2548  174.327   2.7539 5.369232 5.068296 
1 1 1   14   18   10 o  159.351   2.2278  524.587   14.245  523.784   22.963  525.089   18.163  159.224   3.4967  159.478   2.7613 -0.2534790 4.455539 
1 1 1   14   18   11 o  219.382   2.5022  993.726   22.519  1000.82   33.690  987.999   30.276  220.068   3.7117  218.695   3.3565 1.372131 5.004314 
1 1 1   14   18   12 f  213.747   2.6467  944.216   23.324  943.684   32.521  944.779   33.469  213.692   3.6898  213.802   3.7954 -0.1108093 5.293421 
1 1 1   14   18   13 o  395.880   3.3785  3238.67   54.536  3277.32   83.906  3210.41   71.761  397.816   5.1138  393.943   4.4166 3.872803 6.757055 
1 1 1   14   18   14 f  227.861   2.5490  1073.57   23.826  1067.42   35.538  1078.59   32.113  227.243   3.7917  228.480   3.4077 -1.237473 5.098010 
1 1 1   14   18   15 o  153.930   2.3276  489.039   14.770  472.590   20.518  506.729   21.278  151.246   3.2892  156.613   3.2942 -5.367218 4.655173 
1 1 1   14   18   16 o  184.700   2.3677  704.211   18.027  683.447   25.003  726.690   26.016  181.869   3.3333  187.531   3.3635 -5.662018 4.735398 
1 1 1   14   18   17 o   78.135   3.6459  126.621   11.728  117.368   16.528  136.004   16.644   75.245   5.3258   81.025   4.9806 -5.780045 7.291794 
1 1 1   14   18   18 o  278.783   3.1924  1610.28   34.834  1613.14   42.982  1604.80   59.461  279.315   3.7310  278.251   5.1812 1.064148 6.384763 
1 1 1   14   18   19 o  140.917   3.2886  410.276   18.970  420.182   28.792  402.678   25.217  142.380   4.9029  139.454   4.3842 2.926468 6.577190 
1 1 1   14   18   20 o  122.434   2.5426  310.374   12.822  292.108   18.152  328.564   18.114  118.824   3.7039  126.044   3.4844 -7.220200 5.085247 
1 1 1   14   18   21 o  144.659   2.4672  432.849   14.716  436.028   21.087  429.832   20.547  145.173   3.5218  144.146   3.4561 1.026520 4.934336 
1 1 1   14   18   22 o  110.313   2.7431  252.135   12.476  257.787   17.556  246.368   17.733  111.570   3.8152  109.055   3.9424 2.514557 5.486194 
1 1 1   14   18   23 o   49.801   5.4113   47.539   10.369   65.274   19.379   40.426   12.273   55.642   8.4444   43.961   6.7689 11.68106 10.82252 
1 1 1   14   18   24 o   61.269   4.3833   79.260   10.709   81.394   13.624   75.810   17.322   62.482   5.2867   60.057   6.9932 2.425327 8.766646 
1 1 1   14   18   25 o  137.256   3.0725  400.084   16.747  358.067   26.827  426.916   21.438  131.051   4.9633  143.461   3.6231 -12.41034 6.144997 
1 1 1   14   18   26 o   72.480   3.5013  109.994   10.375  107.500   15.647  111.950   13.860   71.680   5.2924   73.280   4.5856 -1.599823 7.002662 
1 1 1   14   18   27 o   95.440   6.0354  192.772   23.070  183.239   29.036  209.094   37.993   92.701   7.5943   98.179   9.3824 -5.478539 12.07075 
1 1 1   14   18   28 o   21.717   6.4614   3.0003   9.4093   5.6487   11.203  -3.3398   17.334   21.358   8.4938   22.075   9.7393 -0.7164650 12.92278 
1 1 1   14   18   29 o  100.847   3.5471  214.015   13.913  214.543   17.073  212.971   24.006  101.353   4.0841  100.341   5.8007 1.012390 7.094194 
1 1 1   14   18   30 o   46.189   7.9100   59.733   11.903   64.458   12.703   25.736   34.075   55.205   5.5792   37.173   14.804 18.03130 15.81999 
1 1 1   14   18   31 o   53.375   6.9696   64.575   14.896   63.709   22.399   65.261   19.946   52.304   10.743   54.446   8.8823 -2.141525 13.93917 
1 1 1   14   18   32 o   48.216   6.1954   44.274   10.971   35.296   12.625   71.953   22.168   39.620   8.0017   56.812   9.4607 -17.19148 12.39079 
1 1 1   14   18   33 o  109.631   3.4802  250.623   14.788  244.121   17.965  264.288   26.045  107.895   4.0371  111.367   5.6701 -3.472755 6.960485 
1 1 1   14   18   34 o   33.305   8.3221   25.070   14.372   30.144   20.546   20.209   20.110   35.542   11.904   31.068   11.632 4.474094 16.64415 
1 1 1   14   18   35 o   23.747   7.0880   5.9910   10.895   8.4838   12.451  -2.1572   22.510   22.965   9.0105   24.528   10.944 -1.563080 14.17598 
1 1 1   14   18   36 o   33.260   6.2569   29.600   11.110   42.998   12.934  -8.1044   21.698   44.092   7.1124   22.428   10.296 21.66446 12.51374 
1 1 1   14   18   37 o   29.798   7.5267   14.065   10.301   7.4895   11.654   37.547   22.023   21.779   8.6624   37.816   12.311 -16.03672 15.05345 
1 1 1   14   18   38 o   34.498   7.3138   32.010   11.225   35.858   13.006   20.774   22.222   38.729   8.3850   30.266   11.986 8.462303 14.62759 
1 1 1   14   18   39 o   28.673   7.8447   19.649   11.764   23.781   12.142 -43.6500   47.522   31.100   8.9703   26.246   12.872 4.854210 15.68949 
1 1 1   14   18   40 o   64.303   5.5364   92.808   13.166   88.239   15.424  105.075   25.273   63.087   5.9280   65.519   9.3523 -2.432499 11.07279 
1 1 1   14   18   41 o   33.072   7.9031   28.300   11.603   25.981   13.330   35.546   23.568   31.640   9.4736   34.504   12.653 -2.863974 15.80614 
1 1 1   14   18   42 o   22.384   7.6492 -18.6201   20.949 -18.2246   33.222 -18.8812   26.991   23.446   11.329   21.321   10.280 2.124681 15.29834 
1 1 1   14   18   43 o   23.941   7.6347   4.6753   12.300   0.9273   13.557   22.111   29.241   19.070   8.5020   28.812   12.684 -9.742012 15.26944 
1 1 1   14   19    0 o   60.122   2.8868   75.654   10.016   75.654   10.016   75.654   10.016   60.122   4.0825   60.122   4.0825 0.000000 0.000000 
1 1 1   14   19    1 o  204.246   2.3408  863.954   19.589  839.710   29.211  883.767   26.407  201.615   3.5128  206.876   3.0949 -5.261307 4.681693 
1 1 1   14   19    2 o  273.818   2.4492  1548.64   27.658  1536.65   38.830  1561.00   39.404  272.744   3.4519  274.893   3.4754 -2.149628 4.898349 
1 1 1   14   19    3 o  191.050   2.5558  760.700   18.477  737.469   33.397  770.947   22.181  188.858   4.2875  193.243   2.7829 -4.385559 5.111510 
1 1 1   14   19    4 o  283.384   2.9712  1672.56   31.926  1629.13   57.566  1691.85   38.366  280.563   4.9747  286.206   3.2502 -5.643585 5.942338 
1 1 1   14   19    5 o   95.777   2.6715  195.500   9.7017  174.046   17.064  205.746   11.793   91.730   4.5104   99.824   2.8644 -8.093826 5.343041 
1 1 1   14   19    6 o  201.839   2.6038  850.186   19.882  820.705   35.911  863.217   23.876  199.207   4.3708  204.471   2.8311 -5.263779 5.207601 
1 1 1   14   19    7 o  102.187   2.6223  217.717   10.026  211.170   18.480  220.448   11.934  101.043   4.4345  103.330   2.8003 -2.287590 5.244654 
1 1 1   14   19    8 o   47.481   3.7755   48.062   6.4653   43.837   12.428   49.630   7.5703   45.956   6.5567   49.005   3.7455 -3.049000 7.551069 
1 1 1   14   19    9 o  133.959   2.5012  373.223   12.724  364.470   22.897  377.133   15.304  132.764   4.1816  135.154   2.7455 -2.389847 5.002321 
1 1 1   14   19   10 o  185.654   2.5720  710.960   17.962  715.498   33.118  709.069   21.379  185.993   4.3171  185.314   2.7971 0.6793823 5.144091 
1 1 1   14   19   11 o   67.075   2.7698   89.105   7.4918  113.602   12.253   74.481   9.4675   74.124   4.0080   60.026   3.8241 14.09827 5.539632 
1 1 1   14   19   12 o  171.767   2.5281  609.786   17.905  626.872   25.352  592.781   25.292  174.172   3.5292  169.361   3.6208 4.811249 5.056182 
1 1 1   14   19   13 o  109.458   2.4821  247.412   11.173  249.751   16.478  245.422   15.200  109.928   3.6344  108.987   3.3815 0.9406662 4.964179 
1 1 1   14   19   14 o  139.321   2.3867  399.819   13.630  412.136   20.575  390.186   18.196  141.214   3.5327  137.428   3.2102 3.785721 4.773358 
1 1 1   14   19   15 o   63.956   3.2008   84.882   8.3361  102.958   12.024   68.155   11.567   70.548   4.1325   57.363   4.8890 13.18498 6.401508 
1 1 1   14   19   16 o  164.857   2.5680  565.843   17.300  526.784   25.740  598.021   23.363  159.599   3.9103  170.114   3.3298 -10.51579 5.135968 
1 1 1   14   19   17 o  208.560   2.4167  898.652   20.782  919.525   29.821  878.942   28.979  210.912   3.4281  206.208   3.4073 4.703888 4.833364 
1 1 1   14   19   18 o  216.103   3.0769  954.963   26.539  920.779   33.276  1014.71   43.993  210.960   3.8245  221.246   4.8211 -10.28629 6.153819 
1 1 1   14   19   19 o  273.548   2.8937  1550.49   32.212  1555.78   42.290  1543.18   49.716  274.197   3.7395  272.900   4.4170 1.296814 5.787369 
1 1 1   14   19   20 o   89.489   2.8677  166.145   10.568  159.685   15.179  172.222   14.721   87.785   4.1924   91.194   3.9140 -3.408852 5.735463 
1 1 1   14   19   21 o   76.648   3.1973  124.393   9.8508   94.086   14.109  153.215   13.760   67.290   5.0838   86.005   3.8790 -18.71504 6.394592 
1 1 1   14   19   22 o  145.483   2.9106  444.789   17.048  469.639   22.214  409.182   26.591  150.592   3.5765  140.374   4.5928 10.21774 5.821152 
1 1 1   14   19   23 o   76.384   4.1144  123.569   12.001  117.665   21.203  126.352   14.557   74.819   6.8711   77.950   4.5278 -3.130829 8.228835 
1 1 1   14   19   24 o   68.603   5.7210   82.653   12.370   74.515   13.400  129.565   32.172   59.710   5.4413   77.496   10.065 -17.78657 11.44204 
1 1 1   14   19   25 o   49.965   4.3395   52.757   8.8488   50.600   13.358   54.444   11.813   48.972   6.6132   50.958   5.6204 -1.986095 8.678925 
1 1 1   14   19   26 o   18.954   5.2310  -1.5216   7.4880 -20.8926   11.551   12.518   9.8340   13.213   6.4517   24.695   8.2359 -11.48170 10.46202 
1 1 1   14   19   27 o   81.881   3.2466  139.708   10.946  145.299   16.046  134.841   14.971   83.393   4.6652   80.369   4.5163 3.024460 6.493191 
1 1 1   14   19   28 o   44.870   7.0590   42.912   13.335   70.327   20.918   24.144   17.307   56.689   8.9465   33.050   10.921 23.63953 14.11793 
1 1 1   14   19   29 o   52.606   5.0539   56.200   10.271   50.692   12.278   69.041   18.747   48.839   6.0954   56.374   8.0630 -7.534798 10.10773 
1 1 1   14   19   30 o   86.943   5.9680  162.525   18.899  159.273   22.019  171.619   36.827   86.483   6.1731   87.404   10.216 -0.9203110 11.93604 
1 1 1   14   19   31 o   24.798   6.7402   10.652   9.5023   14.379   10.996  -0.3408   18.883   26.021   8.7091   23.575   10.290 2.445608 13.48042 
1 1 1   14   19   32 o   44.761   6.4171   41.709   10.547   35.481   12.369   58.301   20.190   39.646   7.8419   49.875   10.160 -10.22920 12.83420 
1 1 1   14   19   33 o   39.586   6.9523   36.516   10.451   36.231   12.259   37.273   19.998   40.067   7.6979   39.106   11.579 0.9604759 13.90466 
1 1 1   14   19   34 o   45.411   7.9996   50.723   14.936   48.611   21.149   52.825   21.097   44.351   11.474   46.471   11.150 -2.119705 15.99925 
1 1 1   14   19   35 o   27.370   7.4235   13.637   10.096   12.303   11.367   18.621   21.974   24.396   8.8112   30.344   11.950 -5.948400 14.84691 
1 1 1   14   19   36 f   39.700   7.4215   37.191   11.438   34.119   13.491   45.043   21.568   37.845   8.8085   41.556   11.947 -3.711456 14.84301 
1 1 1   14   19   37 o   27.383   7.1682   7.6996   9.8275  -0.3659   11.136   36.088   20.893   17.915   7.8582   36.851   11.991 -18.93603 14.33641 
1 1 1   14   19   38 o   18.720   6.1642 -21.1639   9.2430 -30.3223   10.401   13.231   20.156   10.471   5.2721   26.968   11.144 -16.49712 12.32850 
1 1 1   14   19   39 o   38.161   8.9475   39.556   12.762   39.910   13.230   34.811   48.404   40.803   8.1467   35.518   15.933 5.285892 17.89500 
1 1 1   14   19   40 o   29.958   7.0507   1.0102   10.750 -14.4281   12.070   60.271   23.647   14.339   6.9036   45.578   12.296 -31.23969 14.10132 
1 1 1   14   19   41 o   51.844   7.9958   78.372   14.774   82.066   16.931   66.583   30.248   59.591   6.8887   44.097   14.432 15.49363 15.99151 
1 1 1   14   19   42 o   37.354   9.7901   51.229   21.435   33.039   32.201   65.703   28.723   31.647   13.625   43.062   14.062 -11.41498 19.58018 
1 1 1   14   20    0 o   80.274   3.1658  134.323   14.718  134.323   14.718  134.323   14.718   80.274   4.4771   80.274   4.4771 0.000000 0.000000 
1 1 1   14   20    1 o  140.851   2.3362  409.715   13.570  418.883   19.336  400.819   19.048  142.404   3.2921  139.298   3.3155 3.105942 4.672325 
1 1 1   14   20    2 o  171.651   2.1940  608.606   15.132  608.035   24.313  608.966   19.332  171.557   3.4361  171.745   2.7292 -0.1878967 4.388075 
1 1 1   14   20    3 o  268.434   2.9834  1495.99   31.259  1471.30   53.489  1508.80   38.521  266.626   4.8641  270.242   3.4560 -3.616943 5.966846 
1 1 1   14   20    4 o  368.164   3.5719  2823.26   51.708  2748.68   86.881  2864.17   64.345  364.153   5.7847  372.175   4.1918 -8.022430 7.143777 
1 1 1   14   20    5 o  197.293   2.6583  807.453   20.307  795.749   35.332  813.226   24.815  196.146   4.3674  198.440   3.0320 -2.293640 5.316686 
1 1 1   14   20    6 o  199.274   2.6733  829.295   20.806  793.701   35.303  848.237   25.754  195.889   4.3695  202.659   3.0811 -6.770721 5.346577 
1 1 1   14   20    7 o   48.767   3.4701   45.930   6.3708   57.407   12.273   41.696   7.4538   52.627   5.6542   44.908   4.0243 7.719082 6.940104 
1 1 1   14   20    8 f   98.441   2.5800  191.002   9.5135  222.454   18.254  179.273   11.147  103.708   4.2676   93.174   2.9007 10.53410 5.160083 
1 1 1   14   20    9 o  190.945   2.5859  761.126   18.813  733.520   33.539  773.799   22.725  188.311   4.3182  193.579   2.8462 -5.267822 5.171853 
1 1 1   14   20   10 o  165.044   2.5619  574.622   16.164  531.199   28.317  595.611   19.687  160.252   4.2843  169.836   2.8105 -9.584259 5.123861 
1 1 1   14   20   11 o  211.790   2.7655  930.166   22.989  918.379   38.922  936.481   28.490  210.671   4.4795  212.909   3.2444 -2.238052 5.530994 
1 1 1   14   20   12 o  145.938   2.3945  441.152   14.373  422.206   20.830  458.371   19.858  142.927   3.5336  148.949   3.2325 -6.022507 4.789096 
1 1 1   14   20   13 f  130.024   2.6786  347.381   14.234  334.333   18.748  365.135   21.869  127.179   3.5742  132.870   3.9906 -5.691048 5.357190 
1 1 1   14   20   14 o  164.091   2.4382  557.711   16.446  539.644   24.034  573.622   22.554  161.569   3.6066  166.613   3.2821 -5.043564 4.876423 
1 1 1   14   20   15 f  158.370   2.3352  518.239   15.252  525.888   21.772  510.870   21.372  159.517   3.3093  157.224   3.2957 2.292709 4.670460 
1 1 1   14   20   16 o   78.707   3.1021  128.927   9.8731  124.942   15.446  131.681   12.838   77.639   4.8236   79.775   3.9018 -2.136246 6.204172 
1 1 1   14   20   17 o   42.881   4.7402   39.987   7.8851   28.177   11.257   51.362   11.048   36.028   7.8018   49.734   5.3859 -13.70613 9.480322 
1 1 1   14   20   18 o   82.199   3.5014  142.961   11.413  151.300   14.537  129.565   18.425   85.465   4.1240   78.934   5.6595 6.530975 7.002708 
1 1 1   14   20   19 o   61.952   3.9273   78.447   9.9442   68.971   13.057   91.532   15.344   57.582   5.4980   66.323   5.6094 -8.741013 7.854519 
1 1 1   14   20   20 o  125.869   4.6497  331.897   23.983  339.752   32.368  322.334   35.710  127.627   6.1491  124.111   6.9762 3.515953 9.299378 
1 1 1   14   20   21 o   67.552   3.3874   94.216   9.3877  109.078   13.877   81.677   12.747   72.446   4.6444   62.659   4.9325 9.787392 6.774897 
1 1 1   14   20   22 o   76.628   3.3863  122.571   10.632  119.408   15.856  125.155   14.332   75.681   5.0796   77.574   4.4794 -1.893013 6.772568 
1 1 1   14   20   23 o   91.485   3.5215  172.268   12.424  181.295   22.113  168.104   15.019   93.032   5.7629   89.937   4.0488 3.095070 7.043049 
1 1 1   14   20   24 o   68.558   4.4252  101.617   11.164   92.960   20.742  105.147   13.246   66.105   7.6077   71.011   4.5225 -4.905609 8.850462 
1 1 1   14   20   25 o   25.629   6.9440   10.603   8.8836   8.9029   19.716   11.036   9.9510   27.503   11.153   23.755   8.2759 3.748161 13.88798 
1 1 1   14   20   26 o   31.650   6.0367   21.961   7.9674   24.733   12.447   20.036   10.370   33.245   8.9008   30.054   8.1573 3.191689 12.07331 
1 1 1   14   20   27 o   81.809   3.2851  141.063   10.991  133.797   16.390  147.001   14.816   79.784   4.9807   83.834   4.2851 -4.049873 6.570284 
1 1 1   14   20   28 o   66.207   4.1862   91.682   11.062   87.930   13.865   98.251   18.346   64.581   5.2055   67.832   6.5573 -3.251434 8.372343 
1 1 1   14   20   29 o   79.623   4.7256  136.169   15.431  120.035   21.813  152.334   21.833   74.707   7.0793   84.540   6.2618 -9.832253 9.451245 
1 1 1   14   20   30 o   38.318   6.6264   33.749   9.8216   34.021   11.776   33.126   17.800   39.049   7.5854   37.587   10.867 1.462128 13.25273 
1 1 1   14   20   31 o   69.840   9.7005  135.023   14.522  137.742   15.128  103.098   51.831   80.870   4.5356   58.809   18.863 22.06133 19.40098 
1 1 1   14   20   32 o  124.091   3.2802  318.206   16.179  300.787   20.103  350.234   27.259  119.697   4.0720  128.486   5.1438 -8.788780 6.560456 
1 1 1   14   20   33 o   51.433   5.5177   52.035   10.898   41.724   12.853   78.398   20.552   43.669   7.1363   59.198   8.4174 -15.52867 11.03542 
1 1 1   14   20   34 o   70.161   6.3146  109.295   17.707  126.132   29.585   99.897   22.103   73.591   9.7471   66.731   8.0306 6.860191 12.62920 
1 1 1   14   20   35 o   48.354   6.6582   64.283   11.596   76.562   13.870   35.766   21.137   59.507   5.6511   37.202   12.058 22.30458 13.31639 
1 1 1   14   20   36 f   52.407   6.0571   63.431   11.695   62.259   14.038   66.090   21.142   53.149   6.4039   51.665   10.283 1.483471 12.11429 
1 1 1   14   20   37 o   28.183   7.3317   18.796   10.874   20.786   12.769   13.542   20.745   29.136   9.3646   27.230   11.283 1.906300 14.66331 
1 1 1   14   20   38 o   36.102   7.7239   25.973   11.324   16.355   12.911   58.051   23.578   26.461   9.4090   45.743   12.252 -19.28182 15.44786 
1 1 1   14   20   39 o   23.280   6.5363   8.7550   10.938   18.956   12.389 -27.2906   23.289   27.582   9.2443   18.977   9.2430 8.604799 13.07252 
1 1 1   14   20   40 o   38.818   7.1445   44.296   12.072   50.858   14.130   26.568   23.226   46.658   7.3429   30.978   12.258 15.68026 14.28891 
1 1 1   14   20   41 o   26.011   7.2865   16.179   12.840   24.497   14.700 -10.5887   26.371   29.886   10.069   22.136   10.535 7.749945 14.57291 
1 1 1   14   20   42 o   29.164   9.1090   17.176   21.553   48.442   34.284  -3.2580   27.716   34.882   14.484   23.445   11.050 11.43711 18.21807 
1 1 1   14   21    0 o  164.156   2.3837  556.924   22.802  556.924   22.802  556.924   22.802  164.156   3.3711  164.156   3.3711 0.000000 0.000000 
1 1 1   14   21    1 o  369.603   3.1972  2820.63   48.114  2862.78   74.478  2790.44   63.033  371.875   4.8559  367.333   4.1605 4.541931 6.394456 
1 1 1   14   21    2 o  162.462   2.1847  546.924   14.300  536.698   22.696  553.656   18.415  161.171   3.4142  163.753   2.7265 -2.582611 4.369317 
1 1 1   14   21    3 o  324.352   3.2057  2183.52   39.077  2160.49   71.836  2193.20   46.571  322.909   5.3938  325.796   3.4658 -2.887421 6.411304 
1 1 1   14   21    4 o  158.971   2.5591  523.682   15.710  518.259   27.505  526.308   19.139  158.298   4.2127  159.644   2.9067 -1.345612 5.118245 
1 1 1   14   21    5 o  175.192   2.5936  643.008   17.738  606.820   30.009  662.442   21.991  171.286   4.2477  179.098   2.9771 -7.812531 5.187150 
1 1 1   14   21    6 o  126.525   2.5255  314.724   12.042  370.496   22.910  293.433   14.155  133.847   4.1501  119.204   2.8791 14.64296 5.050988 
1 1 1   14   21    7 o  234.114   2.7572  1128.24   24.065  1144.69   45.134  1121.70   28.445  235.176   4.6531  233.052   2.9593 2.123520 5.514427 
1 1 1   14   21    8 o  142.433   2.5200  416.378   13.461  426.250   25.051  412.371   15.961  143.548   4.2311  141.318   2.7385 2.230530 5.040019 
1 1 1   14   21    9 o   76.300   2.8337  114.337   8.1553  135.415   15.508  106.280   9.5881   80.878   4.6491   71.722   3.2413 9.156418 5.667430 
1 1 1   14   21   10 o  175.176   2.7350  645.699   19.353  567.002   29.404  705.847   25.706  165.536   4.3067  184.815   3.3723 -19.27956 5.469955 
1 1 1   14   21   11 o  116.506   2.6701  285.784   12.142  264.250   20.429  297.545   15.098  112.998   4.3834  120.015   3.0501 -7.017189 5.340194 
1 1 1   14   21   12 f   48.685   4.1217   49.222   7.8123   49.110   13.482   49.279   9.5857   48.591   6.7270   48.779   4.7646 -0.1877403 8.243446 
1 1 1   14   21   13 o   99.645   2.9373  203.948   11.931  196.005   15.589  215.179   18.537   97.342   3.8828  101.947   4.4085 -4.605042 5.874599 
1 1 1   14   21   14 o   40.997   4.8193   37.509   7.5756   25.942   11.378   46.721   10.153   34.538   8.1236   47.457   5.1873 -12.91936 9.638508 
1 1 1   14   21   15 o   65.262   3.5960   88.862   9.3198   86.519   15.311   90.242   11.747   64.519   5.7537   66.005   4.3149 -1.486305 7.191933 
1 1 1   14   21   16 o  137.951   2.4458  393.662   13.904  372.583   19.533  415.315   19.797  134.199   3.5290  141.703   3.3874 -7.504562 4.891653 
1 1 1   14   21   17 o   48.655   4.5879   50.108   8.9407   52.732   11.538   46.165   14.144   50.348   5.5565   46.962   7.3022 3.386200 9.175856 
1 1 1   14   21   18 o  108.705   2.7847  245.781   12.330  238.271   18.827  251.422   16.317  107.203   4.2581  110.206   3.5897 -3.003662 5.569329 
1 1 1   14   21   19 o  136.978   3.8100  399.774   19.017  410.916   22.372  370.760   36.103  140.815   3.8521  133.140   6.5746 7.675262 7.619975 
1 1 1   14   21   20 o   36.578   5.1823   26.182   8.5450   3.7066   11.165   57.967   13.277   20.530   8.3672   52.627   6.1168 -32.09646 10.36466 
1 1 1   14   21   21 o   96.254   3.5641  196.667   12.832  184.802   23.427  201.752   15.338   93.908   6.0486   98.601   3.7716 -4.692879 7.128149 
1 1 1   14   21   22 o   62.685   3.5844   82.271   9.2406   78.669   13.391   85.545   12.767   61.336   5.2935   64.034   4.8343 -2.697983 7.168802 
1 1 1   14   21   23 o   52.317   4.7728   54.810   9.9867   45.664   12.407   71.637   16.829   46.505   6.4686   58.128   7.0197 -11.62275 9.545595 
1 1 1   14   21   24 o  129.637   3.0689  357.684   15.683  324.055   25.646  377.769   19.821  124.436   4.9970  134.839   3.5640 -10.40252 6.137771 
1 1 1   14   21   25 o   81.818   3.1243  141.287   10.422  120.733   15.058  160.182   14.438   75.952   4.8070   87.684   3.9922 -11.73242 6.248581 
1 1 1   14   21   26 o  141.328   2.6786  415.740   15.597  396.812   21.471  436.885   22.694  137.935   3.7742  144.720   3.8020 -6.785294 5.357203 
1 1 1   14   21   27 o  150.430   3.2780  474.954   20.323  499.682   28.940  450.894   28.546  154.343   4.5461  146.516   4.7238 7.826859 6.556022 
1 1 1   14   21   28 o   17.994   5.3873   0.5122   7.1480  -6.2208   11.282   5.0279   9.2390   16.459   7.5060   19.528   7.7299 -3.069336 10.77461 
1 1 1   14   21   29 o   29.816   6.8962   19.580   9.4808   20.200   11.605   18.336   16.441   29.922   8.8101   29.709   10.612 0.2126293 13.79248 
1 1 1   14   21   30 o   43.058   6.2695   41.070   10.199   38.237   12.356   47.127   18.066   41.323   7.5268   44.793   10.029 -3.470367 12.53905 
1 1 1   14   21   31 o   26.591   8.9000  -2.8685   9.9949  -3.7539   10.221   16.444   47.738   16.253   7.3040   36.929   16.232 -20.67622 17.80005 
1 1 1   14   21   32 f   20.966   6.3030  -8.5341   8.7098 -16.4212   9.9214   17.970   18.188   12.434   6.0508   29.498   11.059 -17.06467 12.60596 
1 1 1   14   21   33 f   60.225   6.0937   82.253   15.127   83.084   21.817   81.485   20.992   60.431   8.7534   60.019   8.4799 0.4114265 12.18734 
1 1 1   14   21   34 o   81.163   5.2003  145.027   17.230  119.618   23.112  176.817   25.852   72.986   7.6779   89.340   7.0159 -16.35431 10.40061 
1 1 1   14   21   35 o   51.867   5.8664   61.605   11.215   60.454   13.463   64.214   20.268   52.496   6.2181   51.238   9.9495 1.258579 11.73277 
1 1 1   14   21   36 o   45.037   6.7197   50.905   11.112   52.540   13.094   46.696   21.006   48.534   6.5411   41.540   11.740 6.993969 13.43943 
1 1 1   14   21   37 o   46.429   6.8179   59.994   11.987   70.842   14.483   36.403   21.359   56.513   6.2135   36.344   12.138 20.16888 13.63588 
1 1 1   14   21   38 o   26.710   7.2301   3.5297   10.611  -7.4555   12.079   40.688   22.215   16.063   7.4810   37.357   12.375 -21.29439 14.46016 
1 1 1   14   21   39 o   67.241   5.2105   92.667   13.064   77.153   15.084  139.228   26.132   58.459   6.2561   76.023   8.3341 -17.56432 10.42092 
1 1 1   14   21   40 o   23.817   8.1363  -2.4178   12.632  -4.3189   13.174   19.292   44.518   17.417   8.0056   30.217   14.167 -12.80017 16.27259 
1 1 1   14   21   41 o   50.640   6.4220   32.390   12.702   4.5597   13.933  169.432   30.917   20.458   8.8849   80.821   9.2750 -60.36222 12.84394 
1 1 1   14   22    0 o  243.770   3.3394  1229.18   47.442  1229.18   47.442  1229.18   47.442  243.770   4.7226  243.770   4.7226 0.000000 0.000000 
1 1 1   14   22    1 o  142.368   2.5240  419.589   14.764  427.385   20.125  410.502   21.725  143.817   3.3928  140.918   3.7379 2.899063 5.048088 
1 1 1   14   22    2 o  262.856   2.7982  1427.81   30.323  1398.57   42.130  1459.23   43.679  260.071   3.9277  265.641   3.9867 -5.569611 5.596434 
1 1 1   14   22    3 o  165.027   2.5253  556.675   15.571  577.537   29.254  548.428   18.393  167.084   4.2450  162.969   2.7365 4.114456 5.050617 
1 1 1   14   22    4 o   79.874   2.8846  133.715   8.6563  127.655   15.775  136.326   10.354   78.512   4.8716   81.237   3.0903 -2.724739 5.769121 
1 1 1   14   22    5 f  156.958   2.5190  511.196   14.884  504.312   27.266  514.118   17.765  156.128   4.2343  157.787   2.7298 -1.659332 5.037917 
1 1 1   14   22    6 o  129.665   2.5448  352.387   12.433  335.494   22.531  359.784   14.909  127.335   4.2901  131.995   2.7386 -4.660049 5.089698 
1 1 1   14   22    7 o  138.093   2.2780  398.568   12.820  352.839   18.913  437.435   17.437  130.656   3.5098  145.530   2.9050 -14.87401 4.556048 
1 1 1   14   22    8 o  159.078   2.2739  526.356   14.766  495.244   22.153  551.232   19.809  154.794   3.4699  163.362   2.9399 -8.567245 4.547896 
1 1 1   14   22    9 o  160.618   2.2300  526.115   14.286  559.687   23.731  507.032   17.892  164.550   3.4966  156.686   2.7686 7.863297 4.459950 
1 1 1   14   22   10 f  116.190   2.6658  283.016   12.062  267.338   20.512  291.304   14.914  113.639   4.3763  118.741   3.0452 -5.102028 5.331543 
1 1 1   14   22   11 o  278.061   2.9841  1606.18   31.352  1586.56   57.078  1614.66   37.518  276.625   5.0028  279.497   3.2546 -2.872162 5.968270 
1 1 1   14   22   12 o   79.023   3.0052  129.919   8.9393  127.823   16.363  130.811   10.673   78.499   5.0540   79.548   3.2530 -1.048302 6.010370 
1 1 1   14   22   13 o  210.878   3.5410  924.773   30.356  935.542   39.836  909.859   46.877  212.458   4.5461  209.298   5.4303 3.160233 7.082070 
1 1 1   14   22   14 f  247.459   2.9783  1274.89   29.169  1246.41   48.360  1291.18   36.570  245.110   4.7836  249.809   3.5494 -4.698685 5.956602 
1 1 1   14   22   15 o   89.257   3.1956  170.268   11.136  148.421   18.383  182.931   13.996   84.503   5.2744   94.010   3.6095 -9.507217 6.391234 
1 1 1   14   22   16 o  288.465   3.0160  1725.20   35.883  1731.53   50.931  1718.95   50.563  288.988   4.2730  287.942   4.2576 1.046082 6.032066 
1 1 1   14   22   17 o   25.293   5.8571   13.073   6.9997   11.431   11.121   14.150   9.0078   24.755   8.7400   25.830   7.7997 -1.074690 11.71419 
1 1 1   14   22   18 o  135.737   2.8876  388.564   15.558  358.218   25.190  407.279   19.783  131.255   4.6532  140.219   3.4207 -8.964783 5.775227 
1 1 1   14   22   19 o  171.300   2.8286  610.350   19.831  618.320   26.554  600.300   29.820  172.643   3.7293  169.957   4.2540 2.685898 5.657189 
1 1 1   14   22   20 o  136.202   2.7644  386.664   15.266  392.896   19.939  377.836   23.733  137.627   3.5126  134.777   4.2694 2.850403 5.528702 
1 1 1   14   22   21 o  109.552   2.7357  249.707   12.349  256.407   17.247  242.659   17.690  111.084   3.7644  108.020   3.9705 3.064743 5.471381 
1 1 1   14   22   22 o   28.327   5.7580   17.905   7.2154   13.138   11.077   21.417   9.5094   25.540   8.7402   31.115   7.4983 -5.574627 11.51594 
1 1 1   14   22   23 o   52.996   4.5922   58.098   9.8309   53.489   12.500   65.573   15.918   50.391   6.0142   55.600   6.9413 -5.208900 9.184365 
1 1 1   14   22   24 o   76.137   4.0450  126.604   11.454  111.804   20.696  133.138   13.751   72.415   6.9295   79.860   4.1750 -7.445152 8.090001 
1 1 1   14   22   25 o   88.759   3.3358  170.125   11.794  142.577   18.287  189.745   15.433   82.188   5.3948   95.330   3.9252 -13.14182 6.671616 
1 1 1   14   22   26 o   36.441   5.5676   29.795   8.1111   29.740   11.851   29.843   11.125   36.335   8.1131   36.547   7.6270 -0.2127876 11.13523 
1 1 1   14   22   27 o  110.218   3.8223  257.507   17.308  246.171   25.257  267.544   23.766  107.784   5.6814  112.652   5.1150 -4.867805 7.644694 
1 1 1   14   22   28 o   69.798   4.4679  109.052   12.166  125.991   15.769   84.140   19.123   77.294   4.9463   62.301   7.4420 14.99327 8.935851 
1 1 1   14   22   29 o   69.266   4.2317  104.809   11.443  110.308   14.316   95.077   19.043   72.278   4.8022   66.253   6.9690 6.024971 8.463317 
1 1 1   14   22   30 o   23.166   6.4847   2.4152   8.9156  -4.5240   10.562   19.618   16.630   16.276   7.3593   30.055   10.679 -13.77856 12.96948 
1 1 1   14   22   31 o   24.776   6.8717   9.8471   9.5345   8.7050   11.362   12.566   17.532   22.553   8.6738   26.999   10.661 -4.446669 13.74347 
1 1 1   14   22   32 o   35.359   8.9856   22.729   11.079   20.363   11.622   46.290   36.669   29.537   8.8461   41.180   15.643 -11.64333 17.97115 
1 1 1   14   22   33 o   27.879   7.3212   14.862   10.264   11.540   12.054   23.623   19.575   24.099   9.0091   31.658   11.543 -7.559299 14.64240 
1 1 1   14   22   34 o   21.752   6.6845   3.1762   9.6880   3.5677   10.993   1.8147   20.499   19.496   8.1573   24.008   10.592 -4.512815 13.36893 
1 1 1   14   22   35 o   24.740   7.4572   7.1020   13.452   12.612   19.651   2.2430   18.453   26.622   11.003   22.858   10.069 3.764187 14.91430 
1 1 1   14   22   36 o   51.037   6.0197   58.894   11.440   54.162   13.643   70.098   20.995   49.131   6.7330   52.944   9.9807 -3.813843 12.03945 
1 1 1   14   22   37 o   40.810   6.9823   33.006   10.891   19.971   12.513   73.734   22.119   28.306   9.2831   53.314   10.433 -25.00793 13.96470 
1 1 1   14   22   38 o   42.528   7.4985   49.560   12.315   50.852   14.201   45.642   24.730   46.702   7.3728   38.354   13.059 8.347118 14.99698 
1 1 1   14   22   39 f   27.658   7.5080   7.0823   10.831  -3.1609   12.157   46.533   23.857   17.135   7.8055   38.181   12.828 -21.04655 15.01595 
1 1 1   14   22   40 o   31.458   10.057   27.712   14.742   27.712   14.742   0.0000   0.0000   31.458   10.057  ?   ?       ?      ? 
1 1 1   14   23    0 o  146.512   2.6309  444.100   22.450  444.100   22.450  444.100   22.450  146.512   3.7206  146.512   3.7206 0.000000 0.000000 
1 1 1   14   23    1 o   80.714   3.1770  134.757   10.572  129.647   14.739  140.172   15.173   79.138   4.5155   82.290   4.4704 -3.152771 6.354061 
1 1 1   14   23    2 o  110.550   2.4870  251.240   11.107  259.338   17.709  245.990   14.260  111.986   3.8341  109.114   3.1686 2.872108 4.974004 
1 1 1   14   23    3 o   51.265   3.5220   52.767   6.7501   58.448   12.856   50.605   7.9313   53.064   5.8741   49.466   3.8875 3.598064 7.044013 
1 1 1   14   23    4 o  135.282   2.5629  379.555   13.310  375.115   23.554  381.638   16.133  134.636   4.2418  135.929   2.8777 -1.292587 5.125777 
1 1 1   14   23    5 o  166.715   2.2256  567.096   14.779  601.570   24.619  547.675   18.478  170.588   3.4991  162.843   2.7512 7.745651 4.451175 
1 1 1   14   23    6 o  144.485   2.2000  425.362   12.677  454.432   21.082  408.899   15.866  148.265   3.4475  140.704   2.7339 7.560455 4.399940 
1 1 1   14   23    7 o  179.403   2.2484  661.090   16.122  681.515   26.459  649.029   20.333  181.548   3.5335  177.258   2.7811 4.290100 4.496738 
1 1 1   14   23    8 o   63.383   3.0433   83.906   7.8778   76.700   11.668   89.942   10.679   60.839   4.6501   65.928   3.9273 -5.088352 6.086659 
1 1 1   14   23    9 o  185.836   2.2884  712.712   17.040  719.036   27.645  708.838   21.640  186.446   3.5950  185.225   2.8326 1.221420 4.576835 
1 1 1   14   23   10 o  133.820   2.6025  369.845   13.521  372.526   23.528  368.524   16.521  134.108   4.2537  133.533   2.9998 0.5748444 5.205082 
1 1 1   14   23   11 o  121.537   2.3165  307.938   11.274  294.774   18.068  316.330   14.427  119.350   3.6704  123.724   2.8271 -4.374184 4.633011 
1 1 1   14   23   12 o  281.494   3.1291  1652.76   34.937  1606.37   57.539  1679.85   43.970  278.131   5.0159  284.858   3.7425 -6.726654 6.258238 
1 1 1   14   23   13 o  182.614   3.0066  691.518   22.598  688.145   32.999  694.495   31.010  182.163   4.3922  183.066   4.1071 -0.9026337 6.013290 
1 1 1   14   23   14 o   65.315   4.2077   88.441   11.335   0.0000   0.0000   88.441   11.335  ?   ?    65.315   4.2077      ?      ? 
1 1 1   14   23   15 o  100.517   3.0320  211.437   11.973  203.511   20.090  215.802   14.909   98.948   4.9227  102.087   3.5410 -3.138786 6.063997 
1 1 1   14   23   16 o  142.885   2.5043  423.115   14.752  425.344   20.608  420.773   21.128  143.281   3.4872  142.488   3.5951 0.7927246 5.008556 
1 1 1   14   23   17 o  178.526   2.6233  660.558   19.304  629.049   26.907  693.979   27.711  174.132   3.7464  182.920   3.6731 -8.787445 5.246619 
1 1 1   14   23   18 o  157.361   2.4005  512.908   15.572  528.253   22.474  498.737   21.596  159.618   3.4137  155.103   3.3759 4.514206 4.801034 
1 1 1   14   23   19 o   18.378   5.2881   2.4138   6.5432  -3.3966   10.116   6.5938   8.5797   16.549   7.3637   20.206   7.5916 -3.656582 10.57617 
1 1 1   14   23   20 o   70.239   3.2001  103.085   9.2349  101.209   13.601  104.691   12.579   69.606   4.7376   70.873   4.3033 -1.266594 6.400255 
1 1 1   14   23   21 o   44.792   5.1517   40.703   8.9199   26.515   11.314   64.004   14.499   34.537   8.0855   55.048   6.3862 -20.51104 10.30339 
1 1 1   14   23   22 o  133.075   3.2529  370.395   17.821  343.548   25.135  397.529   25.269  128.162   4.7551  137.988   4.4401 -9.825745 6.505771 
1 1 1   14   23   23 o  118.780   2.9851  290.937   14.262  277.674   18.079  312.791   23.207  115.398   3.7984  122.162   4.6060 -6.764145 5.970199 
1 1 1   14   23   24 o  113.656   3.1592  271.154   14.035  269.396   23.973  272.071   17.312  113.080   5.1401  114.232   3.6744 -1.152359 6.318396 
1 1 1   14   23   25 o   81.267   4.0093  143.204   12.118  131.941   22.150  148.016   14.477   78.436   6.8468   84.098   4.1737 -5.662140 8.018585 
1 1 1   14   23   26 o   77.253   3.2329  125.717   10.259  118.368   14.898  132.346   14.149   75.024   4.8145   79.482   4.3160 -4.457771 6.465900 
1 1 1   14   23   27 o   45.684   4.5003   45.304   8.3462   40.355   12.490   49.297   11.219   43.217   7.0073   48.151   5.6489 -4.934505 9.000670 
1 1 1   14   23   28 o   98.193   2.9273  203.368   11.793  185.219   16.995  220.223   16.378   93.840   4.3910  102.547   3.8723 -8.706779 5.854508 
1 1 1   14   23   29 o   81.832   3.3019  142.727   10.959  133.812   16.789  149.344   14.465   79.384   5.1278   84.280   4.1613 -4.896179 6.603849 
1 1 1   14   23   30 o   33.196   6.7230   27.447   9.5129   30.918   11.093   17.803   18.492   36.905   7.5428   29.488   11.131 7.416206 13.44607 
1 1 1   14   23   31 o   26.172   6.9354   12.051   9.2288   9.0639   10.820   20.026   17.680   22.347   8.4954   29.997   10.965 -7.650146 13.87086 
1 1 1   14   23   32 o   24.339   7.4708   7.3623   10.430   10.122   10.927 -20.9408   34.993   22.875   8.5725   25.804   12.238 -2.928736 14.94160 
1 1 1   14   23   33 o   58.127   5.3194   72.702   11.561   68.106   13.574   84.839   22.059   55.895   5.8882   60.359   8.8607 -4.464123 10.63874 
1 1 1   14   23   34 o   26.752   6.8660   16.653   9.9740   20.505   12.118   8.5644   17.561   29.005   9.1001   24.499   10.284 4.506800 13.73209 
1 1 1   14   23   35 o   30.327   7.0701   14.545   13.545   46.214   19.171 -17.0153   19.138   41.923   10.963   18.730   8.9304 23.19282 14.14020 
1 1 1   14   23   36 o   20.812   6.4177   3.3330   9.7134   5.2602   11.373  -1.8634   18.674   20.108   8.3452   21.517   9.7521 -1.409592 12.83536 
1 1 1   14   23   37 o   23.459   6.8738   9.5739   9.9123   9.7361   11.439   9.0849   19.862   22.139   8.6504   24.780   10.685 -2.641253 13.74751 
1 1 1   14   23   38 o   26.039   7.4849   13.888   11.223   11.264   12.949   21.812   22.501   23.158   9.1561   28.921   11.843 -5.763424 14.96974 
1 1 1   14   23   39 o   34.436   7.3945   37.150   12.644   44.934   15.070   18.640   23.240   41.454   9.0666   27.417   11.684 14.03648 14.78898 
1 1 1   14   24    0 f  195.202   2.5333  787.727   28.821  787.727   28.821  787.727   28.821  195.202   3.5826  195.202   3.5826 0.000000 0.000000 
1 1 1   14   24    1 o   75.173   2.9631  116.417   9.0075  114.104   11.592  119.942   14.310   74.263   3.7847   76.083   4.5602 -1.820084 5.926142 
1 1 1   14   24    2 o   91.719   2.9993  174.163   11.343  179.968   16.161  168.526   15.924   93.228   4.2029   90.209   4.2799 3.018944 5.998511 
1 1 1   14   24    3 o  152.449   2.4721  481.171   15.337  477.335   23.652  483.954   20.146  151.888   3.7756  153.010   3.1922 -1.121841 4.944263 
1 1 1   14   24    4 o   77.850   3.0618  132.501   8.7495  109.711   15.902  142.395   10.478   72.696   5.3038   83.004   3.0607 -10.30753 6.123535 
1 1 1   14   24    5 o  227.609   2.8088  1085.75   25.078  1028.16   42.035  1117.57   31.248  222.723   4.5759  232.495   3.2587 -9.771210 5.617655 
1 1 1   14   24    6 o   86.231   2.4205  153.710   8.2950  154.100   13.711  153.484   10.418   86.284   3.8529   86.179   2.9309 0.1054993 4.840968 
1 1 1   14   24    7 o   46.015   3.5013   44.376   6.2994   42.544   10.664   45.358   7.8070   45.230   5.7165   46.800   4.0446 -1.569416 7.002690 
1 1 1   14   24    8 o   72.346   2.7017  110.315   7.7078  101.355   12.660  115.592   9.7162   69.924   4.3898   74.768   3.1508 -4.843834 5.403455 
1 1 1   14   24    9 o   39.397   4.7710   32.554   6.5170   33.915   13.159   32.112   7.5017   39.452   8.3473   39.342   4.6231 0.1098557 9.542048 
1 1 1   14   24   10 o   47.971   4.3836   48.427   7.9049   46.900   14.429   49.082   9.4491   47.314   7.3939   48.629   4.7112 -1.315067 8.767294 
1 1 1   14   24   11 o   90.299   2.6540  168.734   9.8492  170.294   14.587  167.426   13.353   90.667   3.9006   89.931   3.6000 0.7366104 5.307977 
1 1 1   14   24   12 o  168.115   2.4996  577.927   17.214  649.595   26.280  524.071   22.781  177.120   3.5975  159.111   3.4715 18.00824 4.999285 
1 1 1   14   24   13 o   43.107   4.2006   42.155   6.3917   32.936   11.483   46.293   7.6938   38.967   7.4156   47.247   3.9482 -8.280563 8.401169 
1 1 1   14   24   14 o  157.428   3.3854  514.271   18.794  518.867   38.326  512.817   21.564  157.515   5.8994  157.342   3.3230 0.1729279 6.770859 
1 1 1   14   24   15 o  106.645   2.9524  238.001   12.663  228.367   20.064  244.379   16.325  104.743   4.6444  108.546   3.6465 -3.802956 5.904862 
1 1 1   14   24   16 o   49.482   4.2354   53.308   8.1464   44.725   13.374   58.372   10.272   46.036   7.0437   52.928   4.7055 -6.892056 8.470869 
1 1 1   14   24   17 o  102.297   2.5607  217.113   10.790  220.406   15.708  214.170   14.848  103.016   3.6970  101.577   3.5442 1.438705 5.121429 
1 1 1   14   24   18 o  115.022   2.8840  274.332   13.389  270.176   17.185  280.750   21.355  114.025   3.6542  116.019   4.4629 -1.993393 5.768081 
1 1 1   14   24   19 o  159.039   2.7538  528.191   17.646  517.314   27.973  535.380   22.742  157.516   4.3058  160.562   3.4342 -3.046158 5.507567 
1 1 1   14   24   20 o   61.320   3.3781   78.265   8.4871   81.567   12.866   75.721   11.293   62.421   4.9974   60.220   4.5467 2.201244 6.756195 
1 1 1   14   24   21 o   22.511   5.5207   6.6986   7.5870   18.692   10.263  -7.7515   11.266   28.989   8.2110   16.033   7.3818 12.95554 11.04139 
1 1 1   14   24   22 o   44.065   7.9316   44.292   10.880   44.507   11.618   42.764   31.020   45.761   6.1557   42.370   14.620 3.391182 15.86321 
1 1 1   14   24   23 o   60.550   3.6107   77.423   8.9222   76.027   13.565   78.488   11.845   59.968   5.4845   61.131   4.6979 -1.162743 7.221477 
1 1 1   14   24   24 o   48.120   4.5649   50.320   8.6528   46.234   14.190   52.738   10.917   46.267   7.4362   49.974   5.2967 -3.706966 9.129719 
1 1 1   14   24   25 o   84.694   4.0767  163.954   12.771  121.870   21.974  185.422   15.694   75.238   7.0813   94.151   4.0416 -18.91283 8.153439 
1 1 1   14   24   26 o   51.895   4.0443   57.215   8.5715   58.622   13.129   56.169   11.316   52.340   6.0816   51.450   5.3328 0.8903999 8.088513 
1 1 1   14   24   27 o   50.143   4.0572   53.035   8.3422   61.132   12.550   46.625   11.166   53.550   5.6821   46.737   5.7929 6.813622 8.114384 
1 1 1   14   24   28 o   35.105   5.4501   28.703   7.8276   20.495   11.798   35.155   10.462   29.836   8.9079   40.375   6.2822 -10.53943 10.90030 
1 1 1   14   24   29 o   36.627   5.4957   29.594   8.2695   42.804   12.488   19.278   11.035   44.310   6.8335   28.943   8.6091 15.36674 10.99149 
1 1 1   14   24   30 o   48.048   5.9166   51.116   10.831   47.434   13.182   58.768   19.004   46.437   6.8824   49.660   9.6259 -3.223026 11.83323 
1 1 1   14   24   31 o   44.296   6.1698   43.969   10.312   40.782   12.371   51.226   18.668   42.896   6.9921   45.695   10.167 -2.798943 12.33951 
1 1 1   14   24   32 o   20.265   6.2706   0.9792   9.7504   3.6318   11.987  -4.2071   16.762   20.124   8.4747   20.406   9.2446 -0.2813778 12.54126 
1 1 1   14   24   33 o   29.277   8.4683   17.970   11.695   19.452   12.078  -4.2725   46.802   28.333   9.1076   30.222   14.279 -1.888632 16.93668 
1 1 1   14   24   34 o   27.757   7.1029   17.683   9.8369   17.135   11.663   19.033   18.312   26.833   8.9692   28.680   11.016 -1.846804 14.20573 
1 1 1   14   24   35 o   21.597   6.8466  -1.4512   12.836  -9.3104   17.991   6.6990   18.321   19.406   9.0689   23.788   10.259 -4.381353 13.69312 
1 1 1   14   24   36 o   23.448   6.8563   3.8789   9.9887  -3.4439   11.669   23.949   19.319   16.866   7.6692   30.030   11.367 -13.16422 13.71253 
1 1 1   14   24   37 o   28.188   7.0784   21.471   10.550   25.087   12.302   11.413   20.516   31.065   9.0494   25.312   10.887 5.752327 14.15682 
1 1 1   14   24   38 o   25.490   7.2707   11.076   11.103   3.3058   13.232   29.569   20.412   19.740   8.6146   31.241   11.715 -11.50046 14.54134 
1 1 1   14   25    0 f   53.584   4.5481   62.043   13.673   62.043   13.673   62.043   13.673   53.584   6.4320   53.584   6.4320 0.000000 0.000000 
1 1 1   14   25    1 o  125.026   3.3059  331.776   15.403  342.496   18.392  306.592   28.191  128.657   3.4659  121.395   5.6305 7.262260 6.611728 
1 1 1   14   25    2 o   92.816   3.7108  163.995   13.159  142.254   15.500  220.114   24.903   82.816   4.5379  102.816   5.8726 -20.00076 7.421587 
1 1 1   14   25    3 o  112.813   3.0232  263.092   13.973  257.755   18.631  269.957   21.127  111.539   4.0498  114.087   4.4899 -2.548851 6.046477 
1 1 1   14   25    4 o  163.111   2.4771  550.548   16.661  535.206   23.441  566.211   23.685  160.810   3.5343  165.412   3.4717 -4.602707 4.954225 
1 1 1   14   25    5 o  117.810   2.5423  290.385   11.390  279.226   20.357  295.471   13.743  116.056   4.2527  119.563   2.7869 -3.507210 5.084578 
1 1 1   14   25    6 o  244.294   2.6022  1236.35   26.096  1228.05   38.758  1243.22   35.295  243.495   3.8593  245.092   3.4916 -1.596283 5.204323 
1 1 1   14   25    7 o  124.565   2.3116  325.914   11.695  277.157   17.177  368.042   15.967  115.705   3.5994  133.424   2.9015 -17.71849 4.623288 
1 1 1   14   25    8 o   55.564   3.0411   64.309   6.6283   63.139   11.217   64.937   8.2160   55.124   4.9338   56.005   3.5569 -0.8803558 6.082264 
1 1 1   14   25    9 o   47.929   3.7447   53.232   6.5723   33.209   10.807   64.984   8.2794   39.843   6.5763   56.015   3.5837 -16.17244 7.489387 
1 1 1   14   25   10 o  170.630   2.4336  603.536   17.092  556.397   24.063  651.537   24.282  163.874   3.5602  177.386   3.3190 -13.51227 4.867279 
1 1 1   14   25   11 o  137.333   2.2598  393.172   12.457  378.813   19.874  402.463   15.987  135.185   3.5643  139.482   2.7789 -4.296219 4.519634 
1 1 1   14   25   12 o   56.504   3.2731   65.629   7.4671   70.351   12.014   62.657   9.5317   58.095   5.0140   54.913   4.2085 3.182461 6.546169 
1 1 1   14   25   13 o   33.959   5.0621   24.346   6.7274   29.574   10.958   21.184   8.5224   36.777   7.4790   31.140   6.8240 5.636328 10.12429 
1 1 1   14   25   14 o   61.137   3.8787   85.554   8.8417   56.555   14.378  103.191   11.212   51.794   6.7305   70.480   3.8572 -18.68667 7.757376 
1 1 1   14   25   15 o   34.180   5.4695   25.788   7.1997   25.366   12.506   25.996   8.8054   33.753   8.8678   34.607   6.4050 -0.8537331 10.93903 
1 1 1   14   25   16 o  159.193   2.8624  533.834   18.535  479.780   27.713  577.584   24.932  151.667   4.4303  166.720   3.6258 -15.05302 5.724889 
1 1 1   14   25   17 o   96.026   2.8174  194.324   10.876  180.440   17.079  203.794   14.106   92.993   4.4530   99.059   3.4526 -6.065575 5.634733 
1 1 1   14   25   18 o   83.352   2.8323  145.848   9.6410  124.203   13.772  166.651   13.501   77.171   4.3268   89.534   3.6561 -12.36307 5.664692 
1 1 1   14   25   19 o   79.081   2.9214  130.344   9.4879  132.561   14.135  128.525   12.800   79.652   4.3025   78.510   3.9530 1.142189 5.842751 
1 1 1   14   25   20 o   89.646   2.8317  167.642   10.450  182.412   15.056  153.911   14.517   93.479   3.9051   85.812   4.1016 7.666489 5.663341 
1 1 1   14   25   21 o   20.947   5.6784   6.6570   6.7466   8.8529   10.775   5.2411   8.6525   22.639   8.5072   19.255   7.5236 3.383966 11.35679 
1 1 1   14   25   22 o   96.502   5.0158  217.417   15.070  228.532   16.849  172.966   33.694  104.590   3.9059   88.413   9.2399 16.17759 10.03152 
1 1 1   14   25   23 o   48.658   4.0245   49.324   7.9880   55.959   12.474   44.712   10.400   51.338   5.8911   45.978   5.4845 5.360188 8.048902 
1 1 1   14   25   24 o   89.546   3.6805  170.214   13.539  178.622   18.660  160.866   19.675   92.011   4.9169   87.081   5.4780 4.929840 7.361063 
1 1 1   14   25   25 o   25.255   6.7413   11.678   8.4233   9.2477   18.670   12.299   9.4386   26.432   10.802   24.078   8.0687 2.354425 13.48259 
1 1 1   14   25   26 o   24.719   5.7494   13.112   7.3239   4.2117   11.695   18.855   9.3942   20.628   8.5031   28.809   7.7407 -8.181358 11.49875 
1 1 1   14   25   27 o   19.985   5.7025   4.8427   7.1843   6.3833   11.020   3.7039   9.4743   21.171   8.4225   18.798   7.6899 2.372425 11.40497 
1 1 1   14   25   28 o   19.407   5.5107   1.0848   7.2319   12.120   11.200  -6.8071   9.4711   24.346   8.7520   14.467   6.6989 9.879184 11.02146 
1 1 1   14   25   29 o   65.196   3.6834   91.196   9.8904   88.906   14.251   93.324   13.738   64.327   5.3713   66.064   5.0418 -1.737022 7.366839 
1 1 1   14   25   30 o   51.383   5.4686   58.168   11.393   52.572   14.586   66.924   18.244   48.530   7.2872   54.237   8.1558 -5.706245 10.93714 
1 1 1   14   25   31 o   83.226   3.1580  148.018   10.806  134.886   15.286  161.135   15.277   79.401   4.6676   87.050   4.2550 -7.648628 6.316014 
1 1 1   14   25   32 o   28.028   7.0935   15.889   10.349   8.4591   12.911   29.243   17.308   22.529   9.0638   33.527   10.914 -10.99750 14.18695 
1 1 1   14   25   33 o   75.210   5.9084  127.419   13.755  124.772   15.125  140.087   33.085   76.066   4.8209   74.353   10.789 1.712929 11.81674 
1 1 1   14   25   34 o   35.969   7.0980   32.706   10.347   30.695   12.414   37.281   18.728   35.178   8.6230   36.760   11.277 -1.581833 14.19602 
1 1 1   14   25   35 o   38.119   6.8359   36.452   10.160   33.941   12.195   42.149   18.371   37.169   8.1768   39.068   10.957 -1.898567 13.67186 
1 1 1   14   25   36 o   32.960   8.2930   32.023   14.196   32.901   19.542   31.043   20.657   33.473   11.601   32.447   11.853 1.025784 16.58593 
1 1 1   14   25   37 o   32.165   7.4157   21.079   10.745   10.110   12.405   54.015   21.496   22.189   8.8995   42.141   11.865 -19.95168 14.83138 
1 1 1   14   26    0 o   35.640   7.9311   33.344   14.483   33.344   14.483   33.344   14.483   35.640   11.216   35.640   11.216 0.000000 0.000000 
1 1 1   14   26    1 o   92.210   3.1457  170.212   10.974  161.415   12.977  192.286   20.557   88.286   3.5640   96.135   5.1845 -7.848724 6.291337 
1 1 1   14   26    2 o   82.075   3.2175  140.390   10.851  150.041   15.096  130.073   15.609   85.033   4.3043   79.116   4.7835 5.917664 6.434978 
1 1 1   14   26    3 o   96.799   3.0411  193.797   12.112  185.220   16.451  203.952   17.900   94.479   4.2217   99.119   4.3785 -4.639565 6.082224 
1 1 1   14   26    4 o  114.435   2.4168  269.238   11.356  251.242   15.210  291.910   17.071  110.154   3.3478  118.715   3.4865 -8.560966 4.833575 
1 1 1   14   26    5 o   97.466   2.4970  196.764   10.031  195.312   13.899  198.341   14.490   97.099   3.4706   97.834   3.5910 -0.7343903 4.994044 
1 1 1   14   26    6 o   37.085   4.1347   28.217   6.1004   35.381   9.6642   23.473   7.8655   41.158   5.6931   33.012   5.9978 8.145802 8.269472 
1 1 1   14   26    7 o  114.362   3.6698  274.839   14.698  276.797   16.858  268.630   30.018  115.556   3.5370  113.168   6.4311 2.387512 7.339574 
1 1 1   14   26    8 o  105.782   2.3668  232.790   10.167  226.374   15.708  237.415   13.337  104.476   3.6453  107.088   3.0196 -2.612289 4.733550 
1 1 1   14   26    9 o   51.971   3.2915   58.175   6.6009   50.334   11.124   62.437   8.2008   49.076   5.4956   54.865   3.6241 -5.788273 6.582998 
1 1 1   14   26   10 o  108.151   2.2973  240.245   9.9120  250.800   16.386  234.155   12.448  109.945   3.6136  106.357   2.8376 3.587273 4.594530 
1 1 1   14   26   11 o   88.680   2.5436  169.575   8.8325  140.021   14.220  188.137   11.270   82.041   4.2026   95.320   2.8666 -13.27914 5.087179 
1 1 1   14   26   12 o   52.955   3.4868   60.316   7.2555   52.219   11.772   65.275   9.2135   49.887   5.7213   56.024   3.9874 -6.136528 6.973696 
1 1 1   14   26   13 o   97.401   2.9257  198.714   11.217  193.592   18.796  201.548   13.979   96.275   4.7334   98.527   3.4399 -2.252823 5.851377 
1 1 1   14   26   14 o  114.181   2.4575  271.139   11.545  248.558   16.285  293.954   16.369  109.363   3.6103  118.998   3.3352 -9.635376 4.915038 
1 1 1   14   26   15 o   68.526   3.1019   98.670   8.6973   89.610   12.722  106.619   11.917   65.491   4.7099   71.560   4.0377 -6.068153 6.203715 
1 1 1   14   26   16 o  132.352   2.5284  364.969   13.751  352.840   20.131  375.580   18.829  130.233   3.7478  134.470   3.3950 -4.236237 5.056879 
1 1 1   14   26   17 o  127.835   2.8110  347.429   14.347  311.924   22.693  371.073   18.518  122.081   4.5068  133.589   3.3609 -11.50815 5.622022 
1 1 1   14   26   18 o   60.188   3.6395   78.551   8.6287   67.604   13.877   85.451   11.018   56.454   5.9599   63.923   4.1789 -7.469379 7.278964 
1 1 1   14   26   19 o   62.719   3.3382   83.407   8.5453   74.741   12.570   90.852   11.652   59.562   5.1169   65.876   4.2884 -6.314129 6.676314 
1 1 1   14   26   20 o   45.856   4.1568   44.885   7.7864   42.586   11.661   46.735   10.460   44.687   6.3270   47.025   5.3929 -2.338722 8.313537 
1 1 1   14   26   21 o   46.752   4.7438   46.963   9.0445   48.004   12.020   45.604   13.732   47.492   6.1363   46.012   7.2361 1.480453 9.487635 
1 1 1   14   26   22 o   29.334   5.0431   19.523   7.1055   3.7599   10.672   32.074   9.5230   19.850   8.1456   38.819   5.9480 -18.96853 10.08612 
1 1 1   14   26   23 o   40.969   5.7149   37.787   9.4237   26.853   13.075   49.607   13.594   34.045   9.1257   47.893   6.8820 -13.84790 11.42978 
1 1 1   14   26   24 o   49.589   3.9967   51.253   8.0826   62.469   12.511   43.219   10.589   54.157   5.6010   45.020   5.7028 9.136974 7.993304 
1 1 1   14   26   25 o   44.327   4.3751   41.316   7.9045   50.374   12.297   34.937   10.319   48.379   6.1627   40.276   6.2119 8.102222 8.750196 
1 1 1   14   26   26 o   27.134   6.7309   15.656   8.4433   13.230   18.010   16.340   9.5589   27.427   10.813   26.842   8.0189 0.5857353 13.46177 
1 1 1   14   26   27 o   20.352   5.7000   4.8045   7.1519   11.003   11.268   0.6232   9.2550   23.644   8.7359   17.060   7.3241 6.584528 11.39991 
1 1 1   14   26   28 o   33.900   5.8926   27.691   8.3279   20.387   12.375   33.737   11.259   29.396   9.1916   38.405   7.3761 -9.008356 11.78527 
1 1 1   14   26   29 o   73.699   3.3543  114.647   10.135  131.865   15.292  101.158   13.535   78.590   4.7178   68.808   4.7694 9.781906 6.708588 
1 1 1   14   26   30 o   40.678   5.2962   38.642   8.5228   34.225   12.949   42.017   11.320   37.748   8.5196   43.609   6.2939 -5.860630 10.59232 
1 1 1   14   26   31 o   30.755   6.2928   23.872   8.5416   18.178   14.107   27.168   10.733   27.714   9.8374   33.795   7.8500 -6.080812 12.58555 
1 1 1   14   26   32 o   22.655   5.8831   9.1743   7.6127   17.691   11.370   2.2546   10.249   27.111   8.8470   18.198   7.7572 8.912798 11.76617 
1 1 1   14   26   33 o   27.890   7.0318   19.505   10.068   21.277   12.156   15.635   17.968   29.068   9.1133   26.711   10.711 2.356716 14.06370 
1 1 1   14   26   34 o   39.715   8.3461   39.169   11.736   35.872   12.720   58.044   30.433   38.117   8.3244   41.312   14.468 -3.194977 16.69211 
1 1 1   14   26   35 o   64.525   5.2783  103.298   12.267  111.177   14.716   85.352   22.209   71.065   5.0206   57.985   9.2864 13.07995 10.55667 
1 1 1   14   26   36 o   23.862   7.3762   7.9800   14.161  -1.4931   21.014   15.860   19.166   21.740   10.036   25.984   10.813 -4.243797 14.75235 
1 1 1   14   27    0 o   36.883   4.8431   31.026   9.3636   31.026   9.3636   31.026   9.3636   36.883   6.8492   36.883   6.8492 0.000000 0.000000 
1 1 1   14   27    1 o   31.858   5.7523   21.645   8.0384   11.188   10.998   33.639   11.778   24.441   8.6847   39.275   7.5453 -14.83452 11.50462 
1 1 1   14   27    2 o  123.883   2.7860  318.419   14.224  312.181   19.667  325.263   20.597  122.622   3.8886  125.143   3.9906 -2.520531 5.571957 
1 1 1   14   27    3 o   62.031   3.3503   78.069   8.3595   71.374   10.531   89.473   13.745   58.578   4.3588   65.484   5.0890 -6.905907 6.700568 
1 1 1   14   27    4 o   17.197   4.9966   2.0636   5.7340  -0.0029   8.4309   3.8422   7.8215   16.431   7.0205   17.963   7.1116 -1.531664 9.993109 
1 1 1   14   27    5 o  113.854   2.6043  272.383   12.003  249.219   18.379  289.610   15.850  109.500   4.0695  118.208   3.2510 -8.707886 5.208664 
1 1 1   14   27    6 o   76.025   3.1283  122.337   9.6255  106.984   14.495  134.447   12.874   71.603   4.9082   80.446   3.8800 -8.842773 6.256606 
1 1 1   14   27    7 o  128.326   2.2114  342.758   11.652  319.444   16.904  363.864   16.084  124.114   3.3022  132.538   2.9422 -8.424423 4.422813 
1 1 1   14   27    8 o  131.042   2.3800  358.577   12.765  311.972   18.224  403.470   17.886  122.570   3.6048  139.514   3.1083 -16.94382 4.759903 
1 1 1   14   27    9 o   66.882   2.8604   97.879   7.3243   78.780   12.236  108.544   9.1433   61.405   4.8313   72.359   3.0637 -10.95340 5.720866 
1 1 1   14   27   10 o  141.312   2.2780  418.785   12.934  393.189   20.418  435.941   16.716  137.561   3.5987  145.063   2.7938 -7.502182 4.555907 
1 1 1   14   27   11 o   43.715   4.3806   45.622   6.7411   28.653   11.261   55.100   8.4157   35.979   7.8123   51.450   3.9659 -15.47105 8.761289 
1 1 1   14   27   12 o  106.300   2.5653  236.088   11.177  220.483   16.399  249.626   15.275  102.947   3.8622  109.653   3.3774 -6.705299 5.130611 
1 1 1   14   27   13 o   98.940   2.8659  205.800   11.464  193.548   17.780  214.516   14.997   96.288   4.4771  101.593   3.5791 -5.304520 5.731898 
1 1 1   14   27   14 o  150.592   2.9160  466.967   17.589  448.199   22.162  498.911   28.913  146.743   3.6617  154.441   4.5391 -7.697784 5.831912 
1 1 1   14   27   15 o   74.864   3.3301  115.859   10.134  108.094   13.088  127.482   16.013   71.854   4.4163   77.873   4.9856 -6.018524 6.660271 
1 1 1   14   27   16 o   53.855   4.0637   61.213   9.0113   57.074   12.357   65.914   13.170   51.911   5.7714   55.799   5.7225 -3.887810 8.127492 
1 1 1   14   27   17 o   37.298   4.8433   29.901   7.0461   34.521   11.340   26.997   8.9925   39.519   7.2236   35.077   6.4536 4.442829 9.686569 
1 1 1   14   27   18 o   49.820   4.6309   58.810   8.2565   38.532   13.476   70.997   10.447   41.434   8.1758   58.206   4.3517 -16.77152 9.261836 
1 1 1   14   27   19 o   30.729   5.6259   20.505   7.0496   25.317   11.440   17.559   8.9510   33.436   8.3270   28.022   7.5672 5.413940 11.25173 
1 1 1   14   27   20 o   43.168   4.4615   42.288   7.3067   31.556   11.282   50.040   9.5892   37.574   7.5424   48.762   4.7680 -11.18742 8.923094 
1 1 1   14   27   21 f   23.145   5.5209   4.9670   7.8120 -10.0068   10.572   22.979   11.595   14.638   6.8758   31.653   8.6397 -17.01541 11.04180 
1 1 1   14   27   22 o  107.043   2.6732  240.555   11.763  223.889   16.897  256.226   16.385  103.357   3.9638  110.730   3.5877 -7.372955 5.346334 
1 1 1   14   27   23 f   73.527   3.3774  114.411   9.9748  113.913   15.998  114.728   12.758   73.185   5.3001   73.869   4.1877 -0.6840439 6.754791 
1 1 1   14   27   24 o   44.310   5.1870   43.503   9.1029   43.019   11.846   44.200   14.224   44.582   6.4426   44.037   8.1311 0.5450325 10.37404 
1 1 1   14   27   25 o   23.507   5.3293   10.130   7.1512  -4.1446   10.781   21.344   9.5561   16.514   7.4539   30.500   7.6188 -13.98569 10.65866 
1 1 1   14   27   26 o   58.169   4.7129   72.098   10.002   79.000   19.611   69.672   11.628   59.206   8.0309   57.132   4.9345 2.074398 9.425773 
1 1 1   14   27   27 o   18.140   5.4328   1.3886   7.2672  -4.9891   11.373   5.7898   9.4476   16.591   7.5547   19.689   7.8093 -3.097557 10.86554 
1 1 1   14   27   28 f   98.176   3.9711  221.523   15.009  157.746   23.369  266.306   19.582   84.368   6.7158  111.984   4.2398 -27.61597 7.942176 
1 1 1   14   27   29 o   24.042   6.5333   10.948   9.0312   7.7143   11.752   15.611   14.114   21.676   8.6733   26.407   9.7730 -4.731199 13.06662 
1 1 1   14   27   30 o   13.390   4.5445 -12.2905   7.0532 -10.4649   11.081 -13.5337   9.1446   14.626   6.9221   12.155   5.8904 2.471299 9.089090 
1 1 1   14   27   31 o   34.046   6.5013   25.449   8.8931   41.844   16.283   18.480   10.616   40.501   9.8442   27.592   8.4948 12.90900 13.00267 
1 1 1   14   27   32 o   45.424   5.2890   50.639   9.1344   31.985   13.232   67.621   12.625   35.526   9.0155   55.322   5.5333 -19.79595 10.57809 
1 1 1   14   27   33 o   33.817   5.6791   28.870   8.2364   18.589   12.237   37.385   11.137   27.206   9.1868   40.428   6.6790 -13.22161 11.35815 
1 1 1   14   27   34 o   31.430   6.8144   28.028   10.238   33.552   12.567   17.127   17.654   36.321   8.5338   26.539   10.626 9.782579 13.62874 
1 1 1   14   27   35 o   20.159   6.3478   2.4136   9.9279   2.0593   11.878   3.2350   18.084   18.554   8.1276   21.765   9.7531 -3.211594 12.69566 
1 1 1   14   28    0 o   10.998   5.0713  -0.6795   7.9231  -0.6795   7.9231  -0.6795   7.9231   10.998   7.1719   10.998   7.1719 0.000000 0.000000 
1 1 1   14   28    1 o   32.506   5.9234   23.456   7.9792   22.813   10.928   24.191   11.677   32.049   8.2260   32.964   8.5252 -0.9145393 11.84678 
1 1 1   14   28    2 o   36.802   5.4079   29.691   8.0829   35.532   11.352   23.683   11.512   40.983   6.7157   32.622   8.4782 8.360344 10.81577 
1 1 1   14   28    3 o   84.407   2.9061  146.298   9.8516  139.742   12.455  157.253   16.100   81.997   3.6830   86.817   4.4963 -4.820183 5.812163 
1 1 1   14   28    4 o  153.902   2.3431  490.828   14.801  484.083   19.910  499.161   22.129  152.766   3.1599  155.037   3.4607 -2.271194 4.686298 
1 1 1   14   28    5 o   54.873   3.2239   64.136   7.1297   50.222   10.316   76.863   9.8654   48.973   5.1071   60.773   3.9359 -11.80040 6.447750 
1 1 1   14   28    6 o  139.738   2.2479  405.065   12.955  400.564   18.216  409.671   18.427  138.952   3.1786  140.523   3.1794 -1.570496 4.495739 
1 1 1   14   28    7 o  103.214   2.5073  222.277   10.627  204.910   15.325  238.365   14.749   99.269   3.7429  107.158   3.3372 -7.888214 5.014571 
1 1 1   14   28    8 o  103.870   2.5061  225.268   10.679  246.012   14.887  203.277   15.328  108.869   3.3154   98.871   3.7589 9.997818 5.012112 
1 1 1   14   28    9 o   42.866   3.6843   40.070   5.7833   35.007   10.696   42.162   6.8750   40.703   6.3712   45.029   3.7018 -4.326046 7.368592 
1 1 1   14   28   10 o  127.719   2.4164  342.738   12.573  289.283   18.112  392.459   17.468  117.908   3.7245  137.529   3.0795 -19.62096 4.832707 
1 1 1   14   28   11 o   40.151   4.0188   33.741   6.2080   34.823   11.033   33.239   7.5097   40.455   6.6123   39.846   4.5695 0.6088028 8.037595 
1 1 1   14   28   12 o   44.727   4.8861   47.393   7.5139   35.022   13.853   52.550   8.9439   39.344   8.7617   50.111   4.3274 -10.76795 9.772133 
1 1 1   14   28   13 o   60.548   3.4732   76.280   8.2217   79.610   14.205   74.602   10.082   61.354   5.6136   59.742   4.0917 1.611263 6.946500 
1 1 1   14   28   14 o   80.038   2.7907  133.511   9.1868  137.612   13.587  130.058   12.469   81.138   4.0602   78.938   3.8298 2.199982 5.581438 
1 1 1   14   28   15 o   96.633   2.7180  194.554   10.821  185.126   14.894  205.096   15.748   94.161   3.8350   99.105   3.8527 -4.943077 5.436011 
1 1 1   14   28   16 o   62.264   3.2129   82.146   8.0930   76.882   12.499   85.946   10.620   60.411   5.0164   64.116   4.0159 -3.705132 6.425869 
1 1 1   14   28   17 o   43.388   4.1418   40.058   7.1639   39.565   11.684   40.354   9.0684   43.011   6.5864   43.766   5.0237 -0.7552376 8.283635 
1 1 1   14   28   18 o   22.061   5.6872   8.7665   6.4804   10.762   10.947   7.6897   8.0407   23.742   8.6356   20.381   7.4029 3.361248 11.37445 
1 1 1   14   28   19 o   34.200   5.1492   27.392   7.0426   19.171   11.101   32.929   9.1107   29.072   8.6318   39.328   5.6167 -10.25588 10.29833 
1 1 1   14   28   20 o   18.175   5.1050   2.1434   6.5378 -10.7988   10.855   9.5097   8.1897   14.676   6.9167   21.674   7.5103 -6.997665 10.21002 
1 1 1   14   28   21 o   40.494   5.2597   36.479   8.5232   37.055   11.406   35.751   12.825   41.379   6.6834   39.608   8.1235 1.771534 10.51942 
1 1 1   14   28   22 o   35.837   5.5517   30.635   7.8568   22.885   13.142   34.945   9.8013   31.332   9.4120   40.342   5.8906 -9.009825 11.10339 
1 1 1   14   28   23 o   84.799   4.0735  170.188   12.609  111.564   21.068  202.908   15.739   71.319   7.1622   98.279   3.8830 -26.96017 8.147088 
1 1 1   14   28   24 o   21.521   5.7804   8.3133   7.0487   8.4244   10.570   8.2243   9.4590   21.855   8.3755   21.188   7.9690 0.6667252 11.56089 
1 1 1   14   28   25 o   31.686   6.3837   22.979   8.7485   17.491   11.357   30.986   13.719   27.491   8.8313   35.881   9.2204 -8.390205 12.76743 
1 1 1   14   28   26 o   29.520   6.7167   19.458   9.1640   14.604   11.614   27.466   14.917   25.640   8.9403   33.399   10.026 -7.758812 13.43332 
1 1 1   14   28   27 o   39.581   6.9730   35.011   11.460   60.580   19.373   21.247   14.214   49.583   9.8205   29.579   9.9018 20.00476 13.94595 
1 1 1   14   28   28 o   50.067   5.3852   59.522   10.365   66.532   13.541   49.601   16.109   54.955   5.9741   45.179   8.9617 9.775871 10.77040 
1 1 1   14   28   29 o   40.627   6.1822   41.714   10.028   48.304   12.848   31.439   16.042   46.394   6.7144   34.861   10.382 11.53361 12.36437 
1 1 1   14   28   30 o   26.638   6.6079   16.074   10.028   26.179   13.317   2.8374   15.241   32.061   9.4370   21.214   9.2520 10.84739 13.21577 
1 1 1   14   28   31 o   38.765   6.3646   42.214   10.535   53.389   13.103   21.788   17.716   48.462   6.5556   29.068   10.911 19.39430 12.72911 
1 1 1   14   28   32 o   19.244   5.8000   3.0995   8.3236  -2.6651   12.597   7.5664   11.089   17.670   8.0091   20.817   8.3912 -3.146875 11.59992 
1 1 1   14   28   33 o   47.369   4.7192   52.117   9.1736   51.374   13.568   52.742   12.451   46.765   7.0346   47.972   6.2926 -1.207256 9.438338 
1 1 1   14   28   34 o   22.052   6.1890   7.8294   8.8486  -0.6276   11.829   18.573   13.333   17.558   7.8766   26.545   9.5485 -8.987024 12.37798 
1 1 1   14   29    0 o   85.369   2.5123  151.656   12.461  151.656   12.461  151.656   12.461   85.369   3.5529   85.369   3.5529 0.000000 0.000000 
1 1 1   14   29    1 o   67.070   3.1662   94.223   8.5526   92.506   13.579   95.351   11.011   66.470   4.9533   67.671   3.9451 -1.201157 6.332330 
1 1 1   14   29    2 o   71.705   3.2486  111.916   9.1141  125.582   11.679   90.627   14.576   77.713   3.6437   65.697   5.3793 12.01550 6.497159 
1 1 1   14   29    3 o   55.261   3.6910   64.371   8.1343   65.276   10.315   62.882   13.228   55.904   4.4737   54.619   5.8719 1.284302 7.381960 
1 1 1   14   29    4 o   74.410   2.6977  115.306   8.2743  115.964   11.523  114.606   11.888   74.642   3.7431   74.177   3.8858 0.4647827 5.395422 
1 1 1   14   29    5 o   29.161   4.9348   18.519   5.9277   24.467   8.7886   13.554   8.0289   33.396   6.6145   24.926   7.3251 8.470474 9.869561 
1 1 1   14   29    6 o   69.593   2.7650  100.957   7.9316  102.213   11.447   99.796   11.000   69.999   3.9650   69.188   3.8548 0.8108292 5.529987 
1 1 1   14   29    7 o   89.719   2.6085  166.473   9.6131  153.687   12.905  182.410   14.408   85.890   3.6431   93.548   3.7343 -7.658585 5.216988 
1 1 1   14   29    8 o   47.695   3.5649   48.153   6.9578   45.014   10.289   50.798   9.4447   46.184   5.4015   49.206   4.6537 -3.022129 7.129729 
1 1 1   14   29    9 o   41.963   4.2583   40.222   6.6967   27.225   10.178   50.144   8.8928   34.998   7.2878   48.927   4.4068 -13.92894 8.516575 
1 1 1   14   29   10 o   94.485   2.3984  187.212   8.9652  180.853   14.822  190.881   11.258   93.080   3.8609   95.890   2.8466 -2.810562 4.796847 
1 1 1   14   29   11 o   92.309   2.5105  175.752   9.4066  187.563   14.868  167.869   12.147   94.798   3.8026   89.820   3.2789 4.977249 5.021021 
1 1 1   14   29   12 o   47.346   5.3049   64.524   8.0955   21.532   14.376   84.487   9.7964   31.062   9.9315   63.630   3.7328 -32.56834 10.60985 
1 1 1   14   29   13 o   45.611   3.7250   44.608   6.7140   41.326   10.977   46.570   8.4868   44.083   6.0371   47.138   4.3653 -3.054920 7.449973 
1 1 1   14   29   14 f   23.558   5.4408   10.872   5.7856   15.000   10.207   8.9174   7.0229   26.277   8.3647   20.840   6.9601 5.436941 10.88167 
1 1 1   14   29   15 o   14.743   4.6591  -2.2398   5.2682  -2.2667   9.8442  -2.2290   6.2364   16.566   7.3226   12.920   5.7627 3.646212 9.318207 
1 1 1   14   29   16 o   55.141   3.2744   63.888   7.2762   64.740   11.621   63.338   9.3319   55.323   5.0930   54.960   4.1168 0.3630409 6.548799 
1 1 1   14   29   17 o   54.182   3.3950   61.068   7.4791   67.350   11.808   56.860   9.6651   56.400   5.0760   51.964   4.5096 4.435452 6.789907 
1 1 1   14   29   18 o   79.235   2.9659  132.516   9.6040  126.309   14.389  137.503   12.897   77.443   4.5048   81.027   3.8593 -3.583542 5.931892 
1 1 1   14   29   19 o   35.439   5.0581   28.972   6.8804   24.304   11.626   31.488   8.5356   32.424   8.5657   38.453   5.3820 -6.028225 10.11615 
1 1 1   14   29   20 o   19.567   5.1132   5.0642   6.3682  -6.7095   10.142   12.728   8.1823   15.146   6.9845   23.989   7.4697 -8.842896 10.22640 
1 1 1   14   29   21 o   20.794   5.6536   7.3147   6.7451   3.9665   11.544   9.0501   8.3114   20.306   8.4161   21.282   7.5512 -0.9759903 11.30712 
1 1 1   14   29   22 o   48.320   4.6292   51.235   8.5000   50.290   15.177   51.667   10.260   47.449   7.7553   49.191   5.0571 -1.742924 9.258396 
1 1 1   14   29   23 o   37.739   5.4077   32.105   7.8852   35.718   13.119   30.062   9.8660   39.018   8.4009   36.459   6.8115 2.559383 10.81535 
1 1 1   14   29   24 o   24.389   5.9339   10.726   7.2437   21.081   12.253   5.1623   8.9811   29.749   9.1208   19.029   7.5931 10.71908 11.86781 
1 1 1   14   29   25 o   45.148   4.4689   44.003   8.1039   48.877   13.292   41.120   10.224   46.830   6.8820   43.465   5.7029 3.364815 8.937863 
1 1 1   14   29   26 o   33.361   6.3034   27.001   8.8122   23.797   11.768   31.093   13.297   31.201   8.7762   35.521   9.0504 -4.319843 12.60678 
1 1 1   14   29   27 o   33.835   6.8806   27.697   9.1753   30.732   18.729   26.739   10.525   34.110   11.365   33.561   7.7587 0.5493774 13.76112 
1 1 1   14   29   28 o   50.210   6.1884   67.726   10.462   45.655   19.763   76.318   12.331   41.115   11.304   59.306   5.0411 -18.19156 12.37674 
1 1 1   14   29   29 o   80.573   3.1710  140.360   10.477  136.934   15.546  143.212   14.182   79.459   4.7435   81.688   4.2094 -2.229103 6.341934 
1 1 1   14   29   30 o   30.009   6.0141   24.081   8.5394   11.009   14.074   31.697   10.743   23.617   9.4767   36.401   7.4074 -12.78447 12.02818 
1 1 1   14   29   31 o   30.931   6.7512   25.067   9.4545   21.955   12.685   28.956   14.182   28.998   9.3350   32.865   9.7557 -3.866877 13.50243 
1 1 1   14   29   32 o   31.128   6.0600   23.317   9.8388   45.504   14.237   3.0323   13.612   42.397   8.4383   19.858   8.6999 22.53932 12.11993 
1 1 1   14   29   33 o   34.630   6.7184   32.696   9.8928   33.753   13.756   31.564   14.238   35.424   9.2977   33.836   9.7006 1.588245 13.43688 
1 1 1   14   30    0 o  168.157   3.1825  589.181   31.164  589.181   31.164  589.181   31.164  168.157   4.5007  168.157   4.5007 0.000000 0.000000 
1 1 1   14   30    1 o   48.608   3.7438   49.809   7.3522   49.979   11.627   49.696   9.4904   48.567   5.8045   48.648   4.7299 -0.8145523E-01 7.487610 
1 1 1   14   30    2 f  106.044   2.6173  233.717   11.145  231.094   14.191  237.939   18.006  105.401   3.2643  106.688   4.0920 -1.286789 5.234515 
1 1 1   14   30    3 o   79.207   2.5786  130.842   8.4189  136.019   11.905  125.664   11.907   80.792   3.5727   77.623   3.7192 3.169647 5.157215 
1 1 1   14   30    4 o   72.404   2.7528  109.447   8.2188  108.809   11.491  110.115   11.760   72.196   3.8590   72.612   3.9268 -0.4165421 5.505590 
1 1 1   14   30    5 o   18.595   5.0786   5.1526   5.5215   4.0287   8.3629   6.0211   7.3517   18.330   7.3228   18.860   7.0387 -0.5301342 10.15710 
1 1 1   14   30    6 o   61.057   2.9483   78.475   7.3752   69.686   10.584   86.771   10.283   57.652   4.4510   64.462   3.8676 -6.809986 5.896582 
1 1 1   14   30    7 o   45.822   3.6424   44.844   6.7771   36.775   9.7359   52.430   9.4395   41.664   5.6656   49.979   4.5793 -8.314774 7.284842 
1 1 1   14   30    8 o   79.711   2.6176  131.962   8.5861  143.019   12.648  122.511   11.694   82.793   3.7038   76.629   3.6999 6.164871 5.235242 
1 1 1   14   30    9 o   41.947   3.7839   35.991   6.4410   45.590   10.195   29.614   8.3094   46.459   5.3204   37.434   5.3819 9.025158 7.567841 
1 1 1   14   30   10 o   55.498   3.2261   65.978   7.2208   55.674   10.827   74.233   9.6908   51.392   5.1079   59.604   3.9420 -8.212612 6.452121 
1 1 1   14   30   11 o   20.828   5.0816   7.4571   6.0590  -2.2120   9.3817   14.376   7.9360   16.182   7.1509   25.473   7.2219 -9.291012 10.16325 
1 1 1   14   30   12 o   40.249   4.7705   35.816   6.7949   34.295   12.964   36.392   7.9786   38.903   8.3309   41.595   4.6507 -2.691864 9.541098 
1 1 1   14   30   13 o   28.834   5.0693   18.373   5.7820   19.631   9.8944   17.721   7.1252   29.423   7.9604   28.246   6.2789 1.177229 10.13866 
1 1 1   14   30   14 o   29.979   5.0567   19.759   5.9343   21.834   10.142   18.678   7.3178   30.972   7.9110   28.987   6.3006 1.984760 10.11344 
1 1 1   14   30   15 o   45.518   3.6983   43.660   6.7588   45.179   10.955   42.727   8.5881   46.016   5.7723   45.020   4.6252 0.9955254 7.396693 
1 1 1   14   30   16 o   29.027   4.4137   13.325   5.7563   38.067   10.290   2.0561   6.9445   42.168   5.9166   15.886   6.5510 26.28146 8.827306 
1 1 1   14   30   17 o   72.380   2.9108  111.110   8.5766  103.312   12.938  117.222   11.455   69.965   4.4836   74.796   3.7133 -4.830589 5.821592 
1 1 1   14   30   18 o  111.672   2.6934  262.490   12.358  238.789   17.604  285.518   17.352  106.586   4.0044  116.759   3.6032 -10.17338 5.386885 
1 1 1   14   30   19 o   73.330   3.0716  116.562   9.0149   96.488   13.714  131.837   11.963   67.372   4.9352   79.288   3.6582 -11.91557 6.143167 
1 1 1   14   30   20 o   63.832   3.7718   87.126   9.9154   82.553   13.586   92.338   14.504   62.057   5.3079   65.607   5.3603 -3.549881 7.543647 
1 1 1   14   30   21 o   34.563   5.3066   31.514   7.3858   14.133   12.751   40.290   9.0605   25.748   9.3271   43.379   5.0642 -17.63026 10.61320 
1 1 1   14   30   22 o   25.039   5.6830   14.373   6.6490   12.120   10.647   15.814   8.5132   23.908   8.5398   26.170   7.5007 -2.262236 11.36606 
1 1 1   14   30   23 o   22.215   5.7630   10.072   6.9256   6.7648   11.444   11.983   8.6996   21.221   8.5347   23.210   7.7465 -1.989830 11.52606 
1 1 1   14   30   24 o   41.064   4.8641   40.070   7.6277   30.098   11.789   47.250   10.004   35.430   8.2257   46.698   5.1940 -11.26825 9.728274 
1 1 1   14   30   25 o   33.276   5.5044   26.436   7.2630   25.455   11.848   27.027   9.1928   32.280   8.7016   34.272   6.7435 -1.992546 11.00873 
1 1 1   14   30   26 o   22.999   5.3483   6.2595   6.8260   24.624   11.332  -4.1997   8.5517   31.760   8.4881   14.238   6.5093 17.52173 10.69669 
1 1 1   14   30   27 o   79.771   3.5619  135.116   11.535  119.930   14.798  158.628   18.413   74.377   4.8239   85.164   5.2421 -10.78730 7.123836 
1 1 1   14   30   28 o   22.334   7.4153  -8.8215   15.090 -14.6086   17.723   6.4304   28.772   18.033   8.5970   26.635   12.085 -8.601244 14.83056 
1 1 1   14   30   29 o   25.258   6.3195   12.827   9.7113  -3.4249   14.296   26.754   13.233   18.511   8.4448   32.005   9.4036 -13.49434 12.63896 
1 1 1   14   30   30 o   23.358   6.4971   11.921   9.1762   11.642   13.266   12.177   12.706   23.302   9.2502   23.415   9.1260 -0.1131897 12.99421 
1 1 1   14   30   31 o   46.466   5.8807   53.979   10.997   48.484   15.311   59.832   15.804   43.277   8.8760   49.655   7.7167 -6.377846 11.76136 
1 1 1   14   31    0 o   70.782   3.3658  105.690   13.752  105.690   13.752  105.690   13.752   70.782   4.7600   70.782   4.7600 0.000000 0.000000 
1 1 1   14   31    1 o   86.152   2.8305  152.833   9.7866  145.597   12.354  165.026   16.037   83.570   3.5841   88.734   4.3820 -5.164131 5.661078 
1 1 1   14   31    2 o   33.135   5.4038   23.868   6.9876   21.903   8.6607   27.533   11.827   31.398   6.8780   34.872   8.3365 -3.473711 10.80758 
1 1 1   14   31    3 o   45.711   3.5176   44.192   6.5933   39.160   9.3825   49.102   9.2673   43.068   5.2820   48.353   4.6469 -5.285053 7.035141 
1 1 1   14   31    4 o  148.657   2.4641  460.385   15.107  452.911   21.222  468.065   21.511  147.431   3.4900  149.882   3.4797 -2.450760 4.928291 
1 1 1   14   31    5 f   52.013   3.2009   56.451   6.8373   64.327   10.061   49.693   9.3204   55.389   4.4040   48.637   4.6462 6.751720 6.401740 
1 1 1   14   31    6 o   27.932   4.9112   16.392   5.9164   26.809   9.0630   8.6559   7.8101   34.892   6.5379   20.973   7.3304 13.91938 9.822332 
1 1 1   14   31    7 o   60.740   3.0145   77.473   7.5390   74.520   10.843   80.238   10.490   59.582   4.4121   61.898   4.1088 -2.315983 6.029028 
1 1 1   14   31    8 o   50.101   3.2465   51.856   6.6446   62.453   10.181   43.994   8.7697   54.491   4.5301   45.710   4.6516 8.780762 6.493032 
1 1 1   14   31    9 f   61.616   3.0473   81.387   7.5771   65.704   11.091   95.114   10.376   55.793   4.8197   67.440   3.7303 -11.64678 6.094661 
1 1 1   14   31   10 o   51.534   3.3963   57.684   6.9868   47.514   10.686   65.279   9.2343   47.270   5.4809   55.799   4.0125 -8.529072 6.792615 
1 1 1   14   31   11 o   36.078   7.5878   32.156   11.214   34.809   12.491   21.135   25.460   39.200   7.9967   32.956   12.898 6.243927 15.17562 
1 1 1   14   31   12 o   85.235   3.0052  150.281   10.193  143.934   12.714  161.698   17.053   82.943   3.7166   87.527   4.7237 -4.584282 6.010499 
1 1 1   14   31   13 o   45.082   3.7826   45.437   6.6230   34.745   10.487   52.532   8.5422   40.166   6.3303   49.999   4.1423 -9.833149 7.565131 
1 1 1   14   31   14 o   36.178   4.3650   27.049   6.1964   34.827   10.505   22.899   7.6735   40.164   6.3414   32.193   6.0000 7.971165 8.730020 
1 1 1   14   31   15 o   62.423   3.2555   85.934   8.0053   64.155   12.135  102.716   10.652   54.840   5.3651   70.007   3.6891 -15.16761 6.511041 
1 1 1   14   31   16 o   72.081   2.8383  108.678   8.3502  113.414   12.877  105.241   10.969   73.341   4.2569   70.822   3.7553 2.519371 5.676550 
1 1 1   14   31   17 o   26.811   5.3595   16.794   6.0840   13.939   10.530   18.224   7.4542   25.209   8.5220   28.412   6.5018 -3.203325 10.71902 
1 1 1   14   31   18 o   36.200   4.6701   28.330   6.4968   33.976   10.979   25.288   8.0591   38.690   7.1437   33.711   6.0171 4.978817 9.340124 
1 1 1   14   31   19 o   51.350   3.6127   55.248   7.4836   62.647   12.174   50.752   9.4883   53.906   5.4753   48.794   4.7147 5.111969 7.225479 
1 1 1   14   31   20 o   57.608   3.8765   71.222   9.1325   59.444   12.435   85.014   13.456   52.333   5.7609   62.882   5.1884 -10.54873 7.752906 
1 1 1   14   31   21 o   25.826   5.1483   17.090   6.9353  -3.3129   13.088   25.056   8.1780   18.302   8.2411   33.350   6.1729 -15.04803 10.29661 
1 1 1   14   31   22 o   23.276   5.5620   12.420   6.5157   6.8445   11.128   15.329   8.0376   20.945   8.4189   25.607   7.2708 -4.661768 11.12401 
1 1 1   14   31   23 o   18.821   5.3881   4.9714   6.4256   1.9151   10.842   6.6263   7.9777   18.512   7.9368   19.130   7.2894 -0.6173611 10.77629 
1 1 1   14   31   24 o   30.665   5.8877   21.201   7.3325   29.156   12.759   17.278   8.9600   34.362   8.9233   26.969   7.6834 7.393257 11.77543 
1 1 1   14   31   25 f   32.401   6.4109   26.081   9.2084   17.910   12.710   35.108   13.359   27.136   9.3587   37.666   8.7642 -10.53042 12.82173 
1 1 1   14   31   26 o   32.133   6.5324   26.546   9.3865   33.470   13.218   19.501   13.332   36.436   8.8771   27.830   9.5858 8.605904 13.06486 
1 1 1   14   31   27 o   30.050   6.5018   22.962   9.1441   15.660   12.832   30.496   13.034   25.577   9.3426   34.524   9.0448 -8.947720 13.00356 
1 1 1   14   31   28 o   48.125   5.6295   56.095   10.439   35.187   14.150   81.068   15.465   36.616   9.3398   59.633   6.2876 -23.01702 11.25905 
1 1 1   14   31   29 o   26.654   9.4661   18.547   13.064   0.0000   0.0000   18.547   13.064  ?   ?    26.654   9.4661      ?      ? 
1 1 1   14   31   30 o   29.499   7.5758   26.132   12.603   9.5199   26.366   31.052   14.348   25.516   11.574   33.482   9.7786 -7.965860 15.15168 
1 1 1   14   32    0 o   36.422   5.7828   31.870   10.724   31.870   10.724   31.870   10.724   36.422   8.1782   36.422   8.1782 0.000000 0.000000 
1 1 1   14   32    1 o   24.879   5.5787   13.862   6.6890   17.680   8.3913   7.2073   11.078   28.014   7.2178   21.744   8.5084 6.269953 11.15750 
1 1 1   14   32    2 o   62.096   3.4204   82.474   8.4383   85.645   10.723   77.317   13.675   63.898   4.0688   60.293   5.4993 3.604912 6.840875 
1 1 1   14   32    3 o   79.212   2.5627  130.899   8.3562  142.893   12.086  119.916   11.566   82.705   3.5432   75.719   3.7035 6.985771 5.125433 
1 1 1   14   32    4 o   46.827   3.4289   46.158   6.5959   52.266   9.6127   40.724   9.0671   49.782   4.6817   43.872   5.0109 5.910172 6.857702 
1 1 1   14   32    5 o   30.655   4.5856   19.873   5.7512   29.270   8.8772   13.076   7.5500   37.033   5.8120   24.277   7.0944 12.75601 9.171157 
1 1 1   14   32    6 o   23.213   5.0826   11.903   5.5909   6.9227   8.6948   15.413   7.3001   20.188   7.6297   26.238   6.7171 -6.050320 10.16525 
1 1 1   14   32    7 o   75.462   2.7327  119.069   8.4909  109.839   11.762  129.113   12.270   72.390   3.9396   78.533   3.7881 -6.142593 5.465319 
1 1 1   14   32    8 o   16.862   4.9033   2.1915   5.3176   4.4610   8.7898   0.8814   6.6783   18.764   7.5035   14.961   6.3142 3.803658 9.806689 
1 1 1   14   32    9 o   56.891   3.1149   68.631   7.2320   64.882   10.866   71.613   9.6898   55.387   4.7567   58.396   4.0231 -3.009975 6.229889 
1 1 1   14   32   10 o   86.794   2.7031  158.930   9.5781  150.591   14.384  165.573   12.839   84.619   4.1214   88.970   3.4987 -4.351486 5.406169 
1 1 1   14   32   11 o   45.162   7.4155   45.224   11.829   41.822   13.432   56.976   24.964   42.930   7.8765   47.394   12.567 -4.463661 14.83100 
1 1 1   14   32   12 o   53.557   3.9755   61.058   8.6911   58.996   11.420   63.897   13.397   52.610   5.2631   54.503   5.9598 -1.892334 7.951014 
1 1 1   14   32   13 o   22.911   5.6192   6.7743   7.5271  -4.4657   10.083   20.925   11.313   15.804   7.1639   30.019   8.6590 -14.21550 11.23833 
1 1 1   14   32   14 o   26.598   6.1850   16.024   7.8836   17.775   10.380   13.637   12.119   27.767   8.3703   25.430   9.1080 2.336946 12.36998 
1 1 1   14   32   15 o  106.510   3.1575  237.468   13.770  204.392   18.368  279.911   20.807   98.105   4.5395  114.915   4.3901 -16.80989 6.315005 
1 1 1   14   32   16 o   77.595   3.3125  125.697   10.428  114.903   13.380  142.401   16.645   73.578   4.4089   81.613   4.9448 -8.034393 6.624909 
1 1 1   14   32   17 o   46.316   3.9232   47.983   7.1303   39.732   11.355   53.354   9.1617   42.529   6.4737   50.104   4.4334 -7.575172 7.846307 
1 1 1   14   32   18 o   21.542   5.3038   6.2126   5.6550   18.446   10.687   1.4555   6.6644   27.979   8.5063   15.105   6.3376 12.87465 10.60769 
1 1 1   14   32   19 o   12.901   4.3446  -8.1904   5.3080  -4.9754   10.472  -9.3019   6.1575   15.743   7.1998   10.058   4.8645 5.685114 8.689128 
1 1 1   14   32   20 o   47.205   4.4324   53.793   7.5815   35.850   12.061   65.514   9.7481   39.001   7.7711   55.410   4.2655 -16.40965 8.864746 
1 1 1   14   32   21 o   62.263   3.5036   88.023   8.4786   61.255   12.775  109.096   11.335   52.792   5.8672   71.735   3.8311 -18.94274 7.007215 
1 1 1   14   32   22 o   49.283   4.9141   54.308   9.9276   49.550   13.180   60.546   15.093   46.899   6.8139   51.666   7.0827 -4.767490 9.828247 
1 1 1   14   32   23 o   23.640   6.1252   10.796   8.7914  -1.5734   13.392   20.165   11.654   18.746   8.3971   28.535   8.9196 -9.788193 12.25032 
1 1 1   14   32   24 o   28.038   6.5707   19.720   8.9200   22.740   12.687   16.767   12.543   29.822   9.3040   26.255   9.2807 3.567120 13.14141 
1 1 1   14   32   25 o   41.204   8.6828   50.078   19.963   88.372   27.611   8.1307   28.898   55.474   12.382   26.934   12.176 28.53942 17.36556 
1 1 1   14   32   26 o   30.743   7.7259   26.564   12.004   20.100   24.808   28.540   13.716   28.690   12.142   32.796   9.5561 -4.106550 15.45176 
1 1 1   14   32   27 o   31.621   9.2702   31.619   19.780   28.087   27.060   35.673   28.986   30.567   12.795   32.674   13.418 -2.106789 18.54048 
1 1 1   14   32   28 f   19.267   6.5101  -5.1790   11.141 -22.5371   29.836  -2.3663   12.010   21.420   10.439   17.113   7.7811 4.307146 13.02012 
1 1 1   14   33    0 o   36.494   4.3882   30.251   8.5298   30.251   8.5298   30.251   8.5298   36.494   6.2058   36.494   6.2058 0.000000 0.000000 
1 1 1   14   33    1 o   45.979   5.9517   45.398   8.3245   44.083   9.1161   52.002   20.424   45.612   4.8457   46.345   10.873 -0.7325478 11.90346 
1 1 1   14   33    2 o   34.586   5.1547   27.084   6.9679   28.186   8.6981   25.111   11.641   36.257   5.8166   32.915   8.5117 3.341377 10.30931 
1 1 1   14   33    3 o   53.147   3.1679   60.096   6.8803   52.018   9.8718   67.727   9.5944   49.546   4.8309   56.747   4.0993 -7.201649 6.335710 
1 1 1   14   33    4 o   35.313   4.3833   27.721   6.1407   22.981   8.9513   31.935   8.4398   31.911   6.9941   38.714   5.2856 -6.803213 8.766673 
1 1 1   14   33    5 o   51.364   3.2239   56.097   6.7778   52.208   9.9921   59.411   9.2244   49.613   4.8831   53.114   4.2108 -3.501415 6.447874 
1 1 1   14   33    6 o   29.305   4.9437   20.027   5.9352   15.035   9.0942   23.730   7.8336   25.850   7.8440   32.760   6.0194 -6.909573 9.887444 
1 1 1   14   33    7 o   49.711   3.3695   53.130   6.7915   46.798   10.172   58.222   9.1225   46.852   5.2641   52.570   4.2073 -5.718006 6.738913 
1 1 1   14   33    8 o   62.953   3.1368   85.340   7.9388   74.911   12.207   92.984   10.451   59.357   4.9861   66.549   3.8076 -7.192188 6.273670 
1 1 1   14   33    9 o   28.770   5.2200   18.373   5.9531   20.727   10.382   17.220   7.2664   29.906   8.1804   27.635   6.4865 2.271168 10.44001 
1 1 1   14   33   10 o   34.062   5.4668   28.219   7.7881   36.552   10.166   16.382   12.117   41.097   5.9979   27.028   9.1416 14.06806 10.93357 
1 1 1   14   33   11 o   32.878   7.7806   24.230   10.326   23.612   11.279   27.429   25.666   31.670   8.4701   34.087   13.054 -2.416750 15.56118 
1 1 1   14   33   12 o   41.656   4.8129   36.633   7.7491   23.604   9.8963   57.283   12.458   31.907   7.6241   51.405   5.8762 -19.49737 9.625830 
1 1 1   14   33   13 o   34.087   5.4407   25.906   7.4214   19.969   9.5706   34.859   11.754   29.264   7.7912   38.911   7.5963 -9.647669 10.88149 
1 1 1   14   33   14 o   30.925   5.9929   22.715   7.7473   23.102   9.8328   22.081   12.581   31.483   7.6481   30.367   9.2286 1.116554 11.98583 
1 1 1   14   33   15 o   53.597   3.9579   57.576   8.3793   40.719   10.430   88.265   14.073   43.243   5.8477   63.951   5.3353 -20.70808 7.915896 
1 1 1   14   33   16 o   46.829   4.4040   48.319   8.2708   48.372   10.567   48.234   13.289   47.224   5.4252   46.435   6.9390 0.7888260 8.808064 
1 1 1   14   33   17 o   31.391   4.7822   25.342   6.1370   11.957   10.001   33.425   7.7722   23.363   8.2841   39.419   4.7806 -16.05543 9.564487 
1 1 1   14   33   18 f   15.247   4.9959  -6.6535   7.4694  -6.6373   10.660  -6.6692   10.469   15.331   7.1017   15.162   7.0286 0.1689825 9.991762 
1 1 1   14   33   19 o   22.779   7.3143  -2.8429   11.290  -6.3618   12.444   13.531   26.843   16.794   7.7417   28.765   12.412 -11.97097 14.62862 
1 1 1   14   33   20 f   29.901   6.9518   21.485   9.6889   27.576   15.874   17.869   12.231   32.591   10.438   27.212   9.1849 5.379189 13.90356 
1 1 1   14   33   21 o   30.740   6.4985   23.458   9.0758   30.841   13.321   17.063   12.399   34.922   9.1416   26.557   9.2386 8.364958 12.99697 
1 1 1   14   33   22 o   43.171   7.8532   50.495   13.071   53.237   25.282   49.495   15.271   41.533   13.159   44.809   8.5750 -3.276627 15.70635 
1 1 1   14   33   23 o   23.499   7.1680   8.0996   11.113   2.1744   25.122   9.5412   12.392   24.642   11.223   22.357   8.9196 2.285059 14.33609 
1 1 1   14   33   24 o   42.522   7.5829   52.817   12.653   43.063   26.368   55.735   14.421   36.227   13.368   48.816   7.1627 -12.58969 15.16572 
1 1 1   14   33   25 o   44.829   8.0466   52.695   13.529   73.792   26.606   45.337   15.712   48.204   13.059   41.455   9.4055 6.748421 16.09329 
1 1 1   14   33   26 o   27.852   7.9635   14.803   11.884   39.979   26.074   8.2021   13.351   34.077   13.131   21.627   9.0142 12.44996 15.92709 
1 1 1   14   34    0 o   16.179   6.0797   8.2521   7.7470   8.2521   7.7470   8.2521   7.7470   16.179   8.5980   16.179   8.5980 0.000000 0.000000 
1 1 1   14   34    1 o   38.712   6.3760   29.781   7.9523   26.647   8.6913   45.894   19.708   34.536   6.3351   42.887   11.067 -8.351330 12.75209 
1 1 1   14   34    2 o   56.811   3.0839   68.781   7.1574   58.563   10.176   78.787   10.069   52.488   4.7004   61.134   3.9935 -8.646450 6.167839 
1 1 1   14   34    3 o   81.795   2.5173  140.526   8.4794  131.118   11.948  150.072   12.035   78.991   3.6675   84.599   3.4493 -5.607704 5.034649 
1 1 1   14   34    4 o   76.478   2.6662  122.848   8.4020  117.856   11.578  128.403   12.212   74.848   3.7503   78.109   3.7908 -3.260597 5.332469 
1 1 1   14   34    5 o   44.164   3.5209   41.204   6.3768   47.343   9.6009   36.357   8.5300   47.085   4.9438   41.242   5.0147 5.843437 7.041870 
1 1 1   14   34    6 o   39.773   4.5964   37.516   6.8544   25.389   10.642   46.113   8.9604   33.001   7.9198   46.546   4.6675 -13.54509 9.192819 
1 1 1   14   34    7 o   49.392   3.2943   51.086   6.6554   60.187   10.184   44.302   8.7925   53.173   4.6438   45.611   4.6739 7.562546 6.588647 
1 1 1   14   34    8 o   64.921   2.9401   89.495   7.8437   84.180   11.350   94.354   10.852   62.983   4.3691   66.859   3.9355 -3.875755 5.880243 
1 1 1   14   34    9 o   17.058   4.6372  -6.3033   5.0460   14.784   9.8394 -13.8284   5.8778   25.482   8.2236   8.6349   4.2881 16.84677 9.274424 
1 1 1   14   34   10 o   18.700   5.5022   2.5139   7.2742   7.1958   9.8596  -3.0786   10.776   20.675   8.0443   16.724   7.5090 3.950687 11.00435 
1 1 1   14   34   11 o   50.183   5.9942   59.966   11.101   54.508   19.361   62.639   13.549   46.875   10.296   53.492   6.1413 -6.617626 11.98832 
1 1 1   14   34   12 o   38.052   5.8677   34.663   8.9501   30.367   13.064   38.464   12.287   35.376   8.9474   40.728   7.5937 -5.351860 11.73544 
1 1 1   14   34   13 o   32.251   5.8893   24.371   7.9167   19.055   10.457   31.507   12.117   28.220   8.3774   36.282   8.2799 -8.061567 11.77870 
1 1 1   14   34   14 o   38.744   5.1947   33.389   8.0303   27.653   10.299   42.282   12.825   34.291   7.4918   43.197   7.1983 -8.905560 10.38949 
1 1 1   14   34   15 o   31.020   6.9647   22.451   9.7791   31.732   16.315   17.246   12.217   35.053   10.477   26.986   9.1791 8.066208 13.92931 
1 1 1   14   34   16 f   19.577   6.1681  -0.7771   9.6742  -0.6133   16.320  -0.8659   12.012   20.925   9.3288   18.230   8.0718 2.695482 12.33617 
1 1 1   14   34   17 f   29.536   7.1720   21.872   10.445   19.164   17.677   23.325   12.948   28.517   10.854   30.555   9.3771 -2.037373 14.34393 
1 1 1   14   34   18 o   18.162   5.9754  -6.4207   10.257 -22.3756   20.581  -1.1481   11.831   18.451   8.9164   17.873   7.9574 0.5782490 11.95082 
1 1 1   14   34   19 o   24.649   7.8526   3.2019   16.505   0.9546   21.327   6.5576   26.061   23.210   10.479   26.087   11.698 -2.876438 15.70512 
1 1 1   14   34   20 o   32.786   9.1698   27.595   12.885   0.0000   0.0000   27.595   12.885  ?   ?    32.786   9.1698      ?      ? 
1 1 1   14   34   21 o   30.969   7.9234   19.551   11.236   45.118   24.224   12.543   12.683   38.065   12.925   23.874   9.1684 14.19076 15.84687 
1 1 1   14   34   22 o   49.165   7.2435   61.384   13.165   72.442   24.920   57.103   15.505   49.421   12.280   48.909   7.6865 0.5116463 14.48708 
1 1 1   14   34   23 o   45.936   7.3752   64.769   13.059   44.281   25.543   72.020   15.196   36.156   13.185   55.717   6.6126 -19.56076 14.75032 
1 1 1   14   34   24 o   37.017   8.0282   41.002   12.831   42.138   25.021   40.596   14.946   35.106   13.008   38.927   9.4124 -3.820232 16.05647 
1 1 1   14   35    0 o   10.666   4.9180  -0.3051   7.4509  -0.3051   7.4509  -0.3051   7.4509   10.666   6.9551   10.666   6.9551 0.000000 0.000000 
1 1 1   14   35    1 o   69.880   3.1448  105.960   8.7224  112.843   11.168   95.194   13.967   73.178   3.7001   66.582   5.0862 6.595490 6.289688 
1 1 1   14   35    2 o   72.150   2.6468  109.766   7.8749  109.327   11.232  110.190   11.044   71.991   3.7828   72.308   3.7032 -0.3173599 5.293692 
1 1 1   14   35    3 o   57.909   3.0014   71.451   7.1372   65.742   10.269   76.785   9.9266   55.569   4.4807   60.249   3.9947 -4.680405 6.002834 
1 1 1   14   35    4 o   52.087   4.1596   62.722   8.2633   72.799   10.525   46.527   13.342   58.512   4.3611   45.662   7.0846 12.85003 8.319280 
1 1 1   14   35    5 o   21.805   5.2483   10.095   6.0429   3.6021   9.4583   14.573   7.8552   18.470   7.6335   25.140   7.2048 -6.669214 10.49663 
1 1 1   14   35    6 o   72.033   2.7994  109.629   8.2944   98.909   11.467  121.395   12.013   68.294   4.0708   75.773   3.8438 -7.479103 5.598832 
1 1 1   14   35    7 f   33.234   4.4970   23.715   5.9969   40.809   9.4102   12.026   7.7819   43.437   5.2526   23.031   7.3009 20.40524 8.994047 
1 1 1   14   35    8 o   28.713   5.1396   21.797   6.4329   8.0644   12.332   26.930   7.5399   22.151   8.8771   35.275   5.1824 -13.12473 10.27912 
1 1 1   14   35    9 o   48.239   4.2521   51.305   8.3167   51.518   10.853   51.001   12.945   48.655   5.4081   47.822   6.5631 0.8332062 8.504209 
1 1 1   14   35   10 o   33.872   8.4412   19.273   10.684   56.277   29.957   13.881   11.436   42.884   14.375   24.859   8.8535 18.02582 16.88232 
1 1 1   14   35   11 o   16.870   5.2416  -5.5569   7.9226 -19.9314   11.706   6.5937   10.762   13.126   6.4274   20.613   8.2815 -7.487027 10.48312 
1 1 1   14   35   12 o   29.289   6.1097   20.409   8.5948   9.6373   12.247   30.861   12.065   22.799   8.9391   35.779   8.3311 -12.98017 12.21948 
1 1 1   14   35   13 o   40.944   5.6513   40.102   9.2811   56.105   13.349   25.129   12.913   50.139   6.4552   31.749   9.2778 18.38997 11.30256 
1 1 1   14   35   14 o   32.819   7.4120   26.388   10.479   32.815   19.960   23.942   12.313   34.641   11.733   30.997   9.0604 3.643702 14.82395 
1 1 1   14   35   15 o   20.198   6.3291   0.2427   9.4985   5.6012   17.709  -1.9213   11.254   23.212   10.049   17.184   7.6974 6.028131 12.65813 
1 1 1   14   35   16 o   23.309   6.8463   9.0597   10.071   8.6008   19.164   9.2348   11.838   24.517   10.533   22.100   8.7491 2.417551 13.69261 
1 1 1   14   35   17 o   34.688   8.4849   33.657   17.536   56.321   23.338   4.2684   26.576   43.786   12.374   25.590   11.612 18.19556 16.96972 
1 1 1   14   35   18 o   31.885   7.7232   25.318   11.153   35.942   21.661   21.485   13.011   34.869   12.207   28.901   9.4653 5.967846 15.44646 
1 1 1   14   35   19 o   27.339   12.231   12.207   28.318   0.0000   0.0000   12.207   28.318  ?   ?    27.339   12.231      ?      ? 
1 1 1   14   35   20 o   24.273   6.8904   13.003   10.770  -3.0069   22.348   17.846   12.292   22.129   10.262   26.418   9.1983 -4.289316 13.78089 
1 1 1   14   35   21 o   20.209   6.5798  -1.3870   10.604   3.8041   22.329  -2.8988   12.050   23.403   10.629   17.016   7.7590 6.386555 13.15957 
1 1 1   14   35   22 o   36.470   7.9744   32.555   11.588   60.182   24.422   24.527   13.165   42.949   12.815   29.991   9.4948 12.95723 15.94874 
1 1 1   14   36    0 o   57.929   4.0833   73.350   13.483   73.350   13.483   73.350   13.483   57.929   5.7747   57.929   5.7747 0.000000 0.000000 
1 1 1   14   36    1 o   34.052   5.2399   24.811   6.9532   18.117   8.5363   38.010   11.986   27.737   7.3455   40.367   7.4745 -12.62972 10.47974 
1 1 1   14   36    2 o   32.547   5.1184   24.722   6.6285   24.425   8.7033   25.132   10.229   32.560   6.7043   32.534   7.7360 0.2552795E-01 10.23686 
1 1 1   14   36    3 o   43.932   3.6233   42.092   6.5109   37.951   9.4803   45.789   8.9574   41.708   5.5112   46.157   4.7052 -4.449017 7.246522 
1 1 1   14   36    4 o   46.553   3.6366   46.314   6.9031   51.120   10.775   42.967   8.9903   48.463   5.3907   44.642   4.8828 3.821209 7.273281 
1 1 1   14   36    5 f   26.729   5.2700   18.427   6.6113   5.8933   11.791   24.174   7.9845   20.819   8.5548   32.639   6.1570 -11.81957 10.54010 
1 1 1   14   36    6 o   41.004   5.0811   41.467   7.4336   31.486   13.276   46.025   8.9719   35.741   9.0091   46.268   4.7015 -10.52724 10.16212 
1 1 1   14   36    7 f   33.534   5.4406   33.677   7.3792   7.8652   15.980   40.673   8.3193   23.558   9.8442   43.510   4.6359 -19.95172 10.88114 
1 1 1   14   36    8 o   26.170   5.6379   17.892   6.6840   4.1316   15.556   21.008   7.4021   21.986   9.4680   30.354   6.1237 -8.368374 11.27581 
1 1 1   14   36    9 o   44.636   6.4552   50.346   11.007   43.474   18.873   53.889   13.550   40.358   11.026   48.914   6.7165 -8.556698 12.91036 
1 1 1   14   36   10 o   49.073   6.7305   54.426   13.622   0.0000   0.0000   54.426   13.622  ?   ?    49.073   6.7305      ?      ? 
1 1 1   14   36   11 o   73.975   4.7240  122.367   13.420  128.425   23.837  119.556   16.239   74.092   7.8005   73.858   5.3307 0.2339554 9.447923 
1 1 1   14   36   12 o   22.054   6.0051   5.6744   9.8136 -25.7525   17.841   19.308   11.751   16.286   7.9663   27.822   8.9878 -11.53551 12.01013 
1 1 1   14   36   13 o   40.600   7.1850   43.057   11.668   45.867   19.491   41.488   14.567   40.571   11.254   40.629   8.9357 -0.5798721E-01 14.36994 
1 1 1   14   36   14 o   50.980   6.3438   62.442   11.702   69.168   22.059   59.808   13.805   50.668   10.881   51.292   6.5257 -0.6241608 12.68763 
1 1 1   14   36   15 o   68.716   4.9632  100.003   13.045  136.103   24.577   85.843   15.392   75.641   7.8778   61.791   6.0395 13.84946 9.926479 
1 1 1   14   36   16 o   21.794   6.7987   3.0558   10.598   10.555   20.634   0.3686   12.352   25.131   10.863   18.456   8.1779 6.675377 13.59739 
1 1 1   14   36   17 o   22.382   6.7183   8.1330   10.434   0.6418   20.094   10.899   12.209   22.101   10.055   22.662   8.9127 -0.5605755 13.43666 
1 1 1   14   36   18 o   25.015   7.2568   13.272   10.806   17.428   21.592   11.883   12.481   26.936   11.360   23.095   9.0328 3.840784 14.51353 
1 1 1   14   36   19 o   32.261   9.4174   28.251   13.310   0.0000   0.0000   28.251   13.310  ?   ?    32.261   9.4174      ?      ? 
1 1 1   14   36   20 o   26.809   7.5424   17.982   11.373   20.716   23.361   17.133   13.020   27.879   11.790   25.740   9.4095 2.138554 15.08475 
1 1 1   14   37    0 o   23.938   10.303   19.924   26.980   19.924   26.980   19.924   26.980   23.938   14.570   23.938   14.570 0.000000 0.000000 
1 1 1   14   37    1 o   57.769   4.1614   74.120   9.8936   69.649   14.097   78.460   13.888   55.888   6.1158   59.650   5.6451 -3.762268 8.322844 
1 1 1   14   37    2 o   35.272   5.7646   30.232   8.2002   30.847   12.081   29.707   11.167   35.458   8.3911   35.085   7.9064 0.3733978 11.52923 
1 1 1   14   37    3 o   39.720   5.0156   38.616   7.3332   30.722   12.601   42.658   9.0173   35.135   8.7335   44.305   4.9347 -9.169106 10.03125 
1 1 1   14   37    4 o   38.535   6.2875   36.177   9.6626   42.945   15.278   31.665   12.474   41.313   9.2022   35.757   8.5703 5.556145 12.57500 
1 1 1   14   37    5 o   36.617   6.6083   33.274   10.116   44.913   15.517   24.671   13.341   42.254   9.1675   30.981   9.5201 11.27295 13.21651 
1 1 1   14   37    6 o   38.754   6.5965   38.523   10.392   36.500   15.603   40.135   13.931   37.277   9.9593   40.232   8.6525 -2.955875 13.19296 
1 1 1   14   37    7 o   27.735   6.4580   19.637   9.5072   6.3838   15.600   27.469   11.992   22.411   9.5619   33.060   8.6828 -10.64885 12.91592 
1 1 1   14   37    8 o   53.795   5.2273   64.406   11.273   81.412   18.856   54.946   14.063   58.731   7.7843   48.858   6.9788 9.872746 10.45462 
1 1 1   14   37    9 o   20.976   6.3190   4.4734   9.0336   9.2263   15.936   2.2227   10.966   23.526   9.8307   18.426   7.9422 5.100235 12.63807 
1 1 1   14   37   10 o   29.688   9.1280   22.565   12.262   0.0000   0.0000   22.565   12.262  ?   ?    29.688   9.1280      ?      ? 
1 1 1   14   37   11 o   26.565   6.6673   17.662   9.9914   4.9787   16.872   24.513   12.399   22.310   9.7320   30.819   9.1160 -8.509809 13.33467 
1 1 1   14   37   12 o   41.628   6.8479   42.863   10.930   54.941   19.507   37.336   13.197   44.723   10.716   38.533   8.5290 6.189735 13.69573 
1 1 1   14   37   13 o   50.342   6.5828   64.911   12.650   65.057   21.372   64.833   15.694   48.256   10.985   52.429   7.2576 -4.173653 13.16565 
1 1 1   14   37   14 o   32.465   6.9638   30.874   10.633   19.190   19.648   35.715   12.645   27.393   11.125   37.537   8.3798 -10.14386 13.92760 
1 1 1   14   37   15 o   43.907   6.9183   52.759   11.926   48.025   20.426   55.208   14.691   39.804   11.679   48.010   7.4191 -8.206024 13.83661 
1 1 1   14   37   16 o   44.248   7.2197   52.114   12.033   60.065   22.259   48.830   14.304   44.400   11.909   44.096   8.1655 0.3042030 14.43950 
1 1 1   14   37   17 o   20.502   6.4472   3.2871   10.207   1.5842   19.136   3.9642   12.066   21.665   9.8398   19.338   8.3332 2.327417 12.89437 
1 1 1   14   38    4 o   25.746   7.5033   14.162   12.952   19.836   14.398  -9.8958   29.649   27.779   9.9299   23.713   11.251 4.065962 15.00665 
1 1 1   14   38    5 o   25.467   7.7887   11.559   12.910   12.477   14.232   7.2970   30.669   24.121   9.5793   26.813   12.284 -2.691561 15.57737 
1 1 1   14   38    6 o   53.433   8.1808   69.285   18.029   69.285   18.029   0.0000   0.0000   53.433   8.1808  ?   ?       ?      ? 
1 1 1   14   38    7 o   56.410   8.4802   86.104   17.024   79.974   19.567  105.198   34.532   57.177   8.2974   55.643   14.792 1.533623 16.96047 
1 1 1   14   38    8 o   28.010   8.0890   20.510   14.707   25.195   16.309   0.1158   34.027   30.078   10.588   25.941   12.232 4.136839 16.17791 
1 1 1   14   38    9 o   29.450   8.6572   22.582   15.197   20.937   16.977   29.217   34.099   27.926   10.635   30.973   13.663 -3.047571 17.31432 
1 1 1   14   38   10 o   30.767   13.639   29.144   34.391   0.0000   0.0000   29.144   34.391  ?   ?    30.767   13.639      ?      ? 
1 1 1   14   38   11 o   47.631   8.3168   82.131   18.678   97.210   21.783   40.258   36.298   62.356   8.4697   32.906   14.316 29.45041 16.63368 
1 1 1   14   38   12 o   37.879   9.8742   43.659   17.639   33.064   20.012   80.546   37.340   32.658   11.703   43.101   15.907 -10.44331 19.74849 
1 1 1   14   38   13 o   47.173   9.8531   72.858   18.904   66.187   21.802   93.070   37.948   47.664   11.268   46.681   16.167 0.9832611 19.70617 
1 1 1   15    0    1 o  107.511   2.1036  238.946   13.169  238.946   13.169  238.946   13.169  107.511   2.9750  107.511   2.9750 0.000000 0.000000 
1 1 1   15    0    2 o   10.291   4.7443  -0.7634   6.9304  -0.7634   6.9304  -0.7634   6.9304   10.291   6.7094   10.291   6.7094 0.000000 0.000000 
1 1 1   15    0    3 o  546.654   3.9442  6167.85  125.733  6167.85  125.733  6167.85  125.733  546.654   5.5779  546.654   5.5779 0.000000 0.000000 
1 1 1   15    0    4 o   34.587   4.3592   26.912   7.9618   26.912   7.9618   26.912   7.9618   34.587   6.1649   34.587   6.1649 0.000000 0.000000 
1 1 1   15    0    5 f  324.501   3.1255  2173.56   59.134  2173.56   59.134  2173.56   59.134  324.501   4.4201  324.501   4.4201 0.000000 0.000000 
1 1 1   15    0    6 o  298.725   3.6595  1842.91   63.720  1842.91   63.720  1842.91   63.720  298.725   5.1753  298.725   5.1753 0.000000 0.000000 
1 1 1   15    0    8 o  370.076   4.1496  2828.73   89.522  2828.73   89.522  2828.73   89.522  370.076   5.8684  370.076   5.8684 0.000000 0.000000 
1 1 1   15    0    9 o  207.671   2.2145  890.199   26.810  890.199   26.810  890.199   26.810  207.671   3.1317  207.671   3.1317 0.000000 0.000000 
1 1 1   15    0   10 o  289.437   3.5580  1730.29   60.026  1730.29   60.026  1730.29   60.026  289.437   5.0317  289.437   5.0317 0.000000 0.000000 
1 1 1   15    0   11 o  669.921   5.4312  9274.12  212.165  9274.12  212.165  9274.12  212.165  669.921   7.6809  669.921   7.6809 0.000000 0.000000 
1 1 1   15    0   12 o  164.152   2.1139  556.391   20.225  556.391   20.225  556.391   20.225  164.152   2.9895  164.152   2.9895 0.000000 0.000000 
1 1 1   15    0   13 o  555.702   4.6388  6379.59  150.311  6379.59  150.311  6379.59  150.311  555.702   6.5602  555.702   6.5602 0.000000 0.000000 
1 1 1   15    0   14 o  175.051   2.3101  632.816   23.569  632.816   23.569  632.816   23.569  175.051   3.2670  175.051   3.2670 0.000000 0.000000 
1 1 1   15    0   15 o  144.558   2.3292  431.795   19.616  431.795   19.616  431.795   19.616  144.558   3.2939  144.558   3.2939 0.000000 0.000000 
1 1 1   15    0   16 o  102.069   2.5417  215.758   15.089  215.758   15.089  215.758   15.089  102.069   3.5945  102.069   3.5945 0.000000 0.000000 
1 1 1   15    0   17 o  195.760   2.8606  791.940   32.632  791.940   32.632  791.940   32.632  195.760   4.0455  195.760   4.0455 0.000000 0.000000 
1 1 1   15    0   18 o  155.874   3.6121  503.383   32.761  503.383   32.761  503.383   32.761  155.874   5.1083  155.874   5.1083 0.000000 0.000000 
1 1 1   15    0   19 o  265.302   2.5701  1453.36   39.755  1453.36   39.755  1453.36   39.755  265.302   3.6347  265.302   3.6347 0.000000 0.000000 
1 1 1   15    0   20 o   56.304   3.9345   67.383   12.632   67.383   12.632   67.383   12.632   56.304   5.5642   56.304   5.5642 0.000000 0.000000 
1 1 1   15    0   21 o   65.773   4.8016   92.290   17.971   92.290   17.971   92.290   17.971   65.773   6.7905   65.773   6.7905 0.000000 0.000000 
1 1 1   15    0   22 o   64.523   5.5011   89.854   19.906   89.854   19.906   89.854   19.906   64.523   7.7798   64.523   7.7798 0.000000 0.000000 
1 1 1   15    0   23 o  260.991   3.9688  1409.93   60.355  1409.93   60.355  1409.93   60.355  260.991   5.6127  260.991   5.6127 0.000000 0.000000 
1 1 1   15    0   24 o   81.462   3.0628  138.201   14.459  138.201   14.459  138.201   14.459   81.462   4.3314   81.462   4.3314 0.000000 0.000000 
1 1 1   15    0   25 o  116.120   3.4926  280.117   23.558  280.117   23.558  280.117   23.558  116.120   4.9393  116.120   4.9393 0.000000 0.000000 
1 1 1   15    0   26 o  313.822   3.2006  2035.71   58.559  2035.71   58.559  2035.71   58.559  313.822   4.5264  313.822   4.5264 0.000000 0.000000 
1 1 1   15    0   27 o   46.332   5.1597   47.622   12.910   47.622   12.910   47.622   12.910   46.332   7.2969   46.332   7.2969 0.000000 0.000000 
1 1 1   15    0   28 o  270.770   2.7341  1515.10   43.162  1515.10   43.162  1515.10   43.162  270.770   3.8666  270.770   3.8666 0.000000 0.000000 
1 1 1   15    0   29 o   29.150   10.682   26.295   23.471   26.295   23.471   26.295   23.471   29.150   15.107   29.150   15.107 0.000000 0.000000 
1 1 1   15    0   30 o   41.870   5.8968   40.439   12.786   40.439   12.786   40.439   12.786   41.870   8.3393   41.870   8.3393 0.000000 0.000000 
1 1 1   15    0   31 o  102.284   3.1021  217.558   18.430  217.558   18.430  217.558   18.430  102.284   4.3871  102.284   4.3871 0.000000 0.000000 
1 1 1   15    0   32 o   48.306   5.0739   51.635   13.368   51.635   13.368   51.635   13.368   48.306   7.1755   48.306   7.1755 0.000000 0.000000 
1 1 1   15    0   33 o   13.891   6.3607  -0.2235   12.171  -0.2235   12.171  -0.2235   12.171   13.891   8.9954   13.891   8.9954 0.000000 0.000000 
1 1 1   15    0   34 o   16.793   7.0815   6.6188   12.226   6.6188   12.226   6.6188   12.226   16.793   10.015   16.793   10.015 0.000000 0.000000 
1 1 1   15    0   35 o   91.905   3.4731  176.911   18.497  176.911   18.497  176.911   18.497   91.905   4.9118   91.905   4.9118 0.000000 0.000000 
1 1 1   15    0   36 o   20.316   7.6156   12.938   12.134   12.938   12.134   12.938   12.134   20.316   10.770   20.316   10.770 0.000000 0.000000 
1 1 1   15    0   37 o   54.215   8.0692   70.651   22.463   70.651   22.463   70.651   22.463   54.215   11.412   54.215   11.412 0.000000 0.000000 
1 1 1   15    0   38 o   12.180   6.2376 -44.7177   23.701 -44.7177   23.701 -44.7177   23.701   12.180   8.8213   12.180   8.8213 0.000000 0.000000 
1 1 1   15    0   39 o   74.926   6.0673  124.365   25.616  124.365   25.616  124.365   25.616   74.926   8.5805   74.926   8.5805 0.000000 0.000000 
1 1 1   15    0   40 o   46.756   10.974   62.633   26.632   62.633   26.632   62.633   26.632   46.756   15.519   46.756   15.519 0.000000 0.000000 
1 1 1   15    0   41 o   21.008   9.7400   1.7722   29.826   1.7722   29.826   1.7722   29.826   21.008   13.774   21.008   13.774 0.000000 0.000000 
1 1 1   15    0   42 o   28.869   10.382   29.482   21.916   29.482   21.916   29.482   21.916   28.869   14.682   28.869   14.682 0.000000 0.000000 
1 1 1   15    0   43 o   16.088   7.6677  -5.2234   20.764  -5.2234   20.764  -5.2234   20.764   16.088   10.844   16.088   10.844 0.000000 0.000000 
1 1 1   15    0   44 o   51.846   8.2300   68.587   21.725   68.587   21.725   68.587   21.725   51.846   11.639   51.846   11.639 0.000000 0.000000 
1 1 1   15    0   45 f   25.829   10.559   25.131   25.791   25.131   25.791   25.131   25.791   25.829   14.932   25.829   14.932 0.000000 0.000000 
1 1 1   15    0   46 o   21.031   9.6808   9.1013   28.695   9.1013   28.695   9.1013   28.695   21.031   13.691   21.031   13.691 0.000000 0.000000 
1 1 1   15    1    0 o   61.642   2.6091   79.216   9.3040   79.216   9.3040   79.216   9.3040   61.642   3.6898   61.642   3.6898 0.000000 0.000000 
1 1 1   15    1    1 o  370.186   2.9338  2827.66   44.794  2832.34   63.448  2823.01   63.249  370.491   4.1522  369.881   4.1460 0.6102600 5.867662 
1 1 1   15    1    2 o  133.382   2.0581  366.983   11.322  369.201   16.052  364.787   15.972  133.783   2.9090  132.981   2.9121 0.8020782 4.116193 
1 1 1   15    1    3 o  421.558   3.2183  3667.16   55.951  3644.87   78.482  3690.20   79.789  420.257   4.5278  422.859   4.5749 -2.602081 6.436660 
1 1 1   15    1    4 o  473.278   3.5119  4623.36   68.552  4615.99   96.736  4630.79   97.159  472.900   4.9597  473.656   4.9734 -0.7563477 7.023746 
1 1 1   15    1    5 o  198.631   2.8216  812.896   22.605  820.008   36.023  808.277   29.032  199.334   4.3816  197.928   3.5564 1.406143 5.643296 
1 1 1   15    1    6 o   84.776   3.2692  148.340   11.430  148.199   16.047  148.486   16.284   84.736   4.5915   84.817   4.6550 -0.8123016E-01 6.538396 
1 1 1   15    1    7 o  303.723   3.6834  1904.61   46.142  1900.56   65.093  1908.70   65.417  303.400   5.2018  304.047   5.2165 -0.6478577 7.366856 
1 1 1   15    1    8 o  271.906   2.6495  1525.41   29.393  1523.96   38.814  1527.36   45.004  271.767   3.4628  272.044   4.0110 -0.2769470 5.298961 
1 1 1   15    1    9 o  405.905   3.1356  3400.90   52.492  3410.24   74.496  3391.69   73.978  406.457   4.4438  405.353   4.4249 1.104889 6.271109 
1 1 1   15    1   10 o   43.859   3.2404   40.014   5.8041   33.805   8.2516   46.095   8.1657   40.462   4.9445   47.257   4.1895 -6.794498 6.480760 
1 1 1   15    1   11 o  152.251   2.0841  477.870   13.082  461.152   18.213  495.685   18.801  149.502   2.9537  154.999   2.9410 -5.496857 4.168211 
1 1 1   15    1   12 o  202.714   2.2159  847.890   18.526  853.381   26.339  842.513   26.062  203.363   3.1402  202.065   3.1272 1.298523 4.431765 
1 1 1   15    1   13 f  231.558   2.3227  1106.40   22.182  1096.67   31.177  1116.38   31.566  230.527   3.2790  232.589   3.2905 -2.061829 4.645364 
1 1 1   15    1   14 f  246.815   2.6177  1259.96   26.544  1226.46   39.012  1288.84   36.221  243.742   3.8806  249.887   3.5144 -6.145569 5.235451 
1 1 1   15    1   15 o   34.372   5.2279   25.282   7.3528   31.327   10.300   19.002   10.499   38.913   6.4179   29.832   8.2542 9.081059 10.45570 
1 1 1   15    1   16 o  175.634   2.3323  636.260   16.888  619.149   23.494  654.555   24.293  173.193   3.2889  178.075   3.3076 -4.882187 4.664500 
1 1 1   15    1   17 o  223.533   2.6735  1030.55   24.221  1024.59   31.418  1039.27   38.027  222.768   3.4195  224.298   4.1106 -1.530762 5.346922 
1 1 1   15    1   18 o   76.878   4.2235  123.986   12.531  117.660   21.717  127.144   15.342   75.332   6.9896   78.423   4.7432 -3.090378 8.447075 
1 1 1   15    1   19 o  214.712   2.8772  946.105   24.379  974.053   41.219  931.068   30.234  217.081   4.6038  212.344   3.4522 4.736542 5.754305 
1 1 1   15    1   20 o   74.050   3.1003  113.467   9.4282  127.093   13.463  100.352   13.208   78.426   4.1620   69.673   4.5963 8.752502 6.200666 
1 1 1   15    1   21 f   44.031   4.4016   40.231   7.9827   38.983   11.474   41.401   11.113   43.361   6.4156   44.700   6.0280 -1.338394 8.803250 
1 1 1   15    1   22 o  138.195   2.7580  395.813   15.672  373.663   22.640  416.189   21.715  134.458   4.0825  141.931   3.7094 -7.472717 5.516063 
1 1 1   15    1   23 o  138.928   3.9371  403.444   22.329  433.155   30.249  367.872   33.099  144.653   5.0702  133.203   6.0247 11.44983 7.874255 
1 1 1   15    1   24 f  106.462   2.7182  234.274   11.935  236.504   16.851  232.031   16.905  106.971   3.8194  105.952   3.8685 1.019547 5.436303 
1 1 1   15    1   25 o   92.770   2.8843  177.997   11.034  175.124   15.673  180.820   15.536   92.025   4.1294   93.516   4.0280 -1.490852 5.768634 
1 1 1   15    1   26 o   98.974   2.9133  202.604   11.892  204.776   16.788  200.416   16.847   99.509   4.0904   98.440   4.1493 1.069061 5.826523 
1 1 1   15    1   27 o  100.817   2.9436  210.208   12.238  207.104   17.108  213.461   17.512  100.056   4.1456  101.578   4.1801 -1.521317 5.887161 
1 1 1   15    1   28 f  150.587   2.6144  468.856   16.235  466.325   22.726  471.494   23.202  150.176   3.6690  150.999   3.7254 -0.8237915 5.228830 
1 1 1   15    1   29 o   71.304   4.9121  110.972   13.510   90.317   22.317  122.919   16.973   65.660   8.2409   76.948   5.3481 -11.28758 9.824172 
1 1 1   15    1   30 o   84.774   3.7449  148.855   13.072  139.948   17.895  159.045   19.142   82.065   5.2871   87.484   5.3051 -5.418213 7.489799 
1 1 1   15    1   31 o  132.715   3.5231  373.103   18.835  409.144   24.921  325.090   28.764  140.462   4.3017  124.968   5.5806 15.49404 7.046147 
1 1 1   15    1   32 o   47.306   5.5376   49.927   10.135   35.686   14.944   62.054   13.791   40.164   9.2168   54.447   6.1411 -14.28350 11.07527 
1 1 1   15    1   33 o   42.862   5.7067   42.087   9.5825   55.852   13.016   25.798   14.159   51.588   6.1175   34.136   9.6356 17.45192 11.41350 
1 1 1   15    1   34 o   35.201   5.9158   27.635   8.4804   24.847   12.069   30.354   11.918   33.382   8.6837   37.020   8.0361 -3.638008 11.83151 
1 1 1   15    1   35 o   56.728   6.4848   80.393   12.631   94.650   15.278   49.608   22.451   67.140   5.5173   46.317   11.738 20.82275 12.96964 
1 1 1   15    1   36 o   75.901   5.6720  125.489   17.486  151.671   24.992  100.380   24.474   84.054   7.2091   67.748   8.7588 16.30586 11.34407 
1 1 1   15    1   37 o   33.194   9.2091   20.200   18.047   8.9039   32.840   25.088   21.601   32.296   13.829   34.093   12.165 -1.796883 18.41821 
1 1 1   15    1   38 o   56.944   8.4820   76.973   19.771   53.446   27.583  101.832   28.353   46.564   13.547   67.323   10.211 -20.75986 16.96408 
1 1 1   15    1   39 o   40.758   8.6705   40.885   16.184   50.429   22.290   30.244   23.536   45.453   11.790   36.063   12.717 9.390018 17.34098 
1 1 1   15    1   40 o   22.249   7.1645 -16.0681   15.451   6.4299   22.076 -37.6715   21.632   26.834   11.410   17.665   8.6677 9.168926 14.32896 
1 1 1   15    1   41 o   30.476   8.7220   14.443   18.276   27.853   22.966  -8.7135   30.178   34.460   12.512   26.493   12.155 7.966139 17.44400 
1 1 1   15    1   42 f   24.854   7.7162   2.4163   15.214   2.0754   21.727   2.7443   21.311   24.854   10.937   24.855   10.887 -0.1111984E-02 15.43235 
1 1 1   15    1   43 o   24.765   7.6054  -1.9340   15.338 -19.4971   20.831   18.861   22.667   19.494   9.3007   30.036   12.036 -10.54263 15.21070 
1 1 1   15    1   44 o   19.603   6.6254 -19.3225   15.040 -14.5612   21.971 -23.5214   20.633   20.714   9.7860   18.493   8.9342 2.221064 13.25085 
1 1 1   15    1   45 o   40.548   9.6527   48.803   19.464   63.606   28.758   36.290   26.439   45.646   13.969   35.451   13.325 10.19425 19.30548 
1 1 1   15    1   46 o   27.984   8.7794   12.759   20.227   16.856   28.804   8.7736   28.412   28.937   12.667   27.031   12.160 1.905781 17.55889 
1 1 1   15    2    0 o  339.834   2.7798  2383.20   55.084  2383.20   55.084  2383.20   55.084  339.834   3.9312  339.834   3.9312 0.000000 0.000000 
1 1 1   15    2    1 o  204.335   2.1823  861.252   18.391  869.795   26.149  852.890   25.872  205.338   3.0876  203.332   3.0850 2.005234 4.364686 
1 1 1   15    2    2 o  175.422   2.1038  634.765   15.221  630.544   21.408  639.081   21.644  174.832   2.9689  176.012   2.9815 -1.179260 4.207557 
1 1 1   15    2    3 o  274.349   2.4594  1552.84   27.828  1549.31   39.225  1556.43   39.487  274.035   3.4705  274.664   3.4857 -0.6285706 4.918759 
1 1 1   15    2    4 o  345.179   2.8097  2457.53   39.982  2490.64   57.582  2426.70   55.557  347.421   4.0185  342.937   3.9279 4.483948 5.619347 
1 1 1   15    2    5 o  189.191   2.7707  740.532   21.228  728.096   33.199  749.133   27.610  187.832   4.2854  190.549   3.5132 -2.716782 5.541387 
1 1 1   15    2    6 o  171.082   2.7327  602.667   18.883  610.380   29.997  597.605   24.302  171.976   4.2290  170.188   3.4621 1.788101 5.465415 
1 1 1   15    2    7 o  317.391   3.7786  2080.02   49.463  2088.89   70.240  2071.29   69.665  318.061   5.3544  316.720   5.3331 1.340363 7.557178 
1 1 1   15    2    8 o  224.973   2.4379  1045.78   22.432  1055.84   29.931  1032.89   33.883  226.218   3.2079  223.728   3.6719 2.489838 4.875851 
1 1 1   15    2    9 o  171.289   2.1107  605.123   14.908  595.831   20.825  614.890   21.351  169.941   2.9712  172.637   2.9986 -2.695969 4.221328 
1 1 1   15    2   10 o  147.294   2.0922  447.567   12.709  453.485   18.078  441.785   17.871  148.256   2.9565  146.331   2.9610 1.925156 4.184303 
1 1 1   15    2   11 o  211.758   2.2335  923.905   19.491  892.868   26.894  958.237   28.286  208.019   3.1347  215.497   3.1825 -7.478455 4.467058 
1 1 1   15    2   12 o  195.204   2.1996  786.278   17.709  789.401   25.031  783.149   25.059  195.593   3.1028  194.816   3.1187 0.7766876 4.399290 
1 1 1   15    2   13 o  274.383   2.4839  1553.73   28.109  1546.03   39.540  1561.59   39.967  273.697   3.5027  275.070   3.5228 -1.372833 4.967789 
1 1 1   15    2   14 o  193.789   2.3468  770.725   18.202  792.792   29.755  757.529   23.009  195.976   3.6812  191.602   2.9116 4.373367 4.693504 
1 1 1   15    2   15 o  158.373   2.8085  517.927   18.344  512.704   25.992  523.109   25.892  157.576   3.9993  159.170   3.9440 -1.593689 5.616902 
1 1 1   15    2   16 o  347.317   2.9018  2491.23   41.567  2484.59   58.581  2497.97   58.991  346.852   4.0950  347.782   4.1126 -0.9302673 5.803605 
1 1 1   15    2   17 o   74.197   4.2078  121.053   11.201  129.699   13.231   99.180   21.044   79.238   4.0484   69.156   7.3779 10.08237 8.415619 
1 1 1   15    2   18 o  131.051   2.7666  356.634   14.617  345.691   23.079  363.963   18.887  129.339   4.3264  132.763   3.4493 -3.423904 5.533102 
1 1 1   15    2   19 o  182.146   3.0328  676.784   22.567  747.849   34.954  625.990   29.551  190.225   4.4552  174.066   4.1162 16.15942 6.065637 
1 1 1   15    2   20 o  192.934   2.3897  767.564   19.002  800.734   27.497  737.241   26.290  196.918   3.3856  188.950   3.3735 7.967575 4.779400 
1 1 1   15    2   21 o   30.966   5.6949   20.646   7.5649   27.558   10.664   13.646   10.733   35.768   7.4699   26.164   8.5982 9.604021 11.38984 
1 1 1   15    2   22 f  208.290   2.7914  896.591   23.939  896.283   34.889  896.865   32.908  208.243   4.0621  208.337   3.8297 -0.9335327E-01 5.582789 
1 1 1   15    2   23 o  144.030   2.8391  429.605   16.802  438.597   22.927  419.173   24.694  145.678   3.8158  142.382   4.2051 3.295410 5.678272 
1 1 1   15    2   24 o   39.726   5.5563   33.996   8.7702   34.292   12.086   33.667   12.746   39.952   7.6128   39.501   8.0955 0.4505348 11.11265 
1 1 1   15    2   25 o  134.454   3.3408  374.307   18.519  383.347   26.059  365.083   26.322  136.103   4.6422  132.805   4.8056 3.298462 6.681583 
1 1 1   15    2   26 o  188.049   3.4705  749.579   24.231  773.754   28.856  691.764   44.624  193.488   3.6159  182.610   5.9248 10.87794 6.941073 
1 1 1   15    2   27 o  103.568   3.1781  222.611   13.410  225.956   17.716  218.123   20.523  104.513   4.1099  102.623   4.8487 1.889755 6.356140 
1 1 1   15    2   28 o  142.940   4.2278  448.778   23.149  506.726   29.109  349.085   38.181  156.435   4.5116  129.444   7.1515 26.99098 8.455631 
1 1 1   15    2   29 o  142.155   4.0453  423.997   23.244  442.552   30.405  397.903   36.056  146.054   5.0473  138.255   6.3231 7.798477 8.090550 
1 1 1   15    2   30 o   39.219   5.8239   33.700   9.3047   23.209   13.350   43.612   12.976   32.751   9.3944   45.688   6.8861 -12.93716 11.64784 
1 1 1   15    2   31 o   44.999   5.3438   43.058   9.7109   45.344   13.901   40.878   13.572   46.519   7.2449   43.480   7.8573 3.039322 10.68770 
1 1 1   15    2   32 o   68.565   4.2307   98.818   11.833   94.973   17.913  101.795   15.762   67.296   6.4537   69.835   5.4722 -2.538635 8.461406 
1 1 1   15    2   33 o   64.010   5.6045   89.930   13.392   79.767   24.047   94.500   16.124   60.870   9.5784   67.151   5.8220 -6.280369 11.20894 
1 1 1   15    2   34 o   30.146   7.2697   19.433   10.659   23.299   12.354   8.1709   21.085   32.355   8.9542   27.937   11.455 4.418615 14.53943 
1 1 1   15    2   35 o   43.769   6.8728   42.226   11.065   42.009   12.879   42.835   21.623   44.479   7.0206   43.060   11.817 1.418945 13.74552 
1 1 1   15    2   36 o   66.299   5.0244   93.700   12.179   93.011   14.250   95.566   23.462   66.446   5.1996   66.153   8.5989 0.2933731 10.04876 
1 1 1   15    2   37 o   68.240   5.7375  101.385   13.371  101.445   15.191  101.178   28.175   69.314   5.3137   67.167   10.171 2.147263 11.47505 
1 1 1   15    2   38 o   32.077   8.1515   17.525   15.168   36.786   21.768  -0.6510   21.146   39.384   12.170   24.769   10.848 14.61521 16.30301 
1 1 1   15    2   39 o   65.664   6.2508   96.029   16.921   92.871   23.500   99.428   24.383   64.552   8.8265   66.776   8.8533 -2.224525 12.50155 
1 1 1   15    2   40 f   44.217   9.0775   44.384   19.177   81.587   29.865   18.280   25.016   56.829   13.021   31.605   12.651 25.22354 18.15496 
1 1 1   15    2   41 o   33.277   9.9921   15.577   23.584   28.336   36.956   6.8108   30.632   36.670   15.116   29.883   13.072 6.786358 19.98428 
1 1 1   15    2   42 o   24.705   7.7316  -3.2452   16.478   12.908   22.631 -21.4707   24.039   28.372   11.773   21.038   10.025 7.333746 15.46316 
1 1 1   15    2   43 o   35.553   8.5028   32.464   15.426   43.599   21.657   20.997   21.977   40.476   12.065   30.631   11.984 9.844784 17.00560 
1 1 1   15    2   44 f   30.955   8.1849   15.771   16.113  -8.2228   21.608   45.826   24.184   21.775   10.095   40.134   12.886 -18.35900 16.36978 
1 1 1   15    2   45 o   34.594   8.7715   26.198   19.809   62.244   27.328 -13.7090   28.754   45.624   13.542   23.564   11.152 22.05918 17.54303 
1 1 1   15    2   46 o   41.980   10.281   60.983   22.319   68.493   29.366   50.712   34.344   45.978   14.124   37.981   14.945 7.996593 20.56290 
1 1 1   15    2   47 o   29.635   13.295   20.775   33.704   0.0000   0.0000   20.775   33.704  ?   ?    29.635   13.295      ?      ? 
1 1 1   15    3    0 o  541.358   3.9121  6048.95  123.501  6048.95  123.501  6048.95  123.501  541.358   5.5325  541.358   5.5325 0.000000 0.000000 
1 1 1   15    3    1 o  380.069   2.9886  2980.85   46.848  2985.30   66.350  2976.42   66.156  380.352   4.2295  379.786   4.2234 0.5657349 5.977117 
1 1 1   15    3    2 o  237.991   2.3036  1168.40   22.610  1176.33   32.194  1160.68   31.761  238.787   3.2689  237.194   3.2466 1.593155 4.607193 
1 1 1   15    3    3 o  428.735   3.2577  3793.58   57.605  3780.64   81.110  3806.76   81.825  427.998   4.5948  429.472   4.6194 -1.474182 6.515460 
1 1 1   15    3    4 o  340.498   2.9949  2396.38   41.772  2359.10   62.595  2426.30   56.089  338.092   4.4889  342.904   3.9659 -4.810944 5.989814 
1 1 1   15    3    5 o  113.600   2.7324  266.179   12.513  266.821   19.939  265.762   16.072  113.705   4.2516  113.494   3.4334 0.2113113 5.464873 
1 1 1   15    3    6 o  217.085   2.8934  971.134   25.355  979.443   40.305  965.693   32.618  217.836   4.4860  216.334   3.6556 1.502441 5.786895 
1 1 1   15    3    7 o  142.982   2.5620  424.235   14.196  428.908   17.377  414.859   24.614  144.188   2.9220  141.777   4.2093 2.411163 5.124071 
1 1 1   15    3    8 o  319.455   2.8909  2106.80   37.710  2110.28   49.950  2102.19   57.504  319.780   3.7872  319.130   4.3688 0.6500549 5.781823 
1 1 1   15    3    9 o  322.511   2.9125  2144.59   38.276  2132.53   50.311  2161.17   58.977  321.456   3.7947  323.566   4.4193 -2.109497 5.824940 
1 1 1   15    3   10 o  237.547   2.3122  1164.31   22.653  1169.28   32.207  1159.45   31.867  238.048   3.2804  237.046   3.2595 1.001572 4.624373 
1 1 1   15    3   11 o  128.663   2.1121  341.299   11.204  328.680   15.614  354.692   16.085  126.213   2.9994  131.113   2.9745 -4.899803 4.224288 
1 1 1   15    3   12 o  193.571   2.3833  768.769   18.735  748.633   24.299  798.281   29.418  190.475   3.0931  196.667   3.6267 -6.192612 4.766552 
1 1 1   15    3   13 o  224.354   3.3145  1039.41   30.669  1029.41   43.098  1049.67   43.652  223.261   4.6803  225.446   4.6945 -2.185028 6.629038 
1 1 1   15    3   14 o   63.482   3.1748   87.279   7.8138   69.687   12.710   97.968   9.9072   58.071   5.3067   68.894   3.4866 -10.82281 6.349567 
1 1 1   15    3   15 o  166.546   2.3143  572.459   15.896  576.599   22.630  568.427   22.335  167.140   3.2827  165.952   3.2631 1.187775 4.628620 
1 1 1   15    3   16 o  232.218   2.4441  1113.02   23.406  1098.56   32.795  1128.04   33.416  230.681   3.4469  233.755   3.4660 -3.073318 4.888227 
1 1 1   15    3   17 o   61.307   4.4550   78.754   10.053   79.905   11.849   75.796   18.991   62.176   4.6206   60.438   7.6183 1.737946 8.910030 
1 1 1   15    3   18 o   43.836   5.4763   39.669   9.0902   43.362   16.075   37.933   11.022   44.874   8.9984   42.797   6.2441 2.077343 10.95266 
1 1 1   15    3   19 o  226.170   2.9049  1056.61   27.091  1090.01   38.597  1024.18   38.035  229.695   4.0741  222.644   4.1420 7.050964 5.809857 
1 1 1   15    3   20 o  107.286   2.5930  237.762   11.473  241.672   16.241  233.866   16.209  108.168   3.6404  106.404   3.6936 1.763878 5.186004 
1 1 1   15    3   21 o   54.925   3.7928   62.496   8.5826   61.234   12.354   63.674   11.932   54.383   5.5078   55.467   5.2158 -1.084080 7.585603 
1 1 1   15    3   22 f  199.420   5.4423  823.454   44.763  823.454   44.763   0.0000   0.0000  199.420   5.4423  ?   ?       ?      ? 
1 1 1   15    3   23 o  141.804   3.7325  429.460   20.996  476.619   27.221  360.207   32.987  151.810   4.3475  131.798   6.0684 20.01241 7.464990 
1 1 1   15    3   24 o   48.619   6.7325   64.224   12.597   16.665   22.102   87.103   15.330   32.413   12.183   64.825   5.7336 -32.41205 13.46508 
1 1 1   15    3   25 o  146.966   2.5382  445.951   15.378  462.100   22.136  430.887   21.379  149.535   3.5892  144.397   3.5898 5.138535 5.076321 
1 1 1   15    3   26 o  142.848   3.3568  422.308   19.773  416.374   27.617  428.549   28.323  141.822   4.7214  143.875   4.7730 -2.052567 6.713644 
1 1 1   15    3   27 o  135.871   2.6689  381.724   14.953  380.710   21.358  382.699   20.942  135.689   3.8163  136.052   3.7321 -0.3621368 5.337889 
1 1 1   15    3   28 o  168.910   3.4549  593.976   22.650  599.434   27.762  583.110   39.171  170.218   3.9544  167.602   5.6665 2.616043 6.909888 
1 1 1   15    3   29 o   49.333   7.3559   52.134   14.914   75.112   22.001   32.597   20.287   59.782   8.9229   38.884   11.697 20.89858 14.71180 
1 1 1   15    3   30 o  148.107   2.8615  455.323   17.344  447.167   26.081  461.789   23.223  146.871   4.3054  149.343   3.7703 -2.472519 5.722930 
1 1 1   15    3   31 o  137.449   2.7088  391.404   15.352  380.125   21.642  402.828   21.782  135.449   3.8740  139.450   3.7871 -4.000702 5.417579 
1 1 1   15    3   32 o   93.011   3.4595  178.936   13.117  188.117   20.362  172.425   17.149   94.978   5.1980   91.045   4.5667 3.932266 6.919096 
1 1 1   15    3   33 o   62.596   6.3746  104.506   12.936  135.499   15.969   45.342   22.063   80.605   4.8033   44.588   11.810 36.01719 12.74921 
1 1 1   15    3   34 o   32.029   8.4718   17.882   10.799   18.170   11.391   15.332   33.931   28.882   8.7822   35.176   14.490 -6.293905 16.94365 
1 1 1   15    3   35 o   72.113   4.6275  102.925   12.223   95.267   14.099  126.100   24.525   67.436   5.0689   76.791   7.7435 -9.355049 9.255035 
1 1 1   15    3   36 o   71.603   5.6801  112.107   16.605  126.225   23.109   97.034   23.877   76.605   7.3141   66.601   8.6925 10.00381 11.36021 
1 1 1   15    3   37 o   95.410   4.5597  194.575   15.376  194.823   17.709  193.814   30.993   96.386   4.4546   94.434   7.9573 1.952759 9.119362 
1 1 1   15    3   38 o  104.796   4.3095  234.147   18.577  238.698   25.527  229.023   27.087  106.016   5.8380  103.576   6.3408 2.440193 8.619000 
1 1 1   15    3   39 o   21.849   6.8184  -0.6838   9.6223  -1.9142   10.713   4.4527   21.889   17.377   7.6620   26.321   11.281 -8.944628 13.63685 
1 1 1   15    3   40 o   18.508   6.0072  -6.7885   10.067   0.3438   11.443 -31.2163   21.177   18.761   8.0998   18.254   8.8735 0.5068359 12.01443 
1 1 1   15    3   41 o   39.833   7.0591   42.927   12.057   51.925   14.138   18.935   23.087   48.667   7.0438   31.000   12.236 17.66719 14.11817 
1 1 1   15    3   42 o   77.761   5.6782  138.782   17.838  160.434   24.522  114.448   25.997   85.142   6.9830   70.380   8.9557 14.76105 11.35636 
1 1 1   15    3   43 o   26.200   7.8433   8.4571   14.842   1.6536   20.945   15.319   21.034   24.086   10.662   28.314   11.506 -4.227804 15.68653 
1 1 1   15    3   44 o   39.924   9.5250   36.790   19.464   82.347   33.434   13.433   23.939   51.781   14.871   28.067   11.906 23.71416 19.05006 
1 1 1   15    3   45 o   24.859   7.8248  -1.0028   17.408   17.778   23.492 -23.8717   25.923   28.863   11.988   20.854   10.060 8.009308 15.64956 
1 1 1   15    3   46 o   23.208   8.1833 -49.3994   27.134 -22.1847   47.615 -62.4871   33.020   27.016   13.171   19.399   9.7152 7.617445 16.36656 
1 1 1   15    3   47 o   38.197   14.628   54.441   32.229   0.0000   0.0000   54.441   32.229  ?   ?    38.197   14.628      ?      ? 
1 1 1   15    4    0 o  126.850   2.0571  332.409   15.203  332.409   15.203  332.409   15.203  126.850   2.9092  126.850   2.9092 0.000000 0.000000 
1 1 1   15    4    1 o  247.614   2.3420  1264.76   23.916  1276.39   34.122  1253.53   33.530  248.732   3.3261  246.496   3.2981 2.236496 4.684095 
1 1 1   15    4    2 o  141.245   2.0493  411.182   11.933  398.536   16.581  424.768   17.187  138.994   2.8923  143.495   2.9040 -4.501328 4.098614 
1 1 1   15    4    3 o  433.710   3.5461  3885.51   62.872  3863.99   95.344  3902.07   83.632  432.617   5.3435  434.803   4.6635 -2.185425 7.092300 
1 1 1   15    4    4 o  219.061   2.4105  990.534   21.567  986.930   32.843  993.266   28.597  218.703   3.6410  219.419   3.1599 -0.7158508 4.820975 
1 1 1   15    4    5 o  315.201   3.4418  2044.73   43.613  2078.69   70.272  2023.45   55.621  317.288   5.3698  313.114   4.3070 4.174011 6.883698 
1 1 1   15    4    6 o  261.012   3.1247  1403.19   32.858  1420.15   52.568  1392.31   42.095  262.279   4.8595  259.745   3.9293 2.533997 6.249369 
1 1 1   15    4    7 o  510.612   4.0377  5383.38   84.080  5373.58  110.865  5396.65  128.999  510.125   5.2693  511.100   6.1195 -0.9756470 8.075485 
1 1 1   15    4    8 o  545.263   4.8256  6149.53  102.462  6157.97  125.731  6132.84  176.795  546.029   5.5829  544.498   7.8724 1.530396 9.651101 
1 1 1   15    4    9 o  394.825   3.3169  3219.87   53.508  3228.86   71.034  3208.07   81.354  395.494   4.3547  394.156   5.0043 1.337982 6.633775 
1 1 1   15    4   10 o  107.255   2.1390  237.372   9.4610  232.516   13.372  242.239   13.388  106.156   3.0541  108.354   2.9957 -2.197960 4.278072 
1 1 1   15    4   11 o  115.536   2.3208  272.375   10.915  257.585   14.174  293.928   17.111  111.729   3.0758  119.342   3.4762 -7.612343 4.641588 
1 1 1   15    4   12 o  260.737   2.5997  1406.80   27.850  1451.33   38.123  1355.85   40.783  265.184   3.4856  256.291   3.8581 8.893707 5.199467 
1 1 1   15    4   13 o  336.877   2.8956  2345.62   39.160  2331.65   62.987  2354.43   49.997  336.013   4.5450  337.740   3.5892 -1.726990 5.791272 
1 1 1   15    4   14 o  247.873   2.5128  1267.46   24.992  1271.83   40.346  1264.73   31.836  248.193   3.9414  247.554   3.1180 0.6389160 5.025592 
1 1 1   15    4   15 o  134.237   2.3925  371.919   13.245  369.504   18.574  374.418   18.891  133.794   3.3660  134.680   3.4008 -0.8855743 4.784905 
1 1 1   15    4   16 o  102.440   3.8503  216.717   16.268  216.717   16.268   0.0000   0.0000  102.440   3.8503  ?   ?       ?      ? 
1 1 1   15    4   17 o  144.137   3.7811  427.307   22.344  366.094   30.468  498.542   32.867  133.014   5.5537  155.259   5.1327 -22.24556 7.562235 
1 1 1   15    4   18 f  281.444   3.0861  1634.98   35.799  1587.18   49.503  1687.39   51.832  277.141   4.3308  285.747   4.3979 -8.606018 6.172289 
1 1 1   15    4   19 o  215.177   3.6503  955.292   32.301  1063.72   46.862  857.141   44.585  226.799   5.0097  203.554   5.3106 23.24562 7.300637 
1 1 1   15    4   20 o  211.093   2.6351  922.828   22.746  902.241   34.290  939.005   30.396  208.959   3.9787  213.226   3.4563 -4.266800 5.270267 
1 1 1   15    4   21 o   88.180   3.1883  162.056   11.482  149.711   17.076  172.247   15.514   85.071   4.8667   91.290   4.1203 -6.218758 6.376621 
1 1 1   15    4   22 o  177.989   2.5416  651.968   18.550  632.237   24.769  677.169   27.992  174.948   3.4327  181.029   3.7490 -6.080780 5.083145 
1 1 1   15    4   23 f   85.941   2.9964  153.106   10.593  145.182   15.272  160.455   14.707   83.782   4.4194   88.099   4.0474 -4.317642 5.992749 
1 1 1   15    4   24 o  126.744   2.9392  333.611   15.290  351.494   20.993  313.405   22.314  130.398   3.9034  123.090   4.3954 7.307220 5.878418 
1 1 1   15    4   25 o  165.341   2.8518  554.180   18.715  605.285   31.628  526.644   23.215  171.040   4.4834  159.643   3.5258 11.39746 5.703682 
1 1 1   15    4   26 f   68.572   3.5438   97.381   9.9978  106.809   14.320   88.416   13.964   71.820   4.8344   65.324   5.1830 6.495750 7.087662 
1 1 1   15    4   27 o  129.906   3.2561  357.472   16.750  317.889   26.973  382.318   21.370  123.836   5.2809  135.975   3.8104 -12.13889 6.512111 
1 1 1   15    4   28 o   59.150   5.5596   68.863   11.794   64.876   13.483   81.863   24.343   55.886   5.8493   62.415   9.4562 -6.529167 11.11911 
1 1 1   15    4   29 o  172.972   4.0258  626.865   27.252  605.976   46.140  638.056   33.772  170.516   6.5606  175.428   4.6676 -4.911041 8.051575 
1 1 1   15    4   30 o   94.511   3.9578  190.055   14.290  174.383   24.984  197.674   17.421   91.380   6.6290   97.643   4.3259 -6.262390 7.915580 
1 1 1   15    4   31 o   34.725   6.4027   26.494   9.3579   31.434   13.174   21.463   13.295   37.858   8.6290   31.592   9.4615 6.266907 12.80542 
1 1 1   15    4   32 o   59.053   4.0066   72.958   9.7405   71.799   14.146   74.004   13.432   58.580   5.8550   59.527   5.4709 -0.9469643 8.013204 
1 1 1   15    4   33 o   98.462   3.9111  207.698   14.699  216.247   17.920  190.120   25.696  101.935   4.2624   94.990   6.5589 6.944954 7.822177 
1 1 1   15    4   34 o   94.100   5.5126  200.150   15.662  206.075   17.257  172.459   37.306   99.444   4.2074   88.756   10.191 10.68814 11.02525 
1 1 1   15    4   35 o   32.455   7.5646   20.713   10.325   18.690   11.749   27.574   21.636   29.220   8.9267   35.691   12.215 -6.471579 15.12920 
1 1 1   15    4   36 o   63.532   5.1101   82.065   11.874   76.947   13.724   97.300   23.679   60.346   5.5142   66.719   8.6050 -6.372707 10.22016 
1 1 1   15    4   37 o   28.804   7.4302   17.166   10.458   20.261   11.449   1.5727   25.697   30.001   8.7272   27.608   12.028 2.393158 14.86033 
1 1 1   15    4   38 o   26.892   7.9774   5.7289   15.046  -0.4374   20.593   12.791   22.038   24.475   10.712   29.309   11.824 -4.834036 15.95487 
1 1 1   15    4   39 f   65.459   5.8352   96.426   13.423   98.444   15.538   90.488   26.648   68.021   5.5385   62.897   10.272 5.124210 11.67039 
1 1 1   15    4   40 o   25.198   6.9903   11.159   10.189   15.106   11.483  -3.4441   22.087   26.329   8.8995   24.068   10.782 2.260956 13.98057 
1 1 1   15    4   41 o   61.998   6.2661   97.603   12.951  110.351   15.430   67.221   23.821   71.885   5.2043   52.110   11.400 19.77537 12.53221 
1 1 1   15    4   42 o   84.218   5.9891  145.338   14.703  138.554   15.821  188.329   39.824   80.593   4.7595   87.843   10.992 -7.250000 11.97814 
1 1 1   15    4   43 o   44.371   7.1551   49.221   11.450   49.914   13.101   46.981   23.563   47.383   6.7038   41.359   12.643 6.023197 14.31022 
1 1 1   15    4   44 o   39.688   9.3772   45.317   17.895   44.267   23.400   46.796   27.773   39.638   12.670   39.738   13.827 -0.1003189 18.75437 
1 1 1   15    4   45 o   29.386   8.8053   18.215   18.368   18.074   24.285   18.403   28.079   29.006   12.129   29.767   12.768 -0.7607117 17.61065 
1 1 1   15    4   46 o   26.584   9.1351 -22.2693   25.718   27.632   50.053 -40.1703   29.979   32.942   15.304   20.226   9.9788 12.71569 18.27013 
1 1 1   15    4   47 o   36.995   10.957   56.938   27.945   57.510   49.655   56.673   33.806   35.731   16.074   38.258   14.893 -2.527050 21.91304 
1 1 1   15    5    0 o   76.085   2.3255  120.075   10.277  120.075   10.277  120.075   10.277   76.085   3.2888   76.085   3.2888 0.000000 0.000000 
1 1 1   15    5    1 o  195.072   2.1540  785.010   17.330  779.933   24.425  790.157   24.592  194.436   3.0458  195.707   3.0466 -1.270264 4.307953 
1 1 1   15    5    2 o  252.586   2.5526  1317.41   26.340  1309.11   40.046  1323.74   34.968  251.874   3.8549  253.297   3.3472 -1.423111 5.105279 
1 1 1   15    5    3 o  453.046   3.6691  4236.28   67.810  4246.95  103.921  4228.37   89.485  453.504   5.5560  452.588   4.7938 0.9158325 7.338210 
1 1 1   15    5    4 o   36.334   4.0015   26.917   5.9366   29.653   9.2135   24.976   7.7628   37.890   5.8957   34.778   5.4119 3.112057 8.002952 
1 1 1   15    5    5 o  209.581   2.8645  903.429   24.159  920.394   38.838  892.721   30.856  211.163   4.4593  207.998   3.5968 3.165253 5.729067 
1 1 1   15    5    6 o  153.523   2.4237  486.118   15.344  475.300   21.440  497.477   21.968  151.773   3.4250  155.273   3.4303 -3.500290 4.847414 
1 1 1   15    5    7 o  215.576   2.4102  959.539   21.215  963.285   28.113  954.585   32.334  216.074   3.1546  215.078   3.6450 0.9956207 4.820500 
1 1 1   15    5    8 o  172.158   2.7544  614.215   19.214  625.739   25.069  597.804   29.915  174.137   3.4904  170.180   4.2620 3.957809 5.508884 
1 1 1   15    5    9 o  223.225   2.4401  1026.25   22.185  1015.67   29.087  1040.96   34.302  221.864   3.1787  224.586   3.7031 -2.721878 4.880275 
1 1 1   15    5   10 o  424.110   3.5020  3710.26   60.475  3686.80   79.311  3742.84   93.474  422.559   4.5507  425.661   5.3243 -3.101440 7.004052 
1 1 1   15    5   11 o   93.068   2.2716  178.738   8.7196  178.842   12.327  178.635   12.336   93.095   3.2104   93.041   3.2146 0.5406952E-01 4.543156 
1 1 1   15    5   12 o   91.371   2.4981  172.771   9.1082  170.478   14.850  174.155   11.532   90.874   3.9621   91.869   3.0435 -0.9942932 4.996131 
1 1 1   15    5   13 o   85.434   2.6124  152.329   8.9895  142.444   14.083  159.127   11.678   83.059   4.1110   87.809   3.2245 -4.749855 5.224705 
1 1 1   15    5   14 o  315.220   2.9455  2048.04   37.911  2079.16   58.056  2024.90   50.058  317.275   4.4366  313.166   3.8756 4.109039 5.890941 
1 1 1   15    5   15 o  186.731   2.6760  716.498   20.505  687.703   27.430  752.972   30.871  182.508   3.6440  190.955   3.9198 -8.447189 5.351941 
1 1 1   15    5   16 o  254.046   3.3096  1333.34   33.798  1331.27   43.192  1336.62   54.280  253.854   4.1253  254.237   5.1765 -0.3823242 6.619216 
1 1 1   15    5   17 o  283.922   2.6485  1664.94   31.014  1660.99   43.753  1668.93   43.969  283.584   3.7408  284.260   3.7503 -0.6762085 5.296999 
1 1 1   15    5   18 o  136.904   2.4520  386.970   13.844  379.340   19.461  394.787   19.698  135.538   3.4812  138.271   3.4540 -2.733398 4.903946 
1 1 1   15    5   19 o  104.216   3.0533  226.170   12.681  217.632   20.601  231.378   16.090  102.590   4.8687  105.841   3.6858 -3.251396 6.106510 
1 1 1   15    5   20 o   48.418   4.7485   51.990   8.7010   37.982   13.439   62.100   11.417   42.052   8.0413   54.785   5.0528 -12.73229 9.497009 
1 1 1   15    5   21 o  230.493   3.3422  1093.51   30.001  1115.05   52.039  1082.79   36.718  232.074   5.4367  228.911   3.8890 3.162750 6.684472 
1 1 1   15    5   22 o  181.207   3.1754  680.212   23.495  671.469   35.726  686.875   31.188  180.141   4.8085  182.274   4.1485 -2.133362 6.350705 
1 1 1   15    5   23 o  112.749   2.6070  262.673   12.123  266.427   17.228  258.992   17.061  113.547   3.6787  111.951   3.6950 1.596428 5.214014 
1 1 1   15    5   24 o   69.112   3.4905   98.917   9.9453   97.608   14.214  100.172   13.920   68.659   5.0193   69.565   4.8517 -0.9050522 6.980902 
1 1 1   15    5   25 o   99.706   3.1376  206.023   12.746  207.957   16.812  203.409   19.546  100.283   4.0647   99.129   4.7807 1.154434 6.275135 
1 1 1   15    5   26 o  138.936   3.3922  399.883   19.422  404.100   27.009  395.366   27.950  139.708   4.6872  138.164   4.9048 1.543976 6.784354 
1 1 1   15    5   27 o  261.657   3.7847  1418.65   40.822  1394.49   56.610  1444.83   58.920  259.353   5.2922  263.961   5.4120 -4.608490 7.569480 
1 1 1   15    5   28 o   89.940   4.2173  175.669   14.862  138.456   23.469  200.583   19.203   81.500   6.9818   98.380   4.7325 -16.88000 8.434541 
1 1 1   15    5   29 o  162.050   2.6306  543.374   17.580  534.521   24.692  552.476   25.036  160.710   3.7252  163.389   3.7152 -2.678467 5.261124 
1 1 1   15    5   30 o   79.114   4.1540  119.651   12.727  162.812   23.436  101.602   15.156   88.320   6.4338   69.909   5.2563 18.41058 8.307967 
1 1 1   15    5   31 o   67.480   4.2881   97.742   11.535   82.708   17.930  108.358   15.067   62.799   6.9226   72.161   5.0625 -9.361881 8.576234 
1 1 1   15    5   32 o   54.209   5.5901   57.654   11.444   51.557   13.402   74.064   21.987   49.536   6.5597   58.881   9.0537 -9.345257 11.18030 
1 1 1   15    5   33 f   67.859   4.7939   91.728   11.947   85.628   13.821  109.761   23.763   63.976   5.2379   71.743   8.0306 -7.767651 9.587833 
1 1 1   15    5   34 o   57.559   7.9980   75.634   12.687   76.022   13.611   73.066   35.032   60.179   5.4837   54.940   15.027 5.239731 15.99601 
1 1 1   15    5   35 o  148.316   4.1333  471.945   24.789  414.015   37.432  517.196   33.083  139.673   6.4978  156.959   5.1104 -17.28589 8.266661 
1 1 1   15    5   36 o   36.656   7.5536   33.585   11.539   37.773   12.866   16.373   26.084   41.173   7.8634   32.139   12.899 9.034187 15.10730 
1 1 1   15    5   37 o   36.696   7.3532   32.553   10.914   35.201   12.444   23.727   22.719   39.663   7.8844   33.729   12.414 5.934391 14.70646 
1 1 1   15    5   38 o   49.008   6.7605   60.343   11.677   67.120   13.723   42.567   22.226   56.123   5.9285   41.893   12.152 14.22913 13.52107 
1 1 1   15    5   39 o   45.377   7.4256   47.440   12.507   46.740   14.524   49.450   24.606   46.231   7.6169   44.522   12.749 1.708691 14.85118 
1 1 1   15    5   40 o   34.868   7.6199   27.639   11.009   26.130   12.746   32.070   21.844   33.415   9.0327   36.322   12.274 -2.907459 15.23974 
1 1 1   15    5   41 o   32.881   7.6830   25.192   11.098   24.953   12.745   25.944   22.574   32.436   9.1367   33.326   12.354 -0.8899956 15.36596 
1 1 1   15    5   42 o   51.610   8.4207   67.541   13.337   67.394   14.394   68.433   35.449   55.499   6.2883   47.721   15.623 7.778168 16.84144 
1 1 1   15    5   43 o   55.807   7.0880   77.623   12.914   78.776   14.651   73.605   27.348   59.936   5.9266   51.677   12.878 8.259007 14.17601 
1 1 1   15    5   44 o   23.336   7.2643   4.8887   11.188   6.0100   12.306  -0.4554   26.865   21.132   8.7180   25.540   11.622 -4.407778 14.52861 
1 1 1   15    5   45 o   41.902   9.7905   55.821   19.683   57.791   24.301   52.063   33.559   44.538   12.641   39.267   14.953 5.270718 19.58093 
1 1 1   15    5   46 f   31.499   9.9885   24.500   26.009   15.490   50.190   27.808   30.411   31.296   14.787   31.702   13.432 -0.4055481 19.97709 
1 1 1   15    5   47 o   37.097   10.668   58.628   28.343   29.291   52.188   70.900   33.754   31.568   14.964   42.627   15.208 -11.05976 21.33504 
1 1 1   15    6    0 o   42.736   3.2962   39.008   7.9684   39.008   7.9684   39.008   7.9684   42.736   4.6615   42.736   4.6615 0.000000 0.000000 
1 1 1   15    6    1 o  169.115   2.0962  590.040   14.621  587.037   20.703  593.028   20.651  168.686   2.9756  169.545   2.9532 -0.8591461 4.192368 
1 1 1   15    6    2 o  305.734   2.8204  1924.11   35.059  1957.91   54.582  1900.37   45.743  307.996   4.2967  303.472   3.6546 4.524200 5.640733 
1 1 1   15    6    3 o  130.729   2.2248  352.180   11.885  355.658   18.123  349.556   15.743  131.291   3.3467  130.168   2.9324 1.123352 4.449649 
1 1 1   15    6    4 o  108.418   2.6046  237.992   10.919  255.564   19.445  229.900   13.196  111.275   4.2368  105.562   3.0308 5.712914 5.209233 
1 1 1   15    6    5 o  386.258   3.4994  3079.84   55.737  3106.10   79.784  3054.80   77.898  387.862   4.9874  384.653   4.9101 3.208893 6.998837 
1 1 1   15    6    6 o  377.235   3.4436  2937.25   53.562  2971.72   76.890  2904.76   74.654  379.380   4.9139  375.089   4.8256 4.290375 6.887203 
1 1 1   15    6    7 o  389.304   3.2858  3131.28   52.286  3146.40   69.537  3111.62   79.310  390.416   4.3184  388.192   4.9535 2.223389 6.571630 
1 1 1   15    6    8 o  142.281   2.2625  416.206   13.082  409.159   17.031  426.349   20.432  140.823   2.9323  143.738   3.4464 -2.914780 4.525062 
1 1 1   15    6    9 o  236.384   2.4980  1152.87   24.092  1151.07   31.811  1155.28   36.894  236.181   3.2656  236.587   3.7810 -0.4058380 4.995983 
1 1 1   15    6   10 o  183.568   2.3186  695.618   17.379  697.089   23.022  693.669   26.499  183.803   3.0368  183.334   3.5045 0.4687653 4.637225 
1 1 1   15    6   11 o  120.099   2.9686  304.500   14.231  329.380   18.432  267.777   22.394  126.330   3.5376  113.868   4.7682 12.46196 5.937219 
1 1 1   15    6   12 o  269.865   2.9266  1506.68   29.865  1496.12   54.388  1511.23   35.733  269.121   4.9000  270.608   3.2016 -1.487244 5.853205 
1 1 1   15    6   13 o   85.516   2.8196  155.902   9.6273  121.862   14.425  183.240   12.928   76.810   4.5535   94.223   3.3266 -17.41267 5.639163 
1 1 1   15    6   14 o  167.307   2.2899  577.172   15.361  580.233   24.860  575.281   19.536  167.649   3.5952  166.966   2.8370 0.6831665 4.579741 
1 1 1   15    6   15 o  234.630   2.5777  1138.57   24.848  1114.33   36.579  1159.34   33.858  232.294   3.8179  236.967   3.4643 -4.673477 5.155384 
1 1 1   15    6   16 o  265.373   3.3158  1458.40   35.253  1467.01   44.890  1444.56   56.945  266.473   4.0844  264.273   5.2244 2.199799 6.631514 
1 1 1   15    6   17 o  267.370   2.8166  1475.80   30.601  1482.46   47.585  1471.10   39.960  267.845   4.3075  266.895   3.6301 0.9502869 5.633115 
1 1 1   15    6   18 o  153.542   2.6360  479.292   16.262  519.823   26.599  455.098   20.551  158.623   4.0657  148.462   3.3562 10.16051 5.271941 
1 1 1   15    6   19 o  212.922   2.7035  937.067   23.353  933.932   36.442  939.252   30.420  212.585   4.1562  213.258   3.4585 -0.6736450 5.407009 
1 1 1   15    6   20 o  158.779   2.6172  512.711   16.823  562.035   26.951  481.224   21.533  164.916   3.9623  152.641   3.4204 12.27565 5.234378 
1 1 1   15    6   21 o  148.348   3.6184  446.064   21.764  505.706   34.834  407.876   27.874  156.284   5.4042  140.413   4.8131 15.87051 7.236735 
1 1 1   15    6   22 o   57.107   3.6754   67.575   8.6480   66.243   12.441   68.821   12.029   56.556   5.3335   57.658   5.0585 -1.102516 7.350830 
1 1 1   15    6   23 o   32.235   5.9662   22.466   8.0264   23.183   11.208   21.711   11.500   32.729   8.2927   31.740   8.5798 0.9892654 11.93237 
1 1 1   15    6   24 o   93.893   2.9837  182.524   11.540  177.359   16.589  187.366   16.063   92.596   4.3438   95.189   4.0915 -2.592789 5.967329 
1 1 1   15    6   25 o  194.688   3.6571  784.349   28.127  782.276   35.042  788.102   47.157  194.452   4.3693  194.924   5.8656 -0.4714813 7.314118 
1 1 1   15    6   26 o   84.264   3.0967  146.899   10.746  136.221   15.031  158.064   15.370   81.125   4.4923   87.403   4.2635 -6.278572 6.193437 
1 1 1   15    6   27 o  152.100   3.3694  460.822   18.912  439.628   22.010  520.593   36.964  145.815   3.6598  158.386   5.6584 -12.57051 6.738850 
1 1 1   15    6   28 f  140.156   3.2290  411.447   18.186  428.304   23.507  386.314   28.702  143.853   3.9619  136.458   5.0998 7.395691 6.457947 
1 1 1   15    6   29 o  183.253   2.7280  695.476   20.593  691.761   29.827  698.861   28.467  182.766   3.9569  183.740   3.7564 -0.9737396 5.455927 
1 1 1   15    6   30 o  149.818   3.0952  460.731   18.363  482.489   30.919  448.875   22.824  152.410   4.9187  147.225   3.7587 5.185440 6.190430 
1 1 1   15    6   31 o  112.542   3.4930  259.874   15.725  278.844   25.966  248.888   19.760  115.627   5.4448  109.457   4.3771 6.169334 6.986017 
1 1 1   15    6   32 o   38.946   7.0507   35.465   10.808   38.683   12.728   27.148   20.463   42.160   7.5994   35.731   11.878 6.429672 14.10143 
1 1 1   15    6   33 o   69.282   4.6325   91.572   12.113   78.929   14.125  126.719   23.551   61.338   5.5832   77.226   7.3939 -15.88859 9.265084 
1 1 1   15    6   34 o   66.166   4.8781   91.343   12.177   89.199   14.474   96.537   22.528   65.212   5.3813   67.119   8.1379 -1.907150 9.756266 
1 1 1   15    6   35 o  139.453   3.7906  409.371   21.780  404.066   30.039  415.251   31.624  138.558   5.2564  140.349   5.4632 -1.791061 7.581299 
1 1 1   15    6   36 o   60.491   6.6324   83.488   13.085   84.848   14.867   78.810   27.571   63.300   5.6943   57.683   11.980 5.616982 13.26473 
1 1 1   15    6   37 o  100.090   4.4131  212.383   18.170  193.955   24.767  233.861   26.739   95.384   6.2955  104.797   6.1862 -9.412933 8.826294 
1 1 1   15    6   38 o   22.635   6.9197   1.7539   9.5800   0.6944   10.665   6.1787   21.796   18.407   7.8813   26.862   11.376 -8.455561 13.83940 
1 1 1   15    6   39 o   74.510   6.7663  124.600   20.638  134.398   31.551  117.273   27.286   76.769   9.9646   72.252   9.1563 4.517578 13.53256 
1 1 1   15    6   40 o   56.731   6.3379   72.680   12.875   71.649   15.171   75.334   24.340   57.550   6.3916   55.912   10.946 1.638237 12.67586 
1 1 1   15    6   41 o   49.145   6.2854   45.573   11.252   33.547   12.869   84.604   23.185   37.838   8.4590   60.452   9.2991 -22.61439 12.57086 
1 1 1   15    6   42 o   20.446   6.5815  -2.2841   10.114  -1.3763   11.328  -5.8520   22.458   17.770   7.8550   23.122   10.562 -5.351988 13.16298 
1 1 1   15    6   43 o   18.950   6.4965 -14.4874   9.9251 -16.7087   10.757  -1.7669   25.741   12.950   6.3019   24.949   11.362 -11.99873 12.99306 
1 1 1   15    6   44 o   43.617   7.5747   55.664   12.815   61.307   14.384   33.949   28.216   52.303   6.6676   34.930   13.603 17.37326 15.14950 
1 1 1   15    6   45 o   56.509   8.3913   84.634   15.734   82.304   17.617   93.819   34.979   59.775   7.1459   53.243   15.185 6.531746 16.78263 
1 1 1   15    6   46 o   29.109   9.1791   16.807   22.331   18.889   32.442   14.932   30.785   29.646   13.189   28.572   12.770 1.073811 18.35813 
1 1 1   15    6   47 o   24.262   8.3567 -17.8644   26.665 -53.4136   50.028  -3.7572   31.515   23.967   11.997   24.557   11.637 -0.5894928 16.71335 
1 1 1   15    7    0 o  198.739   2.1839  815.300   25.302  815.300   25.302  815.300   25.302  198.739   3.0885  198.739   3.0885 0.000000 0.000000 
1 1 1   15    7    1 o  290.449   2.7384  1739.99   32.442  1747.48   49.762  1734.46   42.785  290.977   4.1464  289.921   3.5781 1.055725 5.476790 
1 1 1   15    7    2 o  243.352   2.5128  1220.76   24.927  1230.15   38.356  1213.88   32.798  244.151   3.8089  242.553   3.2785 1.597580 5.025593 
1 1 1   15    7    3 o  274.136   2.6625  1549.04   29.751  1562.65   45.804  1539.10   39.128  275.163   4.0360  273.109   3.4737 2.053467 5.324979 
1 1 1   15    7    4 o  199.680   2.8194  820.222   22.678  835.266   36.352  810.638   29.016  201.158   4.3815  198.202   3.5495 2.955154 5.638822 
1 1 1   15    7    5 o  294.229   3.3053  1790.40   39.402  1804.16   51.245  1770.49   61.626  295.647   4.2025  292.811   5.1028 2.835083 6.610607 
1 1 1   15    7    6 o  344.585   3.6321  2451.87   50.552  2450.85   65.194  2453.41   80.056  344.544   4.5877  344.625   5.6323 -0.8135986E-01 7.264261 
1 1 1   15    7    7 o  144.148   2.3896  427.581   14.183  408.623   19.383  449.428   20.808  140.720   3.3397  147.577   3.4186 -6.856720 4.779106 
1 1 1   15    7    8 o  208.831   2.5572  899.010   22.012  932.378   31.794  868.290   30.506  212.548   3.6268  205.114   3.6060 7.434006 5.114347 
1 1 1   15    7    9 o  210.139   2.3976  909.843   20.544  901.774   27.032  920.876   31.609  209.049   3.1352  211.230   3.6282 -2.180573 4.795151 
1 1 1   15    7   10 o  214.716   2.4303  950.665   21.286  946.093   28.068  956.854   32.657  214.120   3.1782  215.311   3.6775 -1.190582 4.860531 
1 1 1   15    7   11 o  165.340   2.4932  564.042   16.999  550.563   23.797  578.087   24.291  163.323   3.5327  167.356   3.5191 -4.033249 4.986392 
1 1 1   15    7   12 o  205.019   3.2375  867.366   27.360  891.466   39.543  845.234   37.894  207.746   4.6150  202.292   4.5418 5.453506 6.475028 
1 1 1   15    7   13 o  129.990   2.6910  347.768   12.999  351.423   24.491  346.335   15.338  130.431   4.5526  129.549   2.8705 0.8818817 5.382029 
1 1 1   15    7   14 o  223.728   2.5359  1034.62   23.288  1020.98   34.552  1045.97   31.524  222.363   3.7675  225.094   3.3955 -2.731796 5.071839 
1 1 1   15    7   15 o  214.243   2.4958  944.635   21.816  969.000   33.591  926.860   28.690  216.605   3.7600  211.881   3.2831 4.724533 4.991593 
1 1 1   15    7   16 o  229.880   2.6750  1091.28   24.988  1090.26   32.649  1092.71   38.827  229.782   3.4450  229.978   4.0934 -0.1967926 5.350088 
1 1 1   15    7   17 o   27.517   5.8175   15.851   7.1449   13.799   10.085   17.920   10.124   26.055   8.3167   28.979   8.1367 -2.923639 11.63498 
1 1 1   15    7   18 o  382.527   3.0863  3024.17   48.692  3021.63   68.751  3026.72   68.971  382.368   4.3595  382.687   4.3698 -0.3194580 6.172500 
1 1 1   15    7   19 o  187.048   2.6394  718.722   19.950  742.852   31.789  703.042   25.625  189.592   4.0653  184.503   3.3675 5.088348 5.278846 
1 1 1   15    7   20 o  117.902   2.8604  287.292   13.842  287.262   20.617  287.317   18.676  117.884   4.2405  117.920   3.8400 -0.3659058E-01 5.720799 
1 1 1   15    7   21 o  117.767   2.8318  288.167   13.683  263.040   19.759  311.319   18.967  112.792   4.2475  122.742   3.7465 -9.950562 5.663698 
1 1 1   15    7   22 o  188.452   3.0049  734.370   23.356  736.955   33.095  731.804   32.966  188.782   4.2504  188.121   4.2488 0.6607971 6.009870 
1 1 1   15    7   23 o  146.070   2.4994  440.463   15.050  460.355   21.635  421.815   20.948  149.264   3.5143  142.876   3.5549 6.387863 4.998757 
1 1 1   15    7   24 o  156.563   2.5917  504.840   16.675  526.422   24.851  487.165   22.489  159.585   3.7757  153.540   3.5512 6.045029 5.183337 
1 1 1   15    7   25 o  128.380   2.8769  339.899   15.035  334.956   19.670  346.845   23.318  127.289   3.7467  129.471   4.3667 -2.182137 5.753788 
1 1 1   15    7   26 o  118.381   2.7360  289.767   13.358  284.451   18.785  295.203   18.998  117.282   3.8835  119.480   3.8551 -2.198349 5.472087 
1 1 1   15    7   27 o  103.592   4.0252  229.504   15.152  237.615   17.831  208.432   28.741  107.159   4.0344  100.026   6.9666 7.132996 8.050473 
1 1 1   15    7   28 o  103.408   4.1189  221.988   17.536  204.115   24.328  241.319   25.300   99.063   5.9542  107.753   5.6929 -8.689804 8.237782 
1 1 1   15    7   29 o   35.380   6.1221   27.420   9.1872   38.355   13.041   16.645   12.945   42.126   7.7926   28.634   9.4445 13.49163 12.24429 
1 1 1   15    7   30 o   91.991   5.0246  164.945   15.256  198.597   35.500  157.323   16.896   96.941   8.8789   87.041   4.7065 9.900543 10.04917 
1 1 1   15    7   31 o   23.346   6.8950   3.5182   9.8900   3.1265   11.467   4.6562   19.543   20.471   8.4269   26.220   10.916 -5.749201 13.78996 
1 1 1   15    7   32 o   25.719   7.1146   9.9307   10.148   12.048   11.683   3.4272   20.475   25.223   8.9525   26.216   11.060 -0.9932098 14.22911 
1 1 1   15    7   33 o  113.157   3.9705  266.195   18.433  234.700   24.754  305.397   27.617  105.696   5.6783  120.618   5.5513 -14.92169 7.940998 
1 1 1   15    7   34 o  109.196   3.7507  260.209   15.671  281.268   19.384  220.475   26.625  116.215   4.0439  102.176   6.3180 14.03885 7.501378 
1 1 1   15    7   35 o   61.549   8.0819   96.900   13.471  100.747   14.544   73.681   35.736   69.185   5.0970   53.913   15.339 15.27213 16.16376 
1 1 1   15    7   36 o   62.599   6.9233  100.425   13.331  110.070   15.185   68.015   27.837   72.271   5.0945   52.927   12.875 19.34435 13.84665 
1 1 1   15    7   37 o   27.921   7.3428   14.921   10.076   16.170   11.302   10.079   22.249   27.276   8.8147   28.565   11.746 -1.288595 14.68566 
1 1 1   15    7   38 o   25.495   7.3142   5.2623   10.264   1.0786   11.611   20.210   21.948   19.261   8.2345   31.730   12.091 -12.46910 14.62839 
1 1 1   15    7   39 o   74.416   5.6009  122.088   17.146  111.025   23.919  133.780   24.590   70.780   8.1934   78.051   7.6385 -7.270935 11.20172 
1 1 1   15    7   40 o   58.949   5.6928   74.149   12.679   69.530   14.993   85.747   23.759   56.653   6.4164   61.246   9.4055 -4.592743 11.38564 
1 1 1   15    7   41 o   35.615   7.5667   31.517   11.159   32.490   12.746   28.324   23.088   37.150   8.5026   34.080   12.519 3.069695 15.13348 
1 1 1   15    7   42 o   77.973   5.6041  138.279   17.984  144.101   25.066  132.103   25.816   79.954   7.6013   75.992   8.2368 3.962181 11.20820 
1 1 1   15    7   43 o   31.228   6.4474   27.858   11.988   41.024   13.121 -38.6362   29.487   41.688   7.9206   20.767   10.176 20.92171 12.89487 
1 1 1   15    7   44 o   43.892   7.8612   48.588   12.435   47.112   13.891   54.542   27.896   45.352   7.4264   42.431   13.858 2.920544 15.72234 
1 1 1   15    7   45 o   35.653   9.1192   28.259   13.887   20.588   15.290   64.396   33.187   28.444   10.226   42.863   15.102 -14.41866 18.23840 
1 1 1   15    7   46 o   34.909   9.7656   33.786   24.142   72.231   33.998  -5.3179   34.288   44.210   15.303   25.608   12.136 18.60157 19.53115 
1 1 1   15    7   47 o   23.477   8.1963 -26.3611   26.447 -30.0396   48.432 -24.7981   31.570   25.191   12.475   21.763   10.635 3.427660 16.39264 
1 1 1   15    8    0 f   83.814   2.6427  145.780   12.861  145.780   12.861  145.780   12.861   83.814   3.7373   83.814   3.7373 0.000000 0.000000 
1 1 1   15    8    1 o  242.485   2.9989  1216.74   29.442  1230.09   38.266  1197.39   46.090  244.140   3.8002  240.829   4.6402 3.310928 5.997764 
1 1 1   15    8    2 o  244.442   2.5225  1232.69   25.170  1235.43   38.472  1230.64   33.280  244.668   3.8125  244.216   3.3040 0.4515381 5.044956 
1 1 1   15    8    3 o  104.030   2.5996  223.937   10.554  221.475   18.096  225.206   12.992  103.583   4.2356  104.476   3.0151 -0.8932877 5.199185 
1 1 1   15    8    4 o  277.473   2.8693  1587.19   32.803  1630.65   47.699  1548.18   45.184  281.069   4.1147  273.876   4.0001 7.192566 5.738559 
1 1 1   15    8    5 o  239.367   2.6862  1182.55   26.519  1185.20   37.563  1179.90   37.445  239.635   3.8006  239.099   3.7971 0.5363007 5.372375 
1 1 1   15    8    6 o  172.615   2.2920  613.283   16.105  605.399   21.073  624.354   24.972  171.293   2.9828  173.937   3.4809 -2.644226 4.584027 
1 1 1   15    8    7 o  315.186   2.8742  2051.59   36.993  2056.87   49.017  2044.60   56.385  315.680   3.7647  314.692   4.3442 0.9883423 5.748500 
1 1 1   15    8    8 o  214.781   3.1794  923.328   27.612  1102.83   44.785  813.246   35.071  231.093   4.6987  198.469   4.2844 32.62379 6.358768 
1 1 1   15    8    9 o  392.903   3.3492  3164.00   53.016  3298.82   85.390  3079.44   67.629  399.606   5.1809  386.201   4.2458 13.40488 6.698411 
1 1 1   15    8   10 o  292.623   3.1426  1770.53   35.742  1774.98   43.784  1761.62   61.878  293.244   3.6201  292.002   5.1379 1.241669 6.285182 
1 1 1   15    8   11 o  371.459   3.2182  2850.90   48.904  2842.65   73.973  2857.31   65.179  370.943   4.8350  371.974   4.2484 -1.030670 6.436353 
1 1 1   15    8   12 o   90.234   2.4532  165.293   8.9186  180.712   14.495  155.898   11.314   93.557   3.7563   86.911   3.1563 6.645782 4.906304 
1 1 1   15    8   13 o  205.709   2.3459  875.102   19.386  866.407   31.092  880.632   24.796  204.848   3.6800  206.570   2.9104 -1.721313 4.691743 
1 1 1   15    8   14 o  177.138   2.2788  645.476   16.181  657.443   26.285  638.174   20.533  178.433   3.5717  175.842   2.8312 2.591446 4.557679 
1 1 1   15    8   15 o  294.464   3.0235  1791.81   36.718  1800.82   51.725  1782.66   52.133  295.214   4.2482  293.714   4.3035 1.500000 6.047051 
1 1 1   15    8   16 o  217.131   2.6371  973.845   23.224  974.379   30.223  973.076   36.292  217.233   3.3732  217.028   4.0544 0.2051697 5.274158 
1 1 1   15    8   17 o   49.433   3.9269   50.660   7.9889   47.159   11.355   54.091   11.241   47.732   5.7680   51.134   5.3302 -3.401749 7.853728 
1 1 1   15    8   18 o   72.944   3.0662  110.205   9.2020  101.783   13.062  118.504   12.965   70.164   4.5138   75.724   4.1513 -5.559151 6.132485 
1 1 1   15    8   19 o  152.600   2.6619  477.657   16.357  496.846   26.368  465.652   20.855  155.044   4.1234  150.154   3.3675 4.890030 5.323758 
1 1 1   15    8   20 o  182.518   2.7031  688.544   20.285  686.157   29.865  690.588   27.640  182.210   3.9740  182.827   3.6654 -0.6169739 5.406282 
1 1 1   15    8   21 o  107.094   2.8320  238.257   12.382  228.142   18.672  246.199   16.544  105.034   4.3101  109.153   3.6748 -4.118828 5.663985 
1 1 1   15    8   22 o  382.852   3.1289  3031.81   49.407  3028.28   69.768  3035.36   69.976  382.629   4.4209  383.074   4.4289 -0.4449463 6.257777 
1 1 1   15    8   23 o  217.345   2.7957  984.426   24.790  914.738   37.117  1040.54   33.307  210.298   4.2793  224.391   3.5989 -14.09285 5.591441 
1 1 1   15    8   24 o  302.244   2.9689  1885.36   36.656  1918.30   56.057  1860.76   48.450  304.487   4.4637  300.000   3.9157 4.486328 5.937751 
1 1 1   15    8   25 o  118.664   2.9744  291.405   14.381  291.884   18.931  290.751   22.113  118.809   3.8633  118.519   4.5237 0.2904358 5.948830 
1 1 1   15    8   26 o   87.146   3.3514  157.690   11.925  160.270   15.857  154.331   18.092   87.996   4.3690   86.295   5.0832 1.701485 6.702743 
1 1 1   15    8   27 o  264.681   3.1379  1452.91   34.178  1481.56   47.065  1420.94   49.715  267.489   4.2660  261.873   4.6029 5.616638 6.275785 
1 1 1   15    8   28 o  122.535   3.3222  314.592   16.026  322.560   20.032  300.423   26.712  124.822   3.8910  120.248   5.3859 4.573898 6.644377 
1 1 1   15    8   29 o   35.543   5.9122   28.010   8.6766   19.445   12.480   36.025   12.072   30.227   9.1924   40.859   7.4373 -10.63147 11.82433 
1 1 1   15    8   30 f   68.481   4.0924  100.090   11.281   83.602   16.961  113.169   15.106   63.202   6.5065   73.760   4.9655 -10.55801 8.184785 
1 1 1   15    8   31 o  124.535   3.6973  324.763   18.857  334.306   25.435  313.116   28.099  126.671   4.8683  122.399   5.5660 4.271866 7.394686 
1 1 1   15    8   32 o   64.769   5.0060   85.199   12.517   79.146   15.011   99.010   22.676   61.392   5.9285   68.145   8.0680 -6.753536 10.01194 
1 1 1   15    8   33 o  136.420   3.5635  388.829   20.010  378.202   27.305  401.156   29.409  134.457   4.9237  138.383   5.1526 -3.926468 7.126912 
1 1 1   15    8   34 o   37.850   7.3599   26.918   10.604   20.530   12.131   47.609   21.831   30.449   9.0193   45.252   11.633 -14.80346 14.71977 
1 1 1   15    8   35 o   51.690   10.603   46.321   12.693   43.823   13.007   96.315   58.193   45.215   6.9745   58.165   20.027 -12.94945 21.20698 
1 1 1   15    8   36 o  110.122   3.7284  257.571   15.420  259.889   18.413  252.128   28.215  111.498   4.0039  108.746   6.2908 2.752144 7.456882 
1 1 1   15    8   37 o   49.029   6.8168   56.777   11.504   58.946   13.221   50.017   23.341   52.593   6.0949   45.465   12.195 7.128323 13.63356 
1 1 1   15    8   38 o   62.624   5.6097   81.214   13.085   75.077   15.270   98.176   25.384   59.151   6.2590   66.098   9.3113 -6.947117 11.21945 
1 1 1   15    8   39 o   59.083   6.3904   78.479   15.538   73.075   21.167   84.794   22.881   56.897   9.0200   61.269   9.0547 -4.372189 12.78078 
1 1 1   15    8   40 o   24.953   7.3104   7.3744   10.653   6.0331   12.127   11.907   22.294   21.567   8.7464   28.338   11.716 -6.771814 14.62087 
1 1 1   15    8   41 f   30.998   6.6946   25.437   10.830   34.361   12.333  -4.6176   22.634   38.419   8.0414   23.577   10.705 14.84174 13.38918 
1 1 1   15    8   42 o   27.721   7.6491   16.184   11.808   18.481   13.382   8.1036   25.095   28.070   9.6066   27.371   11.906 0.6988869 15.29812 
1 1 1   15    8   43 o   38.352   9.0877   39.973   13.268   40.787   13.718   28.190   52.185   41.291   8.3425   35.414   16.148 5.876926 18.17535 
1 1 1   15    8   44 o   49.847   7.0798   85.508   13.859  104.885   15.784   20.276   28.960   69.136   5.5353   30.557   13.033 38.57922 14.15950 
1 1 1   15    8   45 o   24.671   7.5186   10.084   12.286   13.376   13.322  -8.6375   31.771   24.533   9.4026   24.809   11.735 -0.2760258 15.03727 
1 1 1   15    8   46 f   22.965   7.8275 -17.0684   22.069 -17.3352   31.978 -16.8257   30.495   23.159   11.172   22.771   10.966 0.3877869 15.65496 
1 1 1   15    8   47 o   23.764   8.1769 -14.7221   24.519 -47.9812   49.475  -3.8937   28.230   24.011   12.005   23.517   11.105 0.4940147 16.35370 
1 1 1   15    9    0 o  480.062   4.1028  4759.23  114.846  4759.23  114.846  4759.23  114.846  480.062   5.8023  480.062   5.8023 0.000000 0.000000 
1 1 1   15    9    1 o  166.401   2.7252  575.720   18.362  595.410   24.028  548.081   28.468  169.861   3.4297  162.941   4.2360 6.919800 5.450414 
1 1 1   15    9    2 o  202.379   2.8372  841.332   23.080  827.596   29.387  863.443   37.285  200.254   3.5580  204.505   4.4204 -4.250153 5.674420 
1 1 1   15    9    3 o  320.659   3.4808  2117.30   44.870  2150.76   72.283  2096.32   57.232  322.664   5.4315  318.653   4.3547 4.011139 6.961670 
1 1 1   15    9    4 o  251.687   3.0709  1303.13   31.064  1328.57   50.120  1287.25   39.584  253.644   4.7909  249.730   3.8431 3.913651 6.141849 
1 1 1   15    9    5 o  233.649   2.6624  1126.33   25.649  1144.61   36.821  1109.10   35.749  235.488   3.7911  231.809   3.7391 3.679398 5.324727 
1 1 1   15    9    6 f  336.534   2.9906  2335.10   40.984  2318.97   53.759  2357.49   63.331  335.177   3.8888  337.891   4.5444 -2.713287 5.981128 
1 1 1   15    9    7 o  368.599   3.1691  2804.17   47.631  2796.94   62.768  2813.98   73.136  368.075   4.1346  369.123   4.8039 -1.048553 6.338159 
1 1 1   15    9    8 o  178.237   2.3216  656.621   16.889  662.795   22.388  648.466   25.729  179.221   3.0288  177.253   3.5194 1.967041 4.643213 
1 1 1   15    9    9 o  206.744   2.2116  882.080   18.858  880.646   26.684  883.511   26.655  206.576   3.1318  206.912   3.1234 -0.3361816 4.423103 
1 1 1   15    9   10 o  310.168   2.8769  1988.85   36.573  1964.80   54.696  2008.30   49.187  308.446   4.2995  311.889   3.8237 -3.442932 5.753768 
1 1 1   15    9   11 o  283.214   2.7539  1659.25   32.001  1624.34   47.480  1688.30   43.317  280.461   4.1047  285.968   3.6726 -5.507019 5.507856 
1 1 1   15    9   12 o  107.256   2.3820  241.015   10.285  219.479   16.001  256.177   13.426  103.099   3.7628  111.413   2.9217 -8.314163 4.763955 
1 1 1   15    9   13 o  132.606   2.2874  367.115   12.249  341.134   19.005  385.573   16.019  128.531   3.5851  136.680   2.8417 -8.149063 4.574741 
1 1 1   15    9   14 o  268.096   2.6945  1482.12   29.460  1501.02   45.311  1468.27   38.774  269.544   4.0757  266.648   3.5256 2.895691 5.389007 
1 1 1   15    9   15 o  233.571   2.7522  1126.83   26.502  1124.13   36.931  1129.70   38.054  233.288   3.8382  233.854   3.9454 -0.5662079 5.504382 
1 1 1   15    9   16 o  270.031   2.5638  1505.82   28.552  1500.23   40.161  1511.54   40.601  269.525   3.6128  270.536   3.6387 -1.010529 5.127571 
1 1 1   15    9   17 o  192.935   2.3376  768.646   18.601  767.123   26.236  770.185   26.378  192.743   3.3002  193.127   3.3115 -0.3834229 4.675221 
1 1 1   15    9   18 o  194.810   2.3653  783.570   19.002  800.427   27.126  767.328   26.627  196.867   3.3408  192.753   3.3493 4.114090 4.730560 
1 1 1   15    9   19 o  253.620   3.2142  1323.09   31.032  1348.54   56.200  1311.93   37.220  255.232   5.3387  252.008   3.5810 3.224411 6.428414 
1 1 1   15    9   20 o   98.703   3.1570  200.964   12.548  203.941   20.113  199.067   16.056   99.269   4.9124   98.136   3.9668 1.133141 6.314034 
1 1 1   15    9   21 o  287.104   2.8910  1701.13   33.826  1723.69   52.164  1684.76   44.433  288.690   4.3810  285.518   3.7732 3.171967 5.781924 
1 1 1   15    9   22 o  106.217   2.7432  233.600   11.997  220.309   17.097  246.491   16.838  103.227   4.0157  109.207   3.7384 -5.980133 5.486465 
1 1 1   15    9   23 o   95.876   2.8339  190.072   11.205  193.959   15.870  186.210   15.822   96.856   3.9727   94.897   4.0423 1.958733 5.667719 
1 1 1   15    9   24 o  213.953   2.6515  946.416   23.320  945.318   34.398  947.350   31.723  213.816   3.9006  214.089   3.5926 -0.2729797 5.302978 
1 1 1   15    9   25 o  134.882   3.1973  383.343   17.401  417.954   23.037  337.367   26.552  142.160   3.9290  127.603   5.0450 14.55628 6.394507 
1 1 1   15    9   26 o   39.360   10.336   18.607   11.579   17.165   11.886   45.471   51.286   28.735   9.0119   49.985   18.604 -21.24992 20.67141 
1 1 1   15    9   27 f   56.073   4.2118   65.497   9.6849   56.839   13.552   74.534   13.846   52.253   6.2884   59.894   5.6048 -7.640945 8.423660 
1 1 1   15    9   28 o   73.378   3.4975  111.764   10.583  114.564   15.094  109.056   14.843   74.284   4.9266   72.472   4.9656 1.811684 6.994928 
1 1 1   15    9   29 o   88.764   3.1522  163.567   11.530  155.738   16.313  171.381   16.299   86.627   4.5659   90.901   4.3473 -4.273338 6.304483 
1 1 1   15    9   30 o   92.306   3.4322  178.731   12.957  162.647   19.015  192.673   17.704   88.332   5.2194   96.280   4.4583 -7.947762 6.864308 
1 1 1   15    9   31 o  133.963   3.5055  373.702   19.334  364.510   26.437  384.271   28.348  132.229   4.8475  135.698   5.0651 -3.469528 7.010936 
1 1 1   15    9   32 o   92.227   4.0623  183.058   14.595  193.576   18.223  164.238   24.376   96.318   4.5871   88.136   6.7057 8.181770 8.124499 
1 1 1   15    9   33 o   24.620   6.9570  -0.0989   9.5638  -6.3976   10.834   22.145   20.359   16.130   7.3558   33.109   11.811 -16.97916 13.91406 
1 1 1   15    9   34 o  109.909   3.6284  258.972   15.296  268.449   18.706  239.845   26.575  113.420   3.9987  106.399   6.0558 7.020775 7.256838 
1 1 1   15    9   35 o   50.338   7.2166   73.303   12.655   86.739   14.450   29.071   26.219   64.068   5.4686   36.608   13.357 27.45994 14.43316 
1 1 1   15    9   36 o   73.049   5.5907  116.420   16.745  122.566   22.926  109.391   24.517   75.365   7.3756   70.733   8.4040 4.632103 11.18150 
1 1 1   15    9   37 o   20.228   6.4770  -3.3533   9.6640  -2.7368   10.883  -5.6526   21.016   17.240   7.6559   23.216   10.450 -5.975788 12.95405 
1 1 1   15    9   38 o   67.732   5.5363  102.317   13.995  104.899   16.761   96.374   25.434   70.093   5.7978   65.372   9.4332 4.721359 11.07250 
1 1 1   15    9   39 o   29.805   7.7538   13.345   14.686   34.836   20.190 -10.8039   21.402   37.639   11.736   21.971   10.137 15.66821 15.50752 
1 1 1   15    9   40 o  133.919   3.7974  375.432   20.696  329.319   26.744  444.269   32.675  124.048   5.2272  143.790   5.5097 -19.74218 7.594734 
1 1 1   15    9   41 o   42.435   6.8354   51.968   11.993   64.346   14.124   19.974   22.707   54.211   6.3170   30.659   12.124 23.55189 13.67088 
1 1 1   15    9   42 o   59.452   7.1741   93.010   14.080   99.603   16.317   73.782   27.865   67.429   5.8670   51.474   13.094 15.95493 14.34823 
1 1 1   15    9   43 o   88.947   8.5839  203.040   17.663  202.765   18.727  205.256   53.164   97.141   4.6742   80.753   16.519 16.38781 17.16778 
1 1 1   15    9   44 o   18.706   6.4950 -13.1135   11.310 -10.2263   12.070 -33.9010   32.385   15.360   7.2556   22.051   10.775 -6.690984 12.99002 
1 1 1   15    9   45 o   18.718   6.5272 -15.6376   11.661 -14.9007   12.605 -20.0117   30.709   14.622   7.0437   22.813   10.991 -8.191749 13.05436 
1 1 1   15    9   46 o   23.843   8.0303 -14.2355   21.148   15.223   33.358 -34.0332   27.346   28.245   12.891   19.441   9.5796 8.804113 16.06062 
1 1 1   15    9   47 o   31.623   9.9153   35.289   25.936   23.741   48.311   39.965   30.742   30.088   14.301   33.158   13.738 -3.070248 19.83067 
1 1 1   15   10    0 o   55.578   3.3827   65.148   10.779   65.148   10.779   65.148   10.779   55.578   4.7839   55.578   4.7839 0.000000 0.000000 
1 1 1   15   10    1 o   76.412   2.9549  118.880   9.1690  111.713   11.821  129.704   14.527   73.566   3.8960   79.258   4.4439 -5.691719 5.909877 
1 1 1   15   10    2 o  343.626   3.2349  2436.67   45.817  2398.02   63.453  2478.77   66.224  340.787   4.5145  346.465   4.6344 -5.678528 6.469767 
1 1 1   15   10    3 o  297.118   2.7756  1823.68   33.705  1832.92   44.814  1811.65   51.142  298.004   3.6460  296.232   4.1858 1.772949 5.551102 
1 1 1   15   10    4 o  161.408   2.4237  537.601   16.134  529.498   22.692  545.884   22.944  160.178   3.4348  162.638   3.4204 -2.460037 4.847414 
1 1 1   15   10    5 o  203.263   2.5418  852.635   21.308  843.070   29.928  862.468   30.344  202.107   3.5903  204.419   3.5990 -2.311554 5.083597 
1 1 1   15   10    6 o  147.416   2.6158  457.298   14.888  474.747   18.297  423.113   25.610  151.683   2.9247  143.148   4.3377 8.535721 5.231567 
1 1 1   15   10    7 o  100.073   2.9526  210.759   11.786  224.528   15.165  189.759   18.729  104.298   3.5253   95.849   4.7375 8.449028 5.905241 
1 1 1   15   10    8 o  110.846   2.3399  254.758   10.545  260.908   13.885  246.379   16.207  112.442   2.9941  109.250   3.5967 3.192078 4.679859 
1 1 1   15   10    9 o  159.910   2.3034  529.914   15.027  512.499   22.802  543.282   19.978  157.567   3.5087  162.252   2.9854 -4.685074 4.606896 
1 1 1   15   10   10 o  333.038   2.8579  2296.70   38.328  2261.06   60.972  2319.98   49.284  330.846   4.4683  335.230   3.5645 -4.384583 5.715864 
1 1 1   15   10   11 o  171.484   2.4748  606.050   17.487  631.781   25.424  582.950   24.090  174.931   3.5239  168.037   3.4759 6.893524 4.949685 
1 1 1   15   10   12 o  184.107   2.5150  697.430   19.058  739.242   28.073  661.683   25.956  189.205   3.5974  179.010   3.5156 10.19487 5.029998 
1 1 1   15   10   13 o  243.221   2.4714  1215.12   23.960  1246.48   39.544  1196.93   30.119  245.647   3.9030  240.794   3.0327 4.852600 4.942747 
1 1 1   15   10   14 o  231.759   2.5439  1112.30   24.206  1073.06   35.613  1145.99   33.000  227.931   3.7883  235.586   3.3962 -7.655014 5.087746 
1 1 1   15   10   15 o   48.202   3.9428   48.460   7.7431   45.303   11.680   50.934   10.342   46.776   6.0543   49.628   5.0526 -2.852306 7.885676 
1 1 1   15   10   16 o  132.480   2.3479  362.416   12.829  362.725   18.092  362.103   18.193  132.537   3.3097  132.423   3.3310 0.1147156 4.695764 
1 1 1   15   10   17 o  130.969   2.3922  354.131   12.919  365.080   18.453  343.605   18.094  132.955   3.3650  128.983   3.4011 3.971771 4.784461 
1 1 1   15   10   18 o  105.127   3.0235  234.547   12.649  256.708   16.383  201.842   19.903  111.477   3.5633   98.776   4.8855 12.70115 6.046909 
1 1 1   15   10   19 o  185.029   3.1686  702.093   22.750  725.590   39.875  690.753   27.700  187.217   5.1641  182.840   3.6732 4.376709 6.337164 
1 1 1   15   10   20 o  150.374   2.8142  471.844   17.283  423.549   25.404  513.456   23.581  143.113   4.3039  157.635   3.6270 -14.52255 5.628377 
1 1 1   15   10   21 o  130.934   2.7565  342.275   14.438  308.447   17.989  403.525   24.205  122.177   3.5698  139.691   4.2012 -17.51413 5.513080 
1 1 1   15   10   22 o   84.919   3.1202  148.002   10.854  158.982   16.542  139.701   14.383   87.653   4.5758   82.185   4.2433 5.467491 6.240489 
1 1 1   15   10   23 o   92.540   3.3624  173.322   12.327  163.833   15.242  191.270   20.962   89.002   4.1521   96.079   5.2898 -7.076973 6.724743 
1 1 1   15   10   24 o  205.049   3.3222  870.453   27.887  871.505   42.091  869.630   37.231  205.110   4.9755  204.989   4.4036 0.1207123 6.644337 
1 1 1   15   10   25 o  101.937   2.9550  214.162   12.397  233.974   18.156  196.857   16.968  106.340   4.1395   97.535   4.2181 8.804909 5.910004 
1 1 1   15   10   26 o  113.906   6.8263  286.096   18.177  289.094   19.102  257.378   59.129  118.195   3.9185  109.618   13.078 8.577354 13.65269 
1 1 1   15   10   27 o  143.503   2.6586  426.232   15.736  426.065   22.295  426.398   22.212  143.474   3.7676  143.533   3.7521 -0.5816650E-01 5.317258 
1 1 1   15   10   28 o  125.608   2.7875  326.812   14.440  329.291   20.570  324.403   20.277  126.075   3.9558  125.140   3.9285 0.9352798 5.575076 
1 1 1   15   10   29 o   35.580   6.2294   27.592   9.1367   33.094   13.383   22.789   12.504   38.844   8.5822   32.317   9.0314 6.527424 12.45877 
1 1 1   15   10   30 o   77.943   4.2139  125.593   12.451  123.176   14.856  131.295   22.821   76.924   4.6826   78.963   7.0072 -2.039635 8.427802 
1 1 1   15   10   31 o   46.607   7.6083   49.105   14.326   48.156   19.976   50.110   20.556   46.153   10.702   47.060   10.817 -0.9072838 15.21654 
1 1 1   15   10   32 o   27.012   7.0700   13.518   10.208   17.101   11.906   3.5696   19.837   28.280   9.0376   25.744   10.875 2.536747 14.13997 
1 1 1   15   10   33 o   74.723   4.4407  114.574   12.465  109.940   14.712  126.367   23.471   72.468   4.9222   76.977   7.3926 -4.508736 8.881318 
1 1 1   15   10   34 o   55.509   5.8675   66.178   11.443   64.360   13.269   71.456   22.608   55.115   5.8370   55.904   10.180 -0.7886963 11.73503 
1 1 1   15   10   35 o   87.851   4.3097  164.194   14.512  164.253   17.572  164.068   25.735   88.379   4.8206   87.324   7.1454 1.054916 8.619442 
1 1 1   15   10   36 o   36.379   8.9470   21.452   11.097   18.600   11.699   47.053   35.050   28.914   8.9203   43.845   15.512 -14.93083 17.89402 
1 1 1   15   10   37 o   53.101   5.7304   55.682   11.455   47.422   13.328   79.034   22.409   46.813   6.9029   59.388   9.1488 -12.57478 11.46083 
1 1 1   15   10   38 o   28.320   6.9582   17.987   10.610   24.530   12.177  -2.6396   21.621   32.527   8.8440   24.113   10.745 8.413311 13.91638 
1 1 1   15   10   39 o   48.198   6.8618   56.974   11.870   60.428   13.942   47.875   22.630   52.823   6.3992   43.574   12.140 9.248772 13.72351 
1 1 1   15   10   40 o   22.622   7.0218   1.6589   10.873   0.8750   12.426   4.2199   22.459   19.459   8.4208   25.785   11.239 -6.325636 14.04351 
1 1 1   15   10   41 o   35.618   7.1207   35.324   12.001   44.326   14.003   10.416   23.293   43.634   8.0783   27.603   11.728 16.03113 14.24132 
1 1 1   15   10   42 o   33.048   7.5176   30.089   11.933   34.877   13.422   12.023   26.072   37.843   8.7707   28.253   12.212 9.589497 15.03523 
1 1 1   15   10   43 o   19.934   6.5931  -4.4104   10.622  -2.2477   11.623 -15.3757   26.171   17.449   7.8189   22.418   10.618 -4.969332 13.18624 
1 1 1   15   10   44 o   41.284   8.0273   51.916   13.959   55.843   15.420   34.092   32.852   48.816   7.6586   33.752   14.110 15.06415 16.05467 
1 1 1   15   10   45 o   52.961   8.1831   88.716   15.429   96.323   17.423   61.078   33.211   64.969   6.5020   40.953   15.019 24.01567 16.36625 
1 1 1   15   10   46 o   25.854   8.4830   4.9802   21.923  -5.8392   32.591   13.922   29.628   24.487   11.669   27.222   12.315 -2.735029 16.96597 
1 1 1   15   11    0 o  158.964   2.4102  522.035   22.325  522.035   22.325  522.035   22.325  158.964   3.4086  158.964   3.4086 0.000000 0.000000 
1 1 1   15   11    1 o  215.858   2.5652  961.618   22.836  952.813   32.052  970.695   32.543  214.855   3.6169  216.861   3.6384 -2.005600 5.130318 
1 1 1   15   11    2 o  123.816   2.2563  315.865   11.381  313.208   14.937  319.542   17.571  123.203   2.9395  124.430   3.4239 -1.226593 4.512584 
1 1 1   15   11    3 o  286.305   2.9127  1692.03   34.388  1674.15   48.082  1710.76   49.202  284.759   4.0939  287.851   4.1442 -3.092194 5.825381 
1 1 1   15   11    4 o  250.860   3.0481  1304.22   31.081  1270.62   47.894  1328.68   40.852  248.028   4.6818  253.692   3.9042 -5.663452 6.096124 
1 1 1   15   11    5 o  273.063   2.8540  1539.35   32.140  1552.81   45.791  1526.27   45.123  274.239   4.0484  271.887   4.0239 2.351990 5.707991 
1 1 1   15   11    6 o  328.496   3.3278  2229.04   42.539  2228.84   52.142  2229.44   73.562  328.567   3.8477  328.426   5.4307 0.1412964 6.655569 
1 1 1   15   11    7 o  275.081   2.6816  1562.65   30.085  1564.84   39.707  1559.70   46.097  275.331   3.4966  274.832   4.0667 0.4992981 5.363244 
1 1 1   15   11    8 o  227.160   2.6597  1062.39   24.869  1020.26   33.900  1111.49   36.596  222.301   3.6973  232.018   3.8242 -9.717010 5.319325 
1 1 1   15   11    9 f  179.825   2.2588  669.012   16.357  660.211   26.036  674.752   21.024  178.827   3.5300  180.822   2.8191 -1.994629 4.517516 
1 1 1   15   11   10 o  225.625   2.3843  1057.26   21.763  1017.46   33.942  1085.05   28.359  221.971   3.7075  229.279   2.9989 -7.307144 4.768520 
1 1 1   15   11   11 o  138.102   2.4609  393.596   14.010  377.040   19.579  410.972   20.058  135.125   3.5130  141.078   3.4471 -5.952759 4.921764 
1 1 1   15   11   12 o  130.016   2.6073  349.735   13.911  355.600   18.842  342.707   20.625  131.227   3.4813  128.806   3.8823 2.421631 5.214580 
1 1 1   15   11   13 o  279.533   2.7345  1616.24   31.348  1592.41   46.708  1635.78   42.287  277.630   4.0790  281.436   3.6430 -3.806458 5.469016 
1 1 1   15   11   14 f  265.556   3.1752  1438.43   33.694  1383.90   42.300  1533.09   55.731  258.826   3.9625  272.287   4.9625 -13.46094 6.350405 
1 1 1   15   11   15 o   83.155   2.7224  141.753   9.2896  153.581   14.026  132.509   12.399   86.218   3.9442   80.092   3.7535 6.125809 5.444754 
1 1 1   15   11   16 o  222.286   2.4242  1020.57   22.224  1025.63   31.323  1015.45   31.537  222.842   3.4080  221.729   3.4485 1.112640 4.848347 
1 1 1   15   11   17 o   62.040   3.3898   80.036   8.5473   63.466   11.918   97.584   12.265   55.376   5.2183   68.704   4.3282 -13.32816 6.779623 
1 1 1   15   11   18 o   85.475   2.9842  149.132   10.380  162.429   16.313  140.085   13.456   88.624   4.4630   82.327   3.9627 6.296425 5.968414 
1 1 1   15   11   19 o  151.754   2.7032  477.121   16.854  461.049   24.708  491.107   23.048  149.341   4.0113  154.167   3.6248 -4.825455 5.406425 
1 1 1   15   11   20 o  205.889   2.6858  862.381   22.190  934.157   36.413  819.980   27.987  212.552   4.1537  199.226   3.4061 13.32599 5.371611 
1 1 1   15   11   21 o  124.990   2.5118  322.900   12.944  313.406   18.307  332.392   18.306  123.148   3.6042  126.831   3.4994 -3.682777 5.023566 
1 1 1   15   11   22 o  163.468   2.6485  552.239   17.709  553.217   26.837  551.485   23.568  163.572   3.9779  163.364   3.4979 0.2077026 5.297040 
1 1 1   15   11   23 o  247.117   2.5744  1262.16   26.236  1250.56   36.780  1274.18   37.434  245.964   3.6256  248.270   3.6558 -2.306992 5.148736 
1 1 1   15   11   24 o  199.774   3.1062  825.427   25.584  804.094   35.598  848.217   36.794  197.108   4.3788  202.439   4.4068 -5.331039 6.212348 
1 1 1   15   11   25 o  133.402   2.9843  366.898   16.323  355.376   21.784  381.649   24.649  131.046   4.0304  135.758   4.4022 -4.712173 5.968547 
1 1 1   15   11   26 o   35.747   7.4008   31.351   11.515   37.741   12.306 -13.6313   32.649   42.525   7.0162   28.968   13.033 13.55655 14.80158 
1 1 1   15   11   27 f  123.522   2.7627  316.216   14.055  336.801   19.935  295.871   19.819  127.538   3.7898  119.507   4.0208 8.030792 5.525360 
1 1 1   15   11   28 f  163.262   2.6106  551.921   17.578  545.201   24.696  558.820   25.024  162.255   3.6903  164.269   3.6935 -2.013535 5.221196 
1 1 1   15   11   29 o  158.649   2.9505  522.405   19.212  525.404   28.651  519.955   25.898  159.009   4.3687  158.288   3.9669 0.7212372 5.900952 
1 1 1   15   11   30 o   45.190   6.5449   46.563   10.671   48.977   12.497   40.068   20.500   48.293   6.2744   42.088   11.488 6.204395 13.08984 
1 1 1   15   11   31 o   57.868   6.0539   71.944   14.434   75.247   20.348   68.600   20.478   59.268   8.3242   56.468   8.7924 2.799706 12.10779 
1 1 1   15   11   32 o   56.305   6.1245   79.360   11.676   94.030   14.124   47.686   20.754   67.010   5.1103   45.600   11.132 21.41051 12.24897 
1 1 1   15   11   33 o   41.055   6.6067   44.917   11.378   58.309   13.648   14.391   20.605   52.418   6.3127   29.692   11.608 22.72580 13.21335 
1 1 1   15   11   34 f   77.321   4.8059  124.173   13.265  120.472   15.236  135.764   26.963   75.695   4.8802   78.946   8.2808 -3.250214 9.611879 
1 1 1   15   11   35 o   24.230   6.8821   8.2920   10.111   12.478   11.520  -5.7481   21.097   25.053   8.8901   23.406   10.508 1.647160 13.76422 
1 1 1   15   11   36 o   48.600   8.3861   48.351   11.874   45.798   12.615   68.173   35.155   46.176   6.6240   51.024   15.409 -4.847820 16.77221 
1 1 1   15   11   37 o   42.644   6.5171   54.170   12.776   75.316   15.039  -0.6877   24.222   59.280   6.1508   26.007   11.492 33.27267 13.03413 
1 1 1   15   11   38 o   32.795   7.4241   25.639   10.875   27.579   12.637   20.103   21.349   34.379   8.8575   31.212   11.917 3.166862 14.84820 
1 1 1   15   11   39 o   41.351   7.4606   37.908   11.256   34.152   12.827   50.492   23.478   38.357   8.3453   44.344   12.369 -5.987686 14.92130 
1 1 1   15   11   40 o   52.704   7.8475   69.721   16.512   74.737   22.945   64.332   23.781   55.264   10.449   50.144   11.711 5.119553 15.69495 
1 1 1   15   11   41 o   47.938   7.5506   69.106   13.622   79.455   15.508   34.149   28.502   60.094   6.2570   35.783   13.744 24.31074 15.10118 
1 1 1   15   11   42 o   41.544   7.3874   50.420   12.477   56.792   14.078   27.080   26.943   50.316   6.7836   32.771   13.125 17.54550 14.77480 
1 1 1   15   11   43 o   30.409   8.0464   22.271   12.164   21.568   13.741   24.818   26.156   29.338   9.7330   31.480   12.816 -2.141603 16.09276 
1 1 1   15   11   44 f   31.770   8.9354   21.311   13.296   16.774   14.382   48.011   34.889   26.413   9.8473   37.128   14.913 -10.71501 17.87071 
1 1 1   15   11   45 o   17.773   6.1050 -14.0822   11.978  -6.9427   13.077 -51.2994   29.857   16.685   7.7752   18.861   9.4145 -2.176060 12.21008 
1 1 1   15   11   46 o   20.408   7.1832 -47.0835   23.000 -16.8860   34.124 -72.2214   31.135   23.326   11.321   17.490   8.8443 5.835718 14.36647 
1 1 1   15   12    0 o  119.888   2.4060  297.255   16.794  297.255   16.794  297.255   16.794  119.888   3.4026  119.888   3.4026 0.000000 0.000000 
1 1 1   15   12    1 o  457.343   3.9518  4323.17   74.531  4290.41  104.321  4357.33  106.519  455.581   5.5519  459.106   5.6253 -3.524658 7.903664 
1 1 1   15   12    2 o  152.892   2.2371  481.679   13.952  477.383   18.379  487.524   21.434  152.097   2.9297  153.687   3.3815 -1.589981 4.474109 
1 1 1   15   12    3 o  236.215   2.6593  1151.85   25.907  1142.66   36.395  1161.29   36.885  235.260   3.7509  237.169   3.7707 -1.908630 5.318604 
1 1 1   15   12    4 o  105.833   2.4787  231.160   10.809  217.700   15.148  245.124   15.429  102.692   3.5764  108.973   3.4328 -6.280899 4.957309 
1 1 1   15   12    5 o  421.582   3.4786  3674.17   59.921  3685.00   79.557  3659.97   91.091  422.358   4.5670  420.806   5.2484 1.551575 6.957228 
1 1 1   15   12    6 f  257.922   2.5864  1372.33   27.186  1366.35   35.754  1380.53   41.856  257.278   3.3694  258.565   3.9248 -1.286774 5.172747 
1 1 1   15   12    7 o  184.401   2.3164  699.587   17.364  688.531   22.628  715.421   27.080  182.649   3.0038  186.153   3.5270 -3.503845 4.632792 
1 1 1   15   12    8 o   93.995   2.4105  181.404   9.2055  176.803   11.956  188.102   14.427   92.548   3.1322   95.442   3.6648 -2.894348 4.820961 
1 1 1   15   12    9 o  120.269   2.5155  298.690   11.511  298.707   20.771  298.683   13.829  120.240   4.1884  120.298   2.7873 -0.5783844E-01 5.031045 
1 1 1   15   12   10 o   72.835   2.8256  110.125   8.4461  101.962   12.260  117.498   11.652   70.246   4.2317   75.425   3.7456 -5.178055 5.651248 
1 1 1   15   12   11 o  171.998   2.6929  614.678   18.939  643.832   25.546  579.098   28.221  176.574   3.5078  167.422   4.0869 9.152054 5.385817 
1 1 1   15   12   12 o  113.212   2.4302  263.857   11.308  273.749   16.829  255.714   15.268  115.136   3.5439  111.288   3.3264 3.848259 4.860473 
1 1 1   15   12   13 o  368.787   3.4293  2811.40   52.142  2787.76   72.645  2836.53   74.885  367.199   4.7967  370.376   4.9021 -3.176910 6.858515 
1 1 1   15   12   14 o   92.798   2.7192  177.732   10.396  181.565   15.118  174.293   14.320   93.744   3.9100   91.853   3.7799 1.890915 5.438385 
1 1 1   15   12   15 o  241.874   2.8280  1203.61   28.059  1160.37   37.493  1258.65   42.303  236.979   3.8359  246.770   4.1564 -9.790634 5.655948 
1 1 1   15   12   16 o  213.169   2.5253  938.623   22.069  938.128   29.629  939.241   33.075  213.126   3.3707  213.213   3.7611 -0.8700562E-01 5.050510 
1 1 1   15   12   17 o   25.409   6.3482   11.502   8.0315   10.735   9.9991   12.897   13.483   23.937   8.2983   26.880   9.6092 -2.943714 12.69640 
1 1 1   15   12   18 o  152.810   2.8638  483.809   18.002  501.719   24.877  464.120   26.083  155.802   3.8714  149.818   4.2211 5.983459 5.727605 
1 1 1   15   12   19 o  193.512   2.4983  775.181   19.894  830.855   28.023  718.611   28.247  200.545   3.3879  186.479   3.6727 14.06641 4.996666 
1 1 1   15   12   20 o   94.500   3.1221  180.702   11.764  200.203   19.709  169.909   14.663   98.342   4.8592   90.657   3.9215 7.685417 6.244172 
1 1 1   15   12   21 o  214.964   2.4894  954.494   22.065  938.030   30.776  971.908   31.653  213.060   3.5022  216.868   3.5388 -3.808746 4.978789 
1 1 1   15   12   22 o  195.814   3.1704  787.473   25.458  848.551   38.585  740.387   33.879  202.465   4.6207  189.163   4.3424 13.30209 6.340880 
1 1 1   15   12   23 o  105.348   2.9213  231.261   12.581  214.205   18.648  245.509   17.044  101.731   4.4444  108.965   3.7924 -7.234299 5.842512 
1 1 1   15   12   24 o   73.172   3.3162  111.013   9.9539  126.389   14.269   96.440   13.892   78.130   4.4281   68.214   4.9377 9.915077 6.632442 
1 1 1   15   12   25 o  108.092   3.8928  249.332   15.995  261.057   19.457  224.897   28.089  112.279   4.2016  103.905   6.5545 8.373840 7.785534 
1 1 1   15   12   26 o   27.432   6.2921   14.703   8.4747   8.0974   11.894   21.515   12.078   23.331   8.8981   31.533   8.8987 -8.202721 12.58423 
1 1 1   15   12   27 o   76.228   3.8303  125.095   11.603  143.898   15.319   99.794   17.769   83.288   4.4594   69.168   6.2288 14.12054 7.660564 
1 1 1   15   12   28 f   99.275   3.2816  204.811   13.339  205.056   20.110  204.618   17.825   99.281   4.9111   99.268   4.3538 0.1342010E-01 6.563117 
1 1 1   15   12   29 o  103.015   4.3249  221.582   18.336  203.479   25.124  242.214   26.822   98.511   6.1835  107.518   6.0484 -9.006569 8.649793 
1 1 1   15   12   30 o   59.326   4.9035   69.421   11.055   62.432   13.018   87.496   20.935   54.550   5.7861   64.102   7.9182 -9.552193 9.807004 
1 1 1   15   12   31 o   42.542   7.8115   41.015   14.584   23.267   20.352   59.751   20.910   33.598   11.827   51.487   10.207 -17.88953 15.62304 
1 1 1   15   12   32 o   74.735   4.2474  112.571   12.325  103.231   14.831  133.420   22.159   70.174   5.1242   79.296   6.7752 -9.122398 8.494754 
1 1 1   15   12   33 o   27.582   7.1824   14.786   10.401   17.242   12.288   8.5787   19.532   28.214   9.1966   26.950   11.035 1.263029 14.36483 
1 1 1   15   12   34 o   22.194   6.8120  -9.3896   9.5959 -15.7875   10.682   17.349   21.839   13.378   6.4545   31.010   11.998 -17.63241 13.62393 
1 1 1   15   12   35 o   49.824   6.5326   60.370   11.357   65.844   13.355   46.070   21.585   55.703   5.8131   43.946   11.701 11.75744 13.06515 
1 1 1   15   12   36 o   39.784   7.5029   46.086   12.231   52.659   13.006  -4.1930   35.969   49.508   6.3692   30.059   13.587 19.44933 15.00572 
1 1 1   15   12   37 o   89.731   4.3383  170.033   14.332  166.565   16.783  179.371   27.541   88.857   4.5796   90.606   7.3697 -1.749229 8.676693 
1 1 1   15   12   38 o   25.731   7.0107   12.492   10.133   16.192   11.462  -0.7506   21.683   26.966   8.8867   24.495   10.845 2.471439 14.02131 
1 1 1   15   12   39 o   40.044   7.3366   32.113   10.774   24.618   12.222   58.249   22.822   32.201   8.9039   47.888   11.663 -15.68725 14.67327 
1 1 1   15   12   40 o   29.380   8.3490   16.969   15.539   20.090   21.522   13.571   22.457   30.399   11.869   28.362   11.745 2.036610 16.69805 
1 1 1   15   12   41 o   31.724   6.5355   28.220   12.009   41.822   13.511 -22.9721   26.211   42.045   8.0847   21.403   10.271 20.64236 13.07104 
1 1 1   15   12   42 o   36.169   8.2068   32.939   12.206   31.368   13.667   39.132   27.135   35.517   9.2410   36.821   13.565 -1.303303 16.41364 
1 1 1   15   12   43 o   41.475   9.5794   43.941   16.056   43.941   16.056   0.0000   0.0000   41.475   9.5794  ?   ?       ?      ? 
1 1 1   15   12   44 o   19.253   8.6394  -0.9124   14.243  -0.9124   14.243   0.0000   0.0000   19.253   8.6394  ?   ?       ?      ? 
1 1 1   15   12   45 o   24.580   7.7596   4.8217   12.918  -0.3653   14.461   25.297   28.732   19.250   8.6661   29.910   12.874 -10.65971 15.51914 
1 1 1   15   12   46 o   21.599   7.1743  -2.1767   12.824  -3.7347   14.252   4.4487   29.390   18.043   8.3055   25.156   11.700 -7.113119 14.34850 
1 1 1   15   13    0 o  487.767   4.1558  4915.78  118.197  4915.78  118.197  4915.78  118.197  487.767   5.8772  487.767   5.8772 0.000000 0.000000 
1 1 1   15   13    1 o  163.571   2.2434  550.720   14.948  542.817   19.588  561.739   23.130  162.180   2.9284  164.962   3.3995 -2.781357 4.486894 
1 1 1   15   13    2 o  169.311   2.2732  590.538   15.668  584.607   20.517  598.835   24.268  168.306   2.9556  170.318   3.4547 -2.011887 4.546473 
1 1 1   15   13    3 o  229.736   2.6331  1089.77   24.949  1088.45   35.293  1091.08   35.274  229.598   3.7270  229.875   3.7205 -0.2771149 5.266140 
1 1 1   15   13    4 o  221.945   2.6034  1016.67   23.825  997.628   33.233  1036.81   34.175  219.809   3.6657  224.081   3.6978 -4.272354 5.206792 
1 1 1   15   13    5 o  262.621   2.6066  1421.61   27.867  1408.33   36.500  1440.18   43.148  261.180   3.3883  264.062   3.9618 -2.882660 5.213109 
1 1 1   15   13    6 o  278.576   2.6858  1599.07   30.425  1581.01   39.722  1624.70   47.326  276.711   3.4805  280.441   4.0916 -3.730042 5.371641 
1 1 1   15   13    7 f  281.440   2.7007  1635.45   30.992  1632.14   40.844  1639.94   47.582  281.137   3.5224  281.742   4.0947 -0.6050110 5.401327 
1 1 1   15   13    8 o  278.526   2.7175  1602.18   30.985  1604.25   46.774  1600.56   41.362  278.659   4.0697  278.393   3.6023 0.2661743 5.434991 
1 1 1   15   13    9 o   91.488   2.3499  172.264   8.6475  175.303   13.915  170.352   11.038   92.131   3.6620   90.845   2.9458 1.286705 4.699775 
1 1 1   15   13   10 o  147.015   2.2051  443.941   12.999  455.691   21.138  436.796   16.484  148.554   3.4499  145.476   2.7473 3.077927 4.410136 
1 1 1   15   13   11 o  240.422   2.4324  1197.61   23.551  1174.63   37.421  1212.68   30.306  238.471   3.8047  242.373   3.0316 -3.901810 4.864800 
1 1 1   15   13   12 o   41.004   4.1918   34.659   7.0648   38.976   10.347   30.888   9.6698   43.390   5.7817   38.619   6.0709 4.770767 8.383542 
1 1 1   15   13   13 o   81.994   2.8251  139.035   9.5349  128.204   13.420  150.075   13.549   78.761   4.1313   85.227   3.8545 -6.465752 5.650249 
1 1 1   15   13   14 o  210.847   2.8079  912.061   23.199  939.865   39.837  897.793   28.538  213.195   4.5305  208.499   3.3185 4.695724 5.615844 
1 1 1   15   13   15 o  236.034   2.8165  1141.07   24.816  1175.53   46.618  1127.44   29.315  238.395   4.7412  233.674   3.0416 4.720840 5.633025 
1 1 1   15   13   16 o   72.365   3.1204  108.295   9.2946  108.279   12.746  108.313   13.583   72.366   4.2704   72.364   4.5511 0.1380920E-02 6.240883 
1 1 1   15   13   17 o  171.244   3.1702  608.569   22.312  559.158   31.900  655.898   31.220  164.390   4.7048  178.098   4.2502 -13.70811 6.340352 
1 1 1   15   13   18 o  131.669   2.7413  358.759   14.836  353.100   21.812  363.631   20.239  130.688   4.0466  132.650   3.6992 -1.962006 5.482665 
1 1 1   15   13   19 o  293.432   2.8598  1783.05   34.468  1812.68   46.892  1748.22   50.836  296.126   3.8393  290.738   4.2394 5.387939 5.719534 
1 1 1   15   13   20 o  170.733   2.6940  604.584   18.644  591.418   29.031  613.826   24.322  169.107   4.1623  172.360   3.4213 -3.253342 5.387978 
1 1 1   15   13   21 o   78.671   3.1172  128.103   10.111  132.368   14.305  123.846   14.292   79.985   4.3363   77.358   4.4794 2.626328 6.234465 
1 1 1   15   13   22 o  275.257   2.8350  1561.79   31.869  1530.42   42.025  1604.23   48.891  272.067   3.7451  278.446   4.2571 -6.378296 5.669998 
1 1 1   15   13   23 o  207.331   3.4051  891.631   29.054  908.584   40.022  872.740   42.247  209.452   4.6328  205.209   4.9915 4.243515 6.810153 
1 1 1   15   13   24 o   25.574   6.9189   10.143   9.6061   12.739   11.115   2.4838   19.094   25.642   8.7552   25.505   10.716 0.1363525 13.83781 
1 1 1   15   13   25 o  230.643   3.0338  1104.01   28.723  1121.22   38.947  1083.50   42.530  232.674   4.0584  228.612   4.5106 4.061874 6.067641 
1 1 1   15   13   26 o   81.350   3.2610  137.218   10.908  123.040   15.174  152.381   15.691   76.986   4.7787   85.714   4.4386 -8.727791 6.522065 
1 1 1   15   13   27 f   56.435   4.5363   64.269   10.354   50.367   13.379   85.030   16.350   49.065   6.6114   63.804   6.2130 -14.73922 9.072650 
1 1 1   15   13   28 o  129.603   2.9632  350.877   15.682  333.801   23.575  364.430   21.002  126.683   4.5119  132.523   3.8424 -5.839714 5.926311 
1 1 1   15   13   29 o   90.187   3.0954  169.253   11.512  171.624   16.477  166.992   16.090   90.800   4.3998   89.575   4.3552 1.224998 6.190802 
1 1 1   15   13   30 o   52.599   5.3570   55.774   10.889   50.437   13.022   68.182   19.856   48.871   6.4607   56.328   8.5468 -7.456711 10.71394 
1 1 1   15   13   31 o   23.917   6.6322  -2.8242   9.4169 -11.8379   10.922   23.296   18.592   14.632   6.9086   33.202   11.323 -18.56983 13.26448 
1 1 1   15   13   32 o  104.291   4.0815  228.850   17.513  213.390   23.795  247.124   25.870  100.479   5.7417  108.102   5.8023 -7.623047 8.162976 
1 1 1   15   13   33 o   81.858   4.5998  140.553   13.953  137.442   16.394  148.731   26.579   80.835   4.9171   82.881   7.7754 -2.045822 9.199682 
1 1 1   15   13   34 o   99.013   4.3963  208.857   17.953  206.667   25.395  211.045   25.382   98.476   6.2525   99.550   6.1819 -1.073906 8.792596 
1 1 1   15   13   35 o   56.818   5.9752   71.547   11.939   71.184   13.944   72.545   23.112   57.815   5.8476   55.821   10.422 1.993298 11.95047 
1 1 1   15   13   36 o   33.605   7.5968   23.629   10.940   19.557   12.853   34.338   20.843   29.452   9.3878   37.758   11.946 -8.305342 15.19356 
1 1 1   15   13   37 o   93.830   4.1438  194.299   14.421  202.388   17.255  175.555   26.264   98.020   4.2680   89.640   7.1040 8.380363 8.287502 
1 1 1   15   13   38 o   28.100   6.8191   17.857   10.885   26.755   12.615  -8.0786   21.537   33.691   8.9331   22.508   10.305 11.18258 13.63811 
1 1 1   15   13   39 o   24.710   7.2293   7.6989   10.429   5.9918   11.899   13.357   21.663   21.239   8.6450   28.180   11.589 -6.940714 14.45853 
1 1 1   15   13   40 o   26.773   8.0253   9.8362   15.377   8.1041   21.645   11.601   21.848   26.204   11.224   27.342   11.474 -1.137417 16.05067 
1 1 1   15   13   41 o   29.119   8.7088   16.127   12.373   17.097   12.810   2.6296   47.793   26.958   9.3897   31.281   14.670 -4.322712 17.41763 
1 1 1   15   13   42 o   32.263   7.1638   29.531   12.670   40.030   14.497  -4.4366   26.074   40.292   8.9556   24.234   11.184 16.05843 14.32751 
1 1 1   15   13   43 o   23.490   7.5052   3.3398   12.735   2.9500   14.162   4.9861   29.104   20.526   8.9361   26.453   12.061 -5.927143 15.01048 
1 1 1   15   13   44 o   16.380   7.7668 -11.1537   14.081 -11.1537   14.081   0.0000   0.0000   16.380   7.7668  ?   ?       ?      ? 
1 1 1   15   13   45 o   28.615   9.0547   19.600   22.460   6.9698   34.161   29.217   29.809   26.624   12.460   30.605   13.142 -3.980152 18.10939 
1 1 1   15   14    0 o  387.791   3.0277  3105.37   68.465  3105.37   68.465  3105.37   68.465  387.791   4.2818  387.791   4.2818 0.000000 0.000000 
1 1 1   15   14    1 o   63.635   2.7288   83.580   7.1123   83.128   9.5016   84.156   10.726   63.446   3.6310   63.825   4.0746 -0.3792648 5.457699 
1 1 1   15   14    2 o  318.312   2.8824  2090.45   37.367  2075.85   49.029  2110.69   57.717  317.031   3.7496  319.593   4.3787 -2.561646 5.764760 
1 1 1   15   14    3 o  169.760   2.4178  595.069   16.929  593.448   23.991  596.676   23.890  169.529   3.4312  169.991   3.4074 -0.4619598 4.835647 
1 1 1   15   14    4 f  143.203   2.3794  422.919   14.045  439.909   20.280  407.261   19.469  145.963   3.3687  140.443   3.3612 5.520279 4.758709 
1 1 1   15   14    5 o   78.963   2.4731  128.347   7.9879  125.689   10.586  131.861   12.173   78.023   3.2896   79.903   3.6937 -1.880379 4.946160 
1 1 1   15   14    6 o   33.815   4.3426   24.192   5.8669   24.852   7.8341   23.348   8.8533   34.658   5.4805   32.972   6.7377 1.685623 8.685221 
1 1 1   15   14    7 o  183.870   2.3634  698.834   17.852  688.855   26.348  707.302   24.272  182.644   3.4976  185.095   3.1794 -2.450821 4.726718 
1 1 1   15   14    8 o   86.545   2.5337  154.181   9.0284  163.508   13.249  146.095   12.336   88.980   3.6100   84.110   3.5561 4.869614 5.067362 
1 1 1   15   14    9 o   83.776   2.4934  147.673   8.3547  132.572   13.170  157.842   10.808   80.108   3.9860   87.444   2.9967 -7.335342 4.986834 
1 1 1   15   14   10 o  172.694   2.2246  614.409   15.452  621.616   24.833  609.856   19.740  173.497   3.4704  171.891   2.7843 1.606461 4.449258 
1 1 1   15   14   11 o   78.323   2.5262  124.695   7.9219  134.902   13.076  118.777   9.9572   80.802   3.9237   75.844   3.1831 4.958076 5.052475 
1 1 1   15   14   12 o   36.637   4.5435   28.362   6.6735   27.563   9.9154   29.024   9.0230   35.842   6.9582   37.431   5.8445 -1.589054 9.087097 
1 1 1   15   14   13 o   58.621   3.2847   72.269   7.8075   61.151   11.517   81.723   10.620   54.360   5.1369   62.882   4.0949 -8.521904 6.569376 
1 1 1   15   14   14 o   45.397   4.2808   42.738   7.9537   36.035   11.046   49.957   11.462   41.684   6.4248   49.111   5.6589 -7.427097 8.561615 
1 1 1   15   14   15 o  174.988   2.2947  632.887   16.067  630.628   26.081  634.269   20.397  174.703   3.6195  175.273   2.8216 -0.5699615 4.589362 
1 1 1   15   14   16 o  125.742   2.3834  326.456   12.354  342.739   17.670  310.889   17.277  128.811   3.3260  122.674   3.4147 6.136299 4.766866 
1 1 1   15   14   17 o   86.124   4.1364  174.207   12.248  114.909   22.844  198.130   14.510   74.327   7.4519   97.920   3.5927 -23.59335 8.272727 
1 1 1   15   14   18 o  384.265   3.5568  3057.43   56.370  3043.04   79.297  3072.12   80.147  383.356   5.0152  385.174   5.0450 -1.817932 7.113694 
1 1 1   15   14   19 o  238.792   2.9018  1179.99   28.517  1166.26   41.597  1192.17   39.169  237.456   4.2473  240.127   3.9549 -2.670547 5.803545 
1 1 1   15   14   20 o  112.504   3.7179  269.185   14.866  248.598   29.310  276.315   17.250  109.388   6.4966  115.620   3.6173 -6.231834 7.435762 
1 1 1   15   14   21 o  236.452   3.2994  1151.20   29.428  1173.49   54.153  1141.85   35.056  237.879   5.5195  235.025   3.6164 2.853760 6.598717 
1 1 1   15   14   22 o   77.139   3.2815  122.850   10.403  108.955   14.318  138.383   15.139   72.523   4.7869   81.754   4.4898 -9.231331 6.563002 
1 1 1   15   14   23 o  145.898   2.7167  439.833   16.182  444.627   24.770  436.264   21.373  146.557   4.0978  145.239   3.5679 1.318176 5.433393 
1 1 1   15   14   24 o   67.529   5.2117  106.870   12.358  122.451   14.828   71.430   22.364   76.843   4.6786   58.214   9.3144 18.62884 10.42343 
1 1 1   15   14   25 o   51.043   5.3494   50.517   10.790   40.781   13.160   70.497   18.851   44.137   7.2288   57.949   7.8873 -13.81209 10.69884 
1 1 1   15   14   26 o   68.298   3.5969   96.922   10.127   98.799   14.602   95.182   14.057   68.929   5.1362   67.667   5.0369 1.262527 7.193854 
1 1 1   15   14   27 o   61.536   4.3322   80.938   10.714   88.915   14.133   70.161   16.428   65.298   5.2478   57.773   6.8943 7.525414 8.664311 
1 1 1   15   14   28 o  100.511   3.3166  213.770   13.529  181.714   19.911  241.263   18.439   93.290   5.1748  107.732   4.1498 -14.44154 6.633193 
1 1 1   15   14   29 o   63.848   3.8775   86.313   10.061  102.537   14.186   69.892   14.272   70.049   4.9101   57.646   6.0026 12.40293 7.755009 
1 1 1   15   14   30 o   51.670   5.3892   51.647   10.658   43.748   12.555   72.020   20.163   45.457   6.6962   57.883   8.4459 -12.42526 10.77832 
1 1 1   15   14   31 o  111.632   3.4914  259.768   15.243  256.547   18.740  266.067   26.205  110.900   4.0969  112.363   5.6545 -1.462624 6.982730 
1 1 1   15   14   32 o   65.471   5.7063   93.103   15.393   93.969   21.357   92.167   22.205   65.872   7.8609   65.070   8.2737 0.8018646 11.41261 
1 1 1   15   14   33 f   57.802   6.2308   75.573   11.985   76.732   13.718   71.832   24.637   60.219   5.5231   55.384   11.171 4.835377 12.46169 
1 1 1   15   14   34 o   38.727   7.1786   32.749   10.617   30.095   12.393   40.071   20.584   36.426   8.4178   41.028   11.631 -4.601742 14.35729 
1 1 1   15   14   35 o   41.249   6.8483   44.192   10.974   50.689   12.772   25.863   21.453   48.565   6.3764   33.932   12.122 14.63321 13.69661 
1 1 1   15   14   36 o   42.762   7.0072   49.994   12.580   63.051   15.046   19.661   22.933   53.936   6.7635   31.587   12.274 22.34892 14.01441 
1 1 1   15   14   37 o   45.620   8.3733   56.453   12.818   59.158   13.645   36.151   37.384   52.301   6.3256   38.939   15.506 13.36226 16.74668 
1 1 1   15   14   38 o   30.681   8.4830   18.699   11.607   19.113   12.249   15.055   36.337   28.650   9.1680   32.712   14.276 -4.062473 16.96602 
1 1 1   15   14   39 o   59.887   6.4160   91.342   13.285  103.253   16.088   65.802   23.557   69.044   5.6494   50.729   11.522 18.31522 12.83202 
1 1 1   15   14   40 o   66.204   7.0401  109.709   18.056  125.464   24.216   89.983   27.097   73.771   7.9589   58.637   11.615 15.13411 14.08029 
1 1 1   15   14   41 o   18.857   6.3525  -9.0175   10.803  -6.4362   11.922 -20.8581   25.534   16.383   7.5613   21.331   10.210 -4.947517 12.70495 
1 1 1   15   14   42 o   26.043   8.1662   1.8866   18.949 -24.6074   28.619   22.567   25.285   21.728   10.503   30.359   12.507 -8.631178 16.33239 
1 1 1   15   14   43 o   35.519   8.8303   34.762   14.031   32.583   15.570   44.179   32.368   34.837   10.190   36.201   14.424 -1.363991 17.66061 
1 1 1   15   14   44 o   25.549   7.8149   12.404   13.261   12.568   14.846   11.757   29.500   24.085   9.7088   27.013   12.249 -2.928493 15.62990 
1 1 1   15   14   45 o   42.395   6.8317   63.750   15.206   85.486   17.693   2.3256   29.743   59.913   7.1600   24.878   11.637 35.03471 13.66332 
1 1 1   15   15    0 o   60.201   2.5566   75.596   8.9030   75.596   8.9030   75.596   8.9030   60.201   3.6155   60.201   3.6155 0.000000 0.000000 
1 1 1   15   15    1 o  141.921   2.0365  415.522   11.917  403.506   16.646  428.158   17.070  139.817   2.8865  144.025   2.8735 -4.208221 4.072989 
1 1 1   15   15    2 o  275.402   2.6503  1569.39   29.905  1592.80   40.216  1540.44   44.727  277.729   3.5109  273.075   3.9713 4.654053 5.300682 
1 1 1   15   15    3 o  137.746   2.3717  391.509   13.470  402.847   19.343  380.835   18.768  139.680   3.3576  135.811   3.3505 3.869354 4.743304 
1 1 1   15   15    4 o  256.350   2.7578  1357.13   29.154  1340.59   40.784  1374.41   41.689  254.755   3.8815  257.944   3.9186 -3.189148 5.515613 
1 1 1   15   15    5 o  292.432   2.7498  1764.32   32.757  1752.98   43.015  1779.99   50.542  291.351   3.5796  293.513   4.1750 -2.162140 5.499508 
1 1 1   15   15    6 o  109.124   2.4660  245.951   11.096  240.168   15.715  251.700   15.670  107.843   3.5332  110.405   3.4412 -2.562614 4.932049 
1 1 1   15   15    7 o  150.712   2.3151  470.206   14.333  453.374   21.012  484.853   19.601  148.173   3.4382  153.250   3.1011 -5.076767 4.630133 
1 1 1   15   15    8 o  152.641   2.3133  481.836   14.502  472.525   21.404  489.739   19.719  151.266   3.4307  154.016   3.1042 -2.750122 4.626661 
1 1 1   15   15    9 f   65.904   2.7928   93.333   7.2377   75.663   11.471  105.020   9.3288   60.491   4.5979   71.317   3.1715 -10.82547 5.585641 
1 1 1   15   15   10 f  192.728   2.2754  766.740   17.595  768.318   28.400  765.758   22.414  192.858   3.5703  192.597   2.8217 0.2609100 4.550762 
1 1 1   15   15   11 o  231.064   2.4021  1110.15   22.474  1061.67   34.892  1144.52   29.380  226.688   3.7319  235.441   3.0255 -8.752731 4.804260 
1 1 1   15   15   12 o  305.591   2.8641  1921.09   35.525  1979.78   55.784  1881.05   46.076  309.444   4.3708  301.738   3.7024 7.705322 5.728163 
1 1 1   15   15   13 o  144.501   2.6060  431.036   15.474  426.825   20.950  436.091   22.953  143.736   3.5339  145.265   3.8309 -1.528900 5.211978 
1 1 1   15   15   14 o  200.303   2.4738  826.554   20.295  848.369   30.736  809.690   27.023  202.620   3.6778  197.986   3.3093 4.634521 4.947528 
1 1 1   15   15   15 f  351.180   2.9978  2541.58   41.900  2583.09   69.252  2517.61   52.624  353.311   4.7524  349.048   3.6554 4.262909 5.995585 
1 1 1   15   15   16 o   75.111   2.9670  117.418   9.1202  101.722   13.000  132.630   12.798   70.121   4.4950   80.101   3.8738 -9.980354 5.933940 
1 1 1   15   15   17 o  133.054   2.5983  368.391   14.095  347.442   21.267  384.803   18.824  129.632   3.9777  136.476   3.3441 -6.843414 5.196636 
1 1 1   15   15   18 o  193.912   2.5170  777.894   20.056  787.182   27.309  767.019   29.551  195.189   3.3922  192.635   3.7194 2.553146 5.033992 
1 1 1   15   15   19 o  349.581   2.9613  2528.04   42.697  2530.25   60.305  2525.81   60.461  349.736   4.1807  349.426   4.1952 0.3101807 5.922659 
1 1 1   15   15   20 o  177.600   3.6546  657.603   26.607  595.927   38.491  714.043   36.821  169.518   5.5052  185.682   4.8079 -16.16350 7.309142 
1 1 1   15   15   21 o   93.078   3.5361  189.216   12.667  148.857   20.792  213.038   15.974   84.663   5.9543  101.492   3.8160 -16.82928 7.072153 
1 1 1   15   15   22 o  105.981   2.7475  232.590   12.001  224.958   17.099  239.998   16.846  104.257   3.9766  107.704   3.7923 -3.446266 5.494955 
1 1 1   15   15   23 o   36.120   5.8833   28.349   8.5594   29.617   12.690   27.292   11.594   36.843   8.5209   35.397   8.1146 1.446114 11.76654 
1 1 1   15   15   24 o  108.076   3.8730  246.928   16.508  257.648   20.790  228.641   27.156  111.449   4.5230  104.703   6.2883 6.745384 7.745937 
1 1 1   15   15   25 o  104.523   3.9455  228.206   16.948  215.994   24.599  239.240   23.383  101.802   5.8587  107.245   5.2864 -5.443108 7.891096 
1 1 1   15   15   26 o  174.566   3.0030  636.446   20.954  618.040   33.858  647.872   26.676  172.350   4.7630  176.781   3.6587 -4.431412 6.006002 
1 1 1   15   15   27 o  104.872   3.1275  228.118   13.380  233.406   20.594  224.255   17.601  105.857   4.7170  103.886   4.1078 1.971321 6.254902 
1 1 1   15   15   28 o   95.706   3.6361  196.160   13.524  206.673   16.817  176.920   22.750   99.666   4.0911   91.745   6.0122 7.921173 7.272150 
1 1 1   15   15   29 o   49.817   4.4375   52.609   9.0708   47.358   12.970   57.636   12.690   47.303   6.6481   52.331   5.8796 -5.027107 8.875067 
1 1 1   15   15   30 o  112.088   3.8258  262.774   17.649  245.848   24.044  282.547   25.988  108.199   5.3879  115.976   5.4329 -7.777229 7.651509 
1 1 1   15   15   31 o   66.750   5.7274   96.978   15.423   73.140   21.297  123.265   22.364   57.729   8.9444   75.771   7.1561 -18.04227 11.45481 
1 1 1   15   15   32 o   67.732   5.6782  100.108   15.794  106.316   21.873   93.345   22.830   70.132   7.5620   65.332   8.4726 4.799606 11.35642 
1 1 1   15   15   33 o   55.538   6.2537   74.157   11.944   81.167   14.164   56.906   22.221   61.931   5.5452   49.145   11.211 12.78660 12.50745 
1 1 1   15   15   34 o   97.154   3.9654  203.669   14.880  209.589   18.285  192.060   25.605   99.829   4.4408   94.479   6.5709 5.350716 7.930836 
1 1 1   15   15   35 o   37.395   7.8893   28.215   10.735   24.788   11.834   44.144   25.514   32.806   8.6299   41.983   13.209 -9.177570 15.77857 
1 1 1   15   15   36 o   78.725   5.7205  152.366   16.159  181.725   20.061   98.124   27.268   92.358   5.2665   65.093   10.157 27.26548 11.44105 
1 1 1   15   15   37 o   60.696   8.1694   74.336   13.494   68.841   14.343  116.694   39.819   56.348   6.1715   65.043   15.128 -8.695347 16.33876 
1 1 1   15   15   38 o   21.919   6.8296  -9.9659   10.528 -18.5299   11.998   18.690   21.948   13.751   6.6832   30.087   11.913 -16.33566 13.65920 
1 1 1   15   15   39 o   45.894   7.1819   54.790   12.399   58.855   14.662   44.585   23.232   51.362   6.9214   40.427   12.586 10.93476 14.36388 
1 1 1   15   15   40 o   22.057   7.2622 -20.4060   16.368 -42.3037   21.394   10.508   25.420   16.452   8.1719   27.663   12.007 -11.21115 14.52435 
1 1 1   15   15   41 o   26.932   7.8689   9.6328   11.689   4.7974   13.059   29.122   26.218   20.905   8.8267   32.960   13.029 -12.05493 15.73776 
1 1 1   15   15   42 o   60.186   7.3331   82.404   15.870   68.826   18.247  124.578   32.158   53.599   8.2538   66.773   12.123 -13.17398 14.66630 
1 1 1   15   15   43 o   22.638   7.4260  -1.8926   12.211  -4.9727   13.389   13.342   29.776   17.457   8.0412   27.819   12.487 -10.36167 14.85200 
1 1 1   15   15   44 o   46.816   8.4299   56.479   14.149   47.475   15.981   89.150   30.441   42.299   9.4036   51.334   13.994 -9.034374 16.85990 
1 1 1   15   16    0 o  111.839   2.0480  258.581   13.340  258.581   13.340  258.581   13.340  111.839   2.8964  111.839   2.8964 0.000000 0.000000 
1 1 1   15   16    1 o  237.512   2.2935  1164.30   22.461  1182.88   32.206  1146.71   31.342  239.354   3.2624  235.669   3.2244 3.684494 4.586967 
1 1 1   15   16    2 o  112.097   2.4112  259.488   11.147  258.770   15.864  260.188   15.665  111.943   3.4360  112.252   3.3836 -0.3085175 4.822358 
1 1 1   15   16    3 o  198.063   2.5032  809.529   20.438  828.483   29.504  792.043   28.338  200.287   3.5716  195.838   3.5084 4.449127 5.006472 
1 1 1   15   16    4 o  290.921   2.7421  1752.66   32.714  1790.91   44.250  1706.56   48.583  294.460   3.6435  287.382   4.0988 7.078094 5.484137 
1 1 1   15   16    5 o   97.074   2.2814  194.549   9.0422  194.368   11.966  194.790   13.806   97.030   2.9900   97.118   3.4467 -0.8770752E-01 4.562883 
1 1 1   15   16    6 o  194.644   2.3777  781.972   18.961  786.333   28.548  778.530   25.363  195.114   3.5475  194.175   3.1670 0.9389343 4.755488 
1 1 1   15   16    7 o   82.399   2.5686  138.783   8.6806  155.051   13.146  126.207   11.559   86.633   3.6792   78.164   3.5854 8.469002 5.137297 
1 1 1   15   16    8 o   70.199   2.7481  101.474   7.9319  106.111   11.782   97.630   10.727   71.657   3.9865   68.741   3.7835 2.916054 5.496152 
1 1 1   15   16    9 o   84.312   2.4121  146.437   8.1714  148.499   13.176  145.148   10.417   84.779   3.7681   83.845   3.0122 0.9337082 4.824099 
1 1 1   15   16   10 f   34.649   4.2905   24.527   5.8317   28.544   9.6649   22.227   7.3130   36.534   6.6594   32.765   5.4116 3.769096 8.580971 
1 1 1   15   16   11 o  146.999   2.4024  444.922   14.498  388.081   19.937  508.711   21.121  137.058   3.5269  156.941   3.2629 -19.88249 4.804737 
1 1 1   15   16   12 o  164.725   2.2433  557.760   14.775  571.139   24.189  549.797   18.662  166.264   3.5274  163.186   2.7727 3.077988 4.486659 
1 1 1   15   16   13 o  176.520   2.6404  643.427   19.145  638.444   25.884  649.446   28.447  175.782   3.5701  177.258   3.8910 -1.476044 5.280726 
1 1 1   15   16   14 o  133.116   2.4295  366.361   13.264  363.492   19.794  368.699   17.869  132.629   3.6184  133.602   3.2429 -0.9732971 4.858938 
1 1 1   15   16   15 o   54.482   3.4778   61.697   7.6853   60.040   11.923   62.876   10.052   53.833   5.3700   55.130   4.4209 -1.297928 6.955637 
1 1 1   15   16   16 o   91.692   2.8203  172.580   10.548  181.992   16.344  165.859   13.810   93.805   4.2243   89.579   3.7379 4.225945 5.640609 
1 1 1   15   16   17 o  134.793   2.4972  374.476   13.852  361.460   18.845  389.772   20.429  132.258   3.4547  137.328   3.6068 -5.069717 4.994398 
1 1 1   15   16   18 o   55.126   3.7235   63.192   8.4347   57.707   12.036   68.487   11.824   52.753   5.5316   57.499   4.9859 -4.746239 7.446985 
1 1 1   15   16   19 o   86.923   2.8464  156.681   10.178  147.663   14.628  165.146   14.172   84.481   4.1982   89.366   3.8450 -4.884956 5.692820 
1 1 1   15   16   20 o   20.580   5.2459   1.5831   7.3643 -16.6299   11.108   15.864   9.8365   13.796   6.6374   27.364   8.1253 -13.56862 10.49171 
1 1 1   15   16   21 o  195.113   2.7491  779.736   21.497  821.279   35.198  755.022   27.148  199.143   4.2854  191.083   3.4447 8.060242 5.498214 
1 1 1   15   16   22 o   95.170   2.8917  187.842   11.325  173.326   16.008  202.388   16.025   91.468   4.2432   98.872   3.9297 -7.403465 5.783327 
1 1 1   15   16   23 o   74.769   4.4072  124.103   12.204  136.401   14.821   98.202   21.509   81.100   4.4308   68.439   7.6198 12.66104 8.814401 
1 1 1   15   16   24 o   67.235   4.3009   92.130   11.766   81.598   15.195  107.902   18.595   62.569   5.8882   71.900   6.2706 -9.330341 8.601856 
1 1 1   15   16   25 o   83.527   3.1374  144.962   10.797  145.243   15.643  144.706   14.920   83.589   4.5375   83.464   4.3341 0.1256485 6.274781 
1 1 1   15   16   26 o   60.634   3.9211   77.645   9.6913   65.662   13.927   88.896   13.494   55.975   6.0324   65.292   5.0111 -9.316257 7.842259 
1 1 1   15   16   27 o  139.336   2.9251  403.599   16.679  406.669   25.253  401.223   22.212  139.731   4.3819  138.942   3.8761 0.7890015 5.850239 
1 1 1   15   16   28 o   60.647   4.2211   78.964   10.308   86.784   13.653   68.596   15.719   64.370   5.1425   56.925   6.6953 7.445076 8.442286 
1 1 1   15   16   29 o   55.104   4.0755   64.542   9.1567   55.196   13.217   73.168   12.698   51.128   6.2678   59.080   5.2110 -7.951473 8.151023 
1 1 1   15   16   30 o   36.736   5.5054   29.497   8.2838   39.763   12.178   20.658   11.301   43.129   6.8463   30.343   8.6234 12.78560 11.01070 
1 1 1   15   16   31 o   20.576   6.4042  -1.6884   9.5773  -2.6522   11.330   0.7236   17.923   17.727   7.8448   23.424   10.125 -5.697254 12.80849 
1 1 1   15   16   32 o   24.682   7.8703  -6.1370   16.598 -14.4835   27.779  -1.5027   20.699   25.061   11.558   24.303   10.686 0.7577705 15.74063 
1 1 1   15   16   33 o   51.647   8.5710   69.082   14.268   72.005   15.493   52.765   36.607   57.945   6.4827   45.349   15.869 12.59578 17.14202 
1 1 1   15   16   34 o   34.228   7.6644   27.613   11.474   29.252   13.270   22.759   22.840   35.531   9.0347   32.925   12.383 2.606140 15.32874 
1 1 1   15   16   35 o   81.068   4.9630  138.780   15.332  131.761   18.276  155.451   28.166   78.493   5.6454   83.644   8.1643 -5.150719 9.926084 
1 1 1   15   16   36 o   82.450   4.7069  157.108   14.421  174.139   17.678  123.226   24.934   90.628   4.7293   74.271   8.1397 16.35658 9.413857 
1 1 1   15   16   37 o   35.425   8.5279   31.341   14.914   27.005   20.223   36.511   22.081   33.281   11.782   37.569   12.332 -4.287277 17.05578 
1 1 1   15   16   38 o   26.700   6.1737   14.022   10.985   30.207   12.641 -35.9160   22.204   35.541   8.6948   17.859   8.7669 17.68224 12.34737 
1 1 1   15   16   39 o   42.856   6.5982   59.410   12.282   75.429   14.084   8.5523   25.095   58.623   5.8250   27.088   11.841 31.53539 13.19643 
1 1 1   15   16   40 o   40.454   7.3942   44.535   12.023   47.922   13.829   34.050   24.334   45.868   7.3100   35.039   12.855 10.82952 14.78840 
1 1 1   15   16   41 o   45.575   7.2594   62.219   13.032   72.312   15.287   35.382   24.928   56.524   6.5574   34.626   12.954 21.89756 14.51878 
1 1 1   15   16   42 o   18.223   6.2332 -14.1684   12.119 -10.8429   13.723 -25.9433   25.824   16.290   7.7078   20.156   9.7979 -3.865532 12.46632 
1 1 1   15   16   43 o   25.734   6.9301   13.989   13.224   28.770   14.825 -43.5619   29.252   32.271   10.056   19.197   9.5389 13.07375 13.86014 
1 1 1   15   16   44 o   22.560   6.8367   5.1927   13.102   18.035   15.008 -35.9418   26.861   26.278   10.002   18.842   9.3234 7.436291 13.67335 
1 1 1   15   17    0 o   55.293   3.2871   64.462   10.429   64.462   10.429   64.462   10.429   55.293   4.6487   55.293   4.6487 0.000000 0.000000 
1 1 1   15   17    1 o  287.876   2.5158  1711.86   29.871  1708.72   42.165  1715.01   42.322  287.612   3.5545  288.140   3.5612 -0.5283203 5.031585 
1 1 1   15   17    2 o  195.270   2.3295  783.882   18.476  807.632   28.944  767.552   24.001  197.733   3.5491  192.808   3.0181 4.924545 4.658913 
1 1 1   15   17    3 o  117.627   2.3776  285.664   11.532  290.114   16.524  281.438   16.102  118.519   3.3803  116.735   3.3444 1.783836 4.755164 
1 1 1   15   17    4 o  159.491   2.2349  524.403   14.516  519.887   19.036  530.678   22.440  158.688   2.9085  160.294   3.3942 -1.606201 4.469837 
1 1 1   15   17    5 o   90.653   2.5630  170.156   9.5421  151.477   13.448  189.098   13.542   85.623   3.8080   95.684   3.4315 -10.06084 5.125960 
1 1 1   15   17    6 o  104.145   2.6552  215.562   11.180  180.081   14.224  272.913   18.084   93.362   3.6940  114.927   3.8151 -21.56505 5.310408 
1 1 1   15   17    7 o  114.772   2.3726  272.661   11.188  264.563   16.425  279.670   15.280  113.170   3.5189  116.374   3.1836 -3.204025 4.745288 
1 1 1   15   17    8 o   62.304   2.8391   82.408   7.0268   71.049   11.115   89.971   9.0692   58.609   4.5980   66.000   3.3317 -7.391083 5.678167 
1 1 1   15   17    9 o  164.385   2.2229  556.031   14.638  566.613   23.821  549.609   18.555  165.610   3.4874  163.161   2.7573 2.449203 4.445786 
1 1 1   15   17   10 o  120.965   2.2609  300.589   11.019  309.726   17.700  294.808   14.080  122.439   3.5050  119.491   2.8570 2.948036 4.521850 
1 1 1   15   17   11 o  333.783   3.0059  2306.09   41.085  2284.63   61.766  2323.13   55.022  332.333   4.5062  335.234   3.9795 -2.901276 6.011856 
1 1 1   15   17   12 o   76.246   2.8630  120.270   8.9832  118.941   13.110  121.446   12.334   75.842   4.1912   76.650   3.9013 -0.8082199 5.725954 
1 1 1   15   17   13 o   44.005   3.9671   40.359   7.1238   38.437   10.743   41.868   9.5173   43.046   6.0508   44.963   5.1320 -1.916962 7.934112 
1 1 1   15   17   14 o  268.426   2.7116  1489.75   29.810  1486.96   44.871  1491.95   39.883  268.163   4.0570  268.689   3.5989 -0.5259399 5.423213 
1 1 1   15   17   15 o  191.717   2.4621  758.635   19.343  767.067   29.125  751.981   25.873  192.648   3.6655  190.786   3.2880 1.862213 4.924113 
1 1 1   15   17   16 o  127.601   2.6315  337.321   13.672  331.912   20.999  341.302   18.013  126.686   4.0189  128.517   3.3983 -1.831360 5.263053 
1 1 1   15   17   17 o   79.048   2.9770  129.334   9.6745  116.083   13.533  143.182   13.835   74.895   4.3812   83.201   4.0317 -8.306366 5.953915 
1 1 1   15   17   18 o  159.410   2.3692  524.356   15.565  549.719   22.521  501.162   21.536  163.095   3.3480  155.725   3.3531 7.370117 4.738390 
1 1 1   15   17   19 o  184.400   2.5526  703.570   19.344  698.091   28.533  708.231   26.315  183.713   3.7657  185.087   3.4472 -1.374084 5.105267 
1 1 1   15   17   20 o   72.191   3.2024  107.725   9.5205  112.728   13.943  103.354   13.031   73.753   4.5836   70.628   4.4735 3.124741 6.404789 
1 1 1   15   17   21 o   53.215   4.9308   57.348   9.8677   63.530   18.589   54.923   11.644   55.024   8.1910   51.405   5.4918 3.618927 9.861686 
1 1 1   15   17   22 o  152.633   2.4793  482.104   15.603  483.816   22.362  480.480   21.781  152.891   3.5463  152.376   3.4657 0.5155487 4.958560 
1 1 1   15   17   23 o   43.042   5.1081   40.157   8.6502   29.988   12.283   50.162   12.184   37.041   8.2514   49.043   6.0235 -12.00183 10.21610 
1 1 1   15   17   24 o   97.275   3.5066  195.329   13.915  186.269   18.201  208.075   21.588   94.637   4.6629   99.913   5.2386 -5.275742 7.013268 
1 1 1   15   17   25 o   62.308   3.7299   82.122   9.4545   69.968   13.784   92.921   12.993   57.820   5.7800   66.796   4.7161 -8.976387 7.459861 
1 1 1   15   17   26 o   80.757   3.5144  134.704   11.431  143.085   18.488  129.517   14.544   82.671   5.4220   78.843   4.4727 3.828735 7.028724 
1 1 1   15   17   27 o   17.885   5.3973  -1.0842   7.3336  -7.3957   10.597   4.7164   10.159   15.596   7.1728   20.173   8.0668 -4.576870 10.79458 
1 1 1   15   17   28 o   53.669   4.0742   60.599   9.0142   61.317   12.603   59.847   12.898   54.013   5.6573   53.324   5.8646 0.6890182 8.148472 
1 1 1   15   17   29 o   74.066   3.7953  115.855   11.485  117.529   15.302  113.695   17.380   74.796   4.9601   73.336   5.7459 1.460136 7.590662 
1 1 1   15   17   30 o  127.101   3.0298  336.930   15.675  330.616   20.489  345.840   24.340  125.813   3.9485  128.389   4.5966 -2.575684 6.059652 
1 1 1   15   17   31 o   32.734   7.3835   23.068   10.615   20.943   12.768   27.824   19.100   30.526   9.3013   34.942   11.469 -4.415966 14.76697 
1 1 1   15   17   32 o   72.251   5.8942  113.817   17.481   99.571   23.907  130.186   25.626   67.270   8.6165   77.231   8.0449 -9.961212 11.78838 
1 1 1   15   17   33 o   67.730   4.5687   91.030   11.959   78.288   14.230  121.671   22.066   60.605   5.6929   74.856   7.1472 -14.25106 9.137313 
1 1 1   15   17   34 o   35.346   8.1688   29.025   14.323   17.438   20.255   40.612   20.256   29.984   11.568   40.707   11.537 -10.72211 16.33765 
1 1 1   15   17   35 o   23.052   6.8531   5.5229   10.557   10.269   11.922 -11.7183   22.723   23.634   8.9337   22.471   10.395 1.163168 13.70619 
1 1 1   15   17   36 o   31.586   7.6710   22.148   10.884   20.497   12.525   27.241   21.999   29.539   9.2488   33.633   12.241 -4.093641 15.34197 
1 1 1   15   17   37 o   28.389   7.2540   9.3557   10.219   0.6368   11.689   37.613   21.044   18.795   8.1504   37.983   12.002 -19.18765 14.50793 
1 1 1   15   17   38 o   19.713   6.6642  -7.6206   11.199  -3.2199   11.915 -41.0009   32.815   17.433   7.8553   21.993   10.767 -4.560062 13.32833 
1 1 1   15   17   39 o   28.254   7.7048   18.205   12.357   20.865   14.463   11.015   23.783   29.187   9.9868   27.321   11.735 1.865332 15.40964 
1 1 1   15   17   40 o   70.710   5.9598  122.241   15.438  128.665   18.547  107.750   27.855   76.210   5.9005   65.210   10.357 10.99979 11.91957 
1 1 1   15   17   41 o   27.846   8.7244   10.795   19.442   24.984   31.074   1.6690   24.922   31.162   13.401   24.531   11.175 6.630985 17.44876 
1 1 1   15   17   42 o   52.847   7.9272   69.172   14.625   61.373   16.574   96.608   31.085   50.458   7.9640   55.236   13.709 -4.777847 15.85445 
1 1 1   15   17   43 o   24.404   7.3676   10.939   13.811   18.886   16.162 -10.5741   26.591   26.795   10.334   22.012   10.504 4.782833 14.73525 
1 1 1   15   18    0 o  355.214   2.8584  2605.98   59.207  2605.98   59.207  2605.98   59.207  355.214   4.0424  355.214   4.0424 0.000000 0.000000 
1 1 1   15   18    1 o  205.735   2.1783  874.020   18.483  872.562   26.124  875.482   26.155  205.563   3.0813  205.907   3.0798 -0.3437805 4.356509 
1 1 1   15   18    2 o  217.509   2.4094  977.003   21.352  978.607   32.869  975.831   28.084  217.636   3.6618  217.382   3.1324 0.2545776 4.818747 
1 1 1   15   18    3 o  220.663   2.4261  1002.81   21.765  1023.33   33.912  988.441   28.381  222.547   3.6946  218.778   3.1453 3.768997 4.852105 
1 1 1   15   18    4 o   85.207   2.8351  151.091   9.8305  157.032   13.037  143.263   14.966   87.180   3.6259   83.235   4.3595 3.944977 5.670295 
1 1 1   15   18    5 f  233.575   2.5175  1128.15   24.116  1117.83   35.981  1136.57   32.495  232.580   3.7509  234.570   3.3588 -1.989639 5.034904 
1 1 1   15   18    6 o   52.740   3.2670   57.494   7.0603   57.979   10.627   57.111   9.4464   52.930   4.8680   52.550   4.3584 0.3792763 6.533967 
1 1 1   15   18    7 o  152.485   2.3158  480.368   14.502  479.304   21.513  481.254   19.634  152.319   3.4244  152.652   3.1185 -0.3323975 4.631604 
1 1 1   15   18    8 o  249.613   2.4634  1290.26   24.746  1273.39   39.458  1301.20   31.770  248.214   3.8543  251.012   3.0687 -2.798508 4.926726 
1 1 1   15   18    9 o  177.034   2.2544  649.524   16.109  636.480   25.426  658.270   20.820  175.515   3.5123  178.553   2.8272 -3.038452 4.508787 
1 1 1   15   18   10 o   76.627   2.6951  123.126   8.3451  111.273   12.801  131.886   11.005   73.353   4.2311   79.901   3.3395 -6.547882 5.390199 
1 1 1   15   18   11 o   96.486   2.3525  189.599   9.1264  204.250   14.881  180.767   11.554   99.415   3.6293   93.557   2.9943 5.857857 4.705097 
1 1 1   15   18   12 o  179.212   2.4038  662.305   17.658  674.714   26.597  652.523   23.614  180.693   3.5688  177.730   3.2214 2.962082 4.807652 
1 1 1   15   18   13 o  263.746   2.6917  1440.55   29.202  1397.48   42.511  1479.03   40.182  259.980   3.9645  267.512   3.6418 -7.532257 5.383366 
1 1 1   15   18   14 o  115.287   2.5293  275.738   11.981  254.655   17.224  295.502   16.677  110.988   3.7626  119.587   3.3811 -8.598503 5.058582 
1 1 1   15   18   15 o  327.585   3.8851  2203.95   52.114  2059.25   68.890  2397.54   79.684  315.196   5.2992  339.973   5.6828 -24.77649 7.770151 
1 1 1   15   18   16 o  197.491   2.6371  794.975   20.955  757.298   26.562  857.078   34.102  191.430   3.3642  203.553   4.0619 -12.12328 5.274204 
1 1 1   15   18   17 o  242.511   2.6411  1218.70   26.348  1259.50   36.369  1173.63   38.224  246.820   3.5726  238.202   3.8907 8.618607 5.282169 
1 1 1   15   18   18 o   62.521   3.4342   82.065   8.7415   70.276   12.743   92.541   12.013   58.195   5.3093   66.848   4.3573 -8.653286 6.868368 
1 1 1   15   18   19 o   35.693   5.2016   28.335   7.4271   20.372   11.298   34.397   9.8564   30.715   8.5850   40.670   5.8759 -9.955433 10.40325 
1 1 1   15   18   20 o  181.779   2.4557  682.562   18.394  709.735   26.718  658.076   25.362  185.209   3.4976  178.349   3.4479 6.859421 4.911366 
1 1 1   15   18   21 f  113.041   3.1028  270.876   13.833  243.487   22.556  287.388   17.514  108.256   5.0519  117.826   3.6039 -9.570190 6.205612 
1 1 1   15   18   22 o   79.182   3.2246  130.067   10.517  120.875   14.667  139.794   15.087   76.293   4.6612   82.071   4.4571 -5.777817 6.449232 
1 1 1   15   18   23 o  113.229   3.1878  270.610   14.474  286.217   18.742  247.546   22.783  117.457   3.8687  109.001   5.0678 8.455444 6.375658 
1 1 1   15   18   24 o   71.680   3.3737  107.424   9.9357  100.958   14.401  113.297   13.725   69.576   5.0186   73.784   4.5102 -4.208527 6.747458 
1 1 1   15   18   25 o   80.826   3.2346  135.950   10.717  138.363   16.132  134.044   14.338   81.422   4.8038   80.230   4.3329 1.191803 6.469185 
1 1 1   15   18   26 o   38.859   5.6681   33.377   8.6919   33.406   13.400   33.356   11.420   38.708   8.6153   39.011   7.3678 -0.3034782 11.33613 
1 1 1   15   18   27 o   22.226   6.0417   7.4768   7.8283   5.5579   11.431   9.1715   10.742   21.463   8.5658   22.989   8.5226 -1.525877 12.08335 
1 1 1   15   18   28 o   70.577   3.5906  106.659   10.245   90.211   15.245  120.208   13.836   65.360   5.6551   75.793   4.4259 -10.43321 7.181136 
1 1 1   15   18   29 o  128.678   2.9577  348.826   15.489  363.727   20.583  329.368   23.520  132.036   3.7796  125.320   4.5504 6.716415 5.915336 
1 1 1   15   18   30 o   54.460   4.1961   63.880   9.2710   52.507   13.380   74.383   12.858   49.559   6.5458   59.361   5.2518 -9.802711 8.392168 
1 1 1   15   18   31 o   79.582   5.2232  135.893   17.080  122.045   23.120  152.529   25.340   75.113   7.4630   84.051   7.3097 -8.938240 10.44646 
1 1 1   15   18   32 o  103.269   3.7115  227.160   15.302  230.258   19.445  222.120   24.800  104.573   4.5084  101.965   5.8970 2.608376 7.422945 
1 1 1   15   18   33 o   30.848   8.0605   19.941   13.596   22.385   19.357   17.562   19.102   31.925   11.503   29.770   11.295 2.154259 16.12102 
1 1 1   15   18   34 o   28.701   7.4469   15.928   10.975   12.479   13.349   23.118   19.276   25.385   9.4828   32.016   11.485 -6.630911 14.89376 
1 1 1   15   18   35 o   30.158   7.6126   19.496   10.595   18.691   12.005   22.332   22.532   28.439   9.0739   31.877   12.226 -3.438242 15.22511 
1 1 1   15   18   36 f   79.250   4.7739  147.719   13.855  163.526   16.844  114.649   24.364   87.605   4.6618   70.895   8.3323 16.71011 9.547740 
1 1 1   15   18   37 o   53.965   6.2367   70.618   11.700   73.300   13.770   63.654   22.189   57.999   5.7564   49.931   11.066 8.067776 12.47340 
1 1 1   15   18   38 o   43.342   9.8433   22.417   11.595   15.344   11.980  127.368   46.150   25.825   9.0757   60.859   17.470 -35.03455 19.68657 
1 1 1   15   18   39 o   19.618   6.3146  -2.5758   10.609   2.8136   12.056 -21.0764   22.336   19.570   8.3792   19.666   9.4490 -0.9605789E-01 12.62912 
1 1 1   15   18   40 o   29.323   7.7082   21.703   11.513   22.019   13.124   20.646   23.984   29.320   9.5011   29.326   12.141 -0.5781174E-02 15.41645 
1 1 1   15   18   41 o   26.058   8.4564   2.2253   21.371 -16.3160   32.631   16.150   28.279   23.755   11.416   28.360   12.479 -4.605288 16.91289 
1 1 1   15   18   42 o   18.882   6.4999 -14.1289   12.334 -15.4343   13.830  -9.0559   27.264   15.188   7.3323   22.576   10.735 -7.387720 12.99979 
1 1 1   15   19    0 o  207.097   2.5531  886.149   30.819  886.149   30.819  886.149   30.819  207.097   3.6106  207.097   3.6106 0.000000 0.000000 
1 1 1   15   19    1 o  117.907   2.0354  287.030   9.8977  283.175   13.941  290.947   14.054  117.108   2.8864  118.705   2.8706 -1.597115 4.070802 
1 1 1   15   19    2 o  114.572   2.2557  272.252   10.491  264.484   16.226  277.831   13.751  113.145   3.4771  115.998   2.8743 -2.853210 4.511302 
1 1 1   15   19    3 o  216.604   2.4071  971.602   21.333  949.630   32.070  989.042   28.572  214.376   3.6270  218.832   3.1656 -4.455124 4.814217 
1 1 1   15   19    4 o  212.020   2.3987  927.534   20.723  935.779   31.944  921.542   27.231  212.805   3.6395  211.236   3.1256 1.569260 4.797409 
1 1 1   15   19    5 o  202.512   2.5388  847.277   21.203  838.085   29.726  856.797   30.252  201.395   3.5787  203.629   3.6020 -2.233276 5.077570 
1 1 1   15   19    6 o  125.201   2.3318  324.138   12.006  319.180   17.586  328.467   16.432  124.295   3.4304  126.108   3.1593 -1.812790 4.663537 
1 1 1   15   19    7 o  136.908   2.3213  385.949   13.043  399.276   19.573  375.303   17.493  139.017   3.4137  134.798   3.1464 4.219208 4.642540 
1 1 1   15   19    8 o  115.890   2.2573  281.842   10.531  254.612   16.338  301.199   13.775  111.001   3.5686  120.779   2.7653 -9.778061 4.514647 
1 1 1   15   19    9 o  199.657   2.3754  827.320   19.450  780.852   28.577  867.421   26.547  194.387   3.5644  204.926   3.1409 -10.53954 4.750779 
1 1 1   15   19   10 o  165.012   2.3342  562.637   15.779  561.605   23.722  563.456   21.132  164.859   3.4887  165.165   3.1021 -0.3059540 4.668399 
1 1 1   15   19   11 o  248.760   2.4741  1286.89   24.924  1233.70   38.700  1324.59   32.581  244.287   3.8410  253.232   3.1195 -8.944870 4.948143 
1 1 1   15   19   12 o  167.281   2.3849  575.700   16.339  598.790   24.814  558.024   21.711  170.214   3.5345  164.349   3.2029 5.864212 4.769816 
1 1 1   15   19   13 o  121.896   2.5644  305.984   12.858  276.710   17.640  339.173   18.783  115.693   3.6968  128.098   3.5550 -12.40584 5.128804 
1 1 1   15   19   14 o  213.612   2.6071  933.957   22.854  840.930   30.578  1051.70   34.400  201.683   3.6759  225.542   3.6980 -23.85936 5.214192 
1 1 1   15   19   15 o  215.980   3.0764  964.337   27.208  975.234   41.115  955.848   36.290  217.018   4.5935  214.941   4.0935 2.077209 6.152802 
1 1 1   15   19   16 o   40.443   5.6597   37.902   8.7944   45.654   11.112   24.907   14.387   46.885   5.7464   34.001   9.7524 12.88474 11.31942 
1 1 1   15   19   17 o  135.990   2.4460  382.333   13.717  375.028   19.213  389.927   19.590  134.665   3.4592  137.314   3.4591 -2.648926 4.891924 
1 1 1   15   19   18 o  109.061   2.6201  246.275   11.778  241.719   16.862  250.616   16.458  108.067   3.7832  110.054   3.6259 -1.987206 5.240208 
1 1 1   15   19   19 o  107.012   2.6427  237.300   11.653  229.730   16.652  244.568   16.315  105.327   3.8331  108.697   3.6391 -3.370583 5.285429 
1 1 1   15   19   20 o   59.107   3.6581   72.863   8.8771   69.615   13.015   75.689   12.139   57.845   5.4552   60.369   4.8753 -2.524288 7.316254 
1 1 1   15   19   21 o  151.884   2.8067  478.318   17.109  478.414   27.573  478.257   21.817  151.801   4.4039  151.967   3.4808 -0.1660614 5.613367 
1 1 1   15   19   22 o   57.480   4.5403   63.740   10.106   86.128   18.598   54.360   12.038   63.966   7.0494   50.994   5.7237 12.97148 9.080506 
1 1 1   15   19   23 o   40.895   8.1963   22.680   10.722   16.501   11.438   67.450   30.790   27.922   8.8515   53.867   13.797 -25.94484 16.39257 
1 1 1   15   19   24 o   33.638   5.9069   25.053   8.1153   25.647   12.242   24.588   10.839   33.950   8.7024   33.325   7.9895 0.6252251 11.81374 
1 1 1   15   19   25 o   86.989   3.6174  161.670   12.239  148.315   20.656  168.895   15.193   83.924   5.9674   90.053   4.0905 -6.128410 7.234755 
1 1 1   15   19   26 o   98.288   4.1071  202.840   16.626  188.787   22.980  218.279   24.086   94.697   5.8835  101.878   5.7322 -7.181122 8.214268 
1 1 1   15   19   27 o   43.287   5.1257   42.606   8.5381   28.239   12.452   55.354   11.730   35.358   8.6172   51.215   5.5529 -15.85756 10.25142 
1 1 1   15   19   28 o   28.707   6.7833   18.350   9.0807   8.4903   19.108   21.226   10.321   26.697   10.921   30.717   8.0492 -4.020147 13.56664 
1 1 1   15   19   29 o   21.154   5.8811   3.6484   7.9760  -3.9049   10.699   13.098   11.967   16.727   7.4982   25.581   9.0624 -8.853588 11.76223 
1 1 1   15   19   30 o   43.101   4.7728   39.531   8.4489   43.207   12.678   36.594   11.332   44.865   6.8514   41.337   6.6466 3.528553 9.545657 
1 1 1   15   19   31 o   50.014   4.3338   53.567   8.9358   53.913   12.844   53.242   12.440   50.146   6.2101   49.882   6.0466 0.2637749 8.667570 
1 1 1   15   19   32 o   72.938   4.4279  116.377   12.467  120.755   15.361  107.926   21.340   75.544   4.9300   70.332   7.3567 5.211960 8.855843 
1 1 1   15   19   33 o   34.343   8.3064   27.377   14.488   18.959   20.328   36.067   20.655   30.473   11.630   38.214   11.863 -7.740871 16.61284 
1 1 1   15   19   34 f   59.766   5.6202   74.755   12.761   67.332   15.051   93.733   24.067   55.566   6.5675   63.966   9.1222 -8.399837 11.24043 
1 1 1   15   19   35 o   39.271   7.1065   38.120   10.769   38.836   12.593   36.169   20.780   41.078   7.7159   37.465   11.936 3.612953 14.21295 
1 1 1   15   19   36 f   19.735   6.3667  -4.0437   9.8184  -5.0739   11.275  -0.8112   19.972   16.429   7.4967   23.042   10.293 -6.613031 12.73335 
1 1 1   15   19   37 o   45.554   6.7590   57.425   11.355   65.682   13.405   36.450   21.365   54.619   5.9503   36.488   12.138 18.13071 13.51796 
1 1 1   15   19   38 o   26.053   7.1952   14.552   10.667   17.551   12.000   3.2517   23.293   27.088   9.0976   25.018   11.150 2.069901 14.39035 
1 1 1   15   19   39 o   27.629   7.6143   17.443   11.318   17.355   12.869   17.742   23.785   26.696   9.4043   28.561   11.978 -1.864841 15.22853 
1 1 1   15   19   40 o   27.987   7.7417   15.418   11.637   9.5437   13.498   32.430   22.971   22.749   9.2269   33.226   12.434 -10.47698 15.48330 
1 1 1   15   19   41 o   33.263   9.0477   30.661   21.061  -8.0840   31.279   62.795   28.486   24.048   11.452   42.479   14.010 -18.43064 18.09532 
1 1 1   15   19   42 o   39.901   8.6276   41.281   13.599   31.446   15.448   75.143   28.664   33.259   10.248   46.544   13.882 -13.28450 17.25517 
1 1 1   15   20    0 o  252.912   2.3618  1320.96   34.827  1320.96   34.827  1320.96   34.827  252.912   3.3401  252.912   3.3401 0.000000 0.000000 
1 1 1   15   20    1 f  131.544   2.0437  357.301   11.087  350.981   15.621  363.717   15.739  130.371   2.9051  132.717   2.8753 -2.346161 4.087411 
1 1 1   15   20    2 o  141.768   2.2281  415.928   12.871  409.869   19.724  420.422   16.986  140.848   3.3953  142.687   2.8863 -1.838440 4.456287 
1 1 1   15   20    3 o  142.250   2.1838  419.554   12.551  409.723   19.732  426.234   16.265  140.822   3.3973  143.678   2.7447 -2.855927 4.367529 
1 1 1   15   20    4 o  200.463   2.2825  830.043   18.392  830.452   29.525  829.784   23.511  200.465   3.5710  200.461   2.8436 0.4608154E-02 4.564912 
1 1 1   15   20    5 o   50.361   3.0715   49.948   6.2106   64.366   10.327   41.779   7.7735   55.776   4.4891   44.945   4.1934 10.83037 6.143007 
1 1 1   15   20    6 o  114.676   2.3790  272.315   11.220  261.690   16.297  281.889   15.470  112.535   3.5113  116.816   3.2108 -4.281670 4.757959 
1 1 1   15   20    7 o  132.411   2.3532  362.581   12.829  355.538   18.601  368.969   17.716  131.175   3.4381  133.646   3.2140 -2.470993 4.706429 
1 1 1   15   20    8 o  283.833   2.7240  1669.19   31.701  1629.46   47.160  1701.94   42.818  280.703   4.0734  286.963   3.6177 -6.260254 5.448013 
1 1 1   15   20    9 o  153.890   2.3194  490.638   14.613  477.610   21.885  501.119   19.629  152.023   3.4904  155.758   3.0555 -3.735046 4.638879 
1 1 1   15   20   10 o  104.864   2.3587  229.465   9.9259  217.083   15.765  237.597   12.776  102.471   3.7300  107.257   2.8881 -4.786034 4.717456 
1 1 1   15   20   11 o   98.744   2.4543  205.565   9.7389  180.462   15.032  223.723   12.785   93.415   3.9016  104.072   2.9785 -10.65681 4.908528 
1 1 1   15   20   12 o  113.601   2.4460  266.951   11.420  263.990   16.823  269.482   15.553  113.005   3.6094  114.197   3.3022 -1.192017 4.892081 
1 1 1   15   20   13 o  205.617   2.5688  866.009   21.683  779.331   29.089  974.390   32.528  194.146   3.6328  217.088   3.6329 -22.94112 5.137617 
1 1 1   15   20   14 o  124.012   2.6587  322.776   12.487  306.172   22.403  330.258   15.039  121.587   4.4675  126.436   2.8839 -4.849121 5.317441 
1 1 1   15   20   15 o   35.198   5.7082   25.559   7.9333   33.720   13.132   20.869   9.9551   39.400   8.3412   30.997   7.7947 8.403038 11.41636 
1 1 1   15   20   16 o  110.021   3.0821  245.884   13.661  229.380   17.300  273.221   22.265  105.256   3.9851  114.786   4.7029 -9.529861 6.164290 
1 1 1   15   20   17 o   86.147   3.1919  156.460   11.084  168.559   14.580  139.895   17.060   90.217   3.9183   82.076   5.0397 8.141083 6.383722 
1 1 1   15   20   18 o  116.908   2.5645  283.388   12.345  267.873   17.600  298.413   17.320  113.737   3.7518  120.078   3.4971 -6.340950 5.128925 
1 1 1   15   20   19 o  161.245   2.4477  538.084   16.276  544.998   23.261  531.453   22.782  162.258   3.4759  160.234   3.4473 2.024185 4.895450 
1 1 1   15   20   20 o  154.889   3.5685  503.488   19.771  507.593   22.909  491.502   39.142  156.513   3.5488  153.265   6.1921 3.247604 7.136937 
1 1 1   15   20   21 o   60.981   3.9563   77.768   9.8126   77.446   15.169   78.000   12.868   60.803   6.0486   61.158   5.1013 -0.3547287 7.912557 
1 1 1   15   20   22 o   61.453   4.5205   81.567   10.261   74.401   18.939   84.545   12.209   59.209   7.7553   63.697   4.6472 -4.487858 9.041050 
1 1 1   15   20   23 o   58.497   5.2678   82.943   10.735  105.511   13.701   47.050   17.278   71.100   4.6721   45.894   9.4431 25.20605 10.53563 
1 1 1   15   20   24 o   28.289   6.0354   16.891   7.6104   21.509   11.744   13.547   9.9926   31.133   8.7709   25.445   8.2932 5.688623 12.07086 
1 1 1   15   20   25 f   22.642   6.1637   6.2259   9.4093 -69.3395   28.252   15.654   9.9790   18.397   9.1786   26.888   8.2289 -8.491076 12.32732 
1 1 1   15   20   26 o   89.936   3.8310  172.983   13.877  183.743   18.152  157.852   21.526   93.595   4.7023   86.276   6.0494 7.318741 7.662069 
1 1 1   15   20   27 o   91.170   3.6134  175.424   13.321  176.838   17.269  173.346   20.932   91.820   4.5599   90.520   5.6067 1.300018 7.226888 
1 1 1   15   20   28 o   24.850   5.9898   12.367   7.6376   6.8593   11.012   17.472   10.602   21.662   8.4811   28.038   8.4607 -6.376467 11.97964 
1 1 1   15   20   29 o   73.569   3.3877  114.053   10.260  107.780   14.656  120.081   14.368   71.528   4.9679   75.611   4.6072 -4.083221 6.775446 
1 1 1   15   20   30 o   66.280   4.1399   90.940   11.143   75.060   14.408  114.579   17.579   59.282   5.8926   73.277   5.8164 -13.99443 8.279740 
1 1 1   15   20   31 f   88.473   3.7410  161.271   13.068  149.976   16.056  183.434   22.492   84.327   4.6164   92.618   5.8879 -8.290909 7.481919 
1 1 1   15   20   32 o   20.808   6.0546   1.9127   9.4952   11.846   11.173 -23.9139   18.016   24.241   8.7386   17.374   8.3827 6.866785 12.10920 
1 1 1   15   20   33 o   74.889   6.2850  133.254   18.016  106.712   29.490  149.057   22.755   67.132   10.651   82.646   6.6757 -15.51374 12.56997 
1 1 1   15   20   34 o   25.032   7.1271   7.5896   10.015   3.6213   11.551   19.604   20.099   19.976   8.3604   30.087   11.545 -10.11092 14.25413 
1 1 1   15   20   35 o   97.148   4.2598  206.024   17.066  206.164   23.954  205.879   24.320   97.227   5.9736   97.070   6.0746 0.1574936 8.519654 
1 1 1   15   20   36 o   37.794   6.6325   40.062   11.166   50.294   13.392   16.722   20.225   47.328   6.8604   28.261   11.353 19.06716 13.26505 
1 1 1   15   20   37 o   28.406   7.4843   17.341   10.647   14.798   12.393   24.507   20.803   25.559   9.2046   31.253   11.804 -5.694267 14.96867 
1 1 1   15   20   38 o   26.028   6.8736   15.727   10.956   22.985   12.357 -10.9641   23.695   30.215   9.1377   21.842   10.271 8.373312 13.74728 
1 1 1   15   20   39 o   35.081   9.6572   26.276   12.517   22.981   12.988   69.256   46.904   29.853   9.4288   40.310   16.857 -10.45634 19.31439 
1 1 1   15   20   40 o   46.090   8.1659   53.086   13.961   42.918   16.111   83.747   27.977   40.074   9.8235   52.106   13.047 -12.03195 16.33186 
1 1 1   15   20   41 o   23.523   7.3025   8.1396   13.632   13.836   15.889  -7.7492   26.536   24.615   10.001   22.430   10.643 2.184587 14.60501 
1 1 1   15   21    0 f  198.736   2.1707  815.725   25.149  815.725   25.149  815.725   25.149  198.736   3.0698  198.736   3.0698 0.000000 0.000000 
1 1 1   15   21    1 o   76.046   2.2725  119.553   7.1185  112.274   10.050  126.882   10.085   73.718   3.3053   78.375   3.1197 -4.656929 4.545081 
1 1 1   15   21    2 o   90.197   2.3868  167.031   8.7097  173.460   13.843  162.819   11.205   91.609   3.6638   88.785   3.0600 2.824043 4.773592 
1 1 1   15   21    3 o   50.328   4.0956   54.910   8.0943   63.418   10.536   42.654   12.645   55.354   4.6147   45.302   6.7677 10.05194 8.191274 
1 1 1   15   21    4 o  110.760   2.2375  253.039   9.9686  255.178   16.005  251.683   12.742  111.121   3.4922  110.399   2.7984 0.7219086 4.475070 
1 1 1   15   21    5 o  200.973   2.2967  834.127   18.514  836.048   29.907  832.933   23.575  201.117   3.6054  200.829   2.8461 0.2883301 4.593393 
1 1 1   15   21    6 o  158.770   2.2014  523.647   14.111  506.094   22.170  535.603   18.296  156.490   3.4348  161.049   2.7545 -4.558380 4.402890 
1 1 1   15   21    7 o  155.295   2.3839  498.608   15.253  470.845   21.514  526.666   21.628  150.938   3.4558  159.651   3.2845 -8.713516 4.767705 
1 1 1   15   21    8 o   90.270   2.4441  171.869   8.7963  153.580   13.957  183.921   11.330   86.175   3.9268   94.364   2.9110 -8.189186 4.888114 
1 1 1   15   21    9 o   91.197   2.4551  171.656   9.1070  173.350   14.132  170.452   11.909   91.564   3.7422   90.829   3.1791 0.7354736 4.910242 
1 1 1   15   21   10 o  211.766   2.3645  922.437   20.039  944.682   32.728  909.096   25.345  213.745   3.7124  209.786   2.9292 3.959152 4.728929 
1 1 1   15   21   11 o  141.342   2.2571  413.715   12.822  408.941   20.527  416.769   16.419  140.638   3.5388  142.046   2.8026 -1.407974 4.514195 
1 1 1   15   21   12 o  237.875   2.7329  1170.13   26.803  1147.28   37.321  1194.47   38.519  235.483   3.8426  240.267   3.8870 -4.784485 5.465756 
1 1 1   15   21   13 f  132.662   2.3226  368.477   12.375  342.107   19.497  386.269   16.015  128.594   3.6760  136.730   2.8398 -8.135757 4.645147 
1 1 1   15   21   14 o  114.685   2.7299  279.636   11.752  254.066   21.156  291.045   14.132  110.696   4.6338  118.674   2.8873 -7.978310 5.459730 
1 1 1   15   21   15 o   85.226   2.8410  151.679   9.8985  138.162   14.571  163.262   13.489   81.642   4.3273   88.811   3.6824 -7.169441 5.682086 
1 1 1   15   21   16 o  106.975   3.0604  241.103   13.001  252.740   16.539  222.286   21.031  110.494   3.6292  103.456   4.9288 7.037651 6.120790 
1 1 1   15   21   17 o  131.728   2.9364  358.991   15.917  349.397   21.674  370.225   23.452  129.839   4.0473  133.618   4.2555 -3.778763 5.872778 
1 1 1   15   21   18 o  110.190   3.0589  256.966   13.445  274.161   17.318  230.873   21.333  115.027   3.6504  105.353   4.9095 9.673698 6.117885 
1 1 1   15   21   19 o  101.953   3.1324  217.864   12.875  225.046   16.702  207.345   20.212  104.136   3.8886   99.771   4.9119 4.365364 6.264830 
1 1 1   15   21   20 o  192.251   3.4577  769.473   27.399  738.252   37.955  803.444   39.592  188.185   4.8901  196.318   4.8897 -8.133438 6.915362 
1 1 1   15   21   21 o  149.588   4.9992  467.392   30.843  467.392   30.843   0.0000   0.0000  149.588   4.9992  ?   ?       ?      ? 
1 1 1   15   21   22 o   37.405   7.0208   32.690   11.401   20.572   17.694   41.291   14.907   31.688   11.036   43.122   8.6821 -11.43386 14.04168 
1 1 1   15   21   23 o   68.200   3.3673   97.982   9.3932   87.730   13.674  107.143   12.926   64.724   5.1223   71.676   4.3723 -6.952248 6.734662 
1 1 1   15   21   24 o   77.640   3.1625  127.165   10.025  112.359   14.636  140.247   13.758   73.255   4.8442   82.025   4.0668 -8.770340 6.324964 
1 1 1   15   21   25 o   25.230   5.9565   13.120   7.6241   6.6121   11.500   18.224   10.184   21.875   8.6352   28.584   8.2068 -6.708902 11.91292 
1 1 1   15   21   26 o   70.959   5.6642  113.804   15.337   95.718   25.949  123.515   19.014   65.675   9.5799   76.244   6.0464 -10.56916 11.32846 
1 1 1   15   21   27 o   49.613   4.4099   53.912   8.7513   43.056   13.100   62.661   11.760   44.738   7.0996   54.488   5.2331 -9.750179 8.819804 
1 1 1   15   21   28 o   32.252   5.8295   23.739   7.8001   21.141   11.557   25.913   10.571   30.561   8.7326   33.942   7.7249 -3.380587 11.65904 
1 1 1   15   21   29 o   77.377   3.2460  126.309   10.308  124.508   15.290  127.810   13.957   76.784   4.8281   77.971   4.3400 -1.187325 6.492009 
1 1 1   15   21   30 o   35.907   6.1924   29.166   9.0110   25.317   11.773   34.611   14.002   33.151   8.5533   38.662   8.9567 -5.510387 12.38472 
1 1 1   15   21   31 o   29.430   6.8318   20.425   9.7335   24.535   11.518   10.158   18.205   32.527   8.4936   26.333   10.703 6.193861 13.66358 
1 1 1   15   21   32 o   54.413   4.1565   63.990   9.2690   61.813   13.751   65.804   12.548   53.413   6.2418   55.414   5.4904 -2.000141 8.312935 
1 1 1   15   21   33 o   31.635   8.5575   22.198   14.953   23.222   26.308   21.710   18.174   32.614   13.001   30.656   11.131 1.957474 17.11501 
1 1 1   15   21   34 o   37.241   6.7129   28.367   10.103   17.492   12.060   53.962   18.501   27.455   9.1186   47.027   9.8540 -19.57230 13.42572 
1 1 1   15   21   35 f   51.455   6.2076   67.648   11.316   75.413   13.696   50.946   20.087   58.745   5.6529   44.166   11.054 14.57830 12.41512 
1 1 1   15   21   36 o   31.664   7.4205   21.798   10.625   15.185   12.620   37.897   19.692   25.835   9.2901   37.494   11.574 -11.65843 14.84108 
1 1 1   15   21   37 o   45.310   7.1298   48.044   11.708   42.340   13.554   64.809   23.236   41.967   8.1240   48.652   11.719 -6.684258 14.25963 
1 1 1   15   21   38 o   23.786   7.2081   6.1328   10.645   2.7585   12.048   18.148   22.734   19.297   8.3211   28.275   11.772 -8.978769 14.41619 
1 1 1   15   21   39 o   20.528   7.2054  -8.3041   11.827  -5.9298   12.206 -44.8099   47.861   16.392   7.5951   24.665   12.247 -8.273848 14.41076 
1 1 1   15   21   40 o   32.181   8.1399   31.430   13.352   32.601   15.415   27.911   26.718   34.062   10.185   30.301   12.700 3.760624 16.27973 
1 1 1   15   22    0 o  104.523   2.5371  226.361   15.427  226.361   15.427  226.361   15.427  104.523   3.5880  104.523   3.5880 0.000000 0.000000 
1 1 1   15   22    1 o   75.802   2.4905  116.355   7.6478  131.291   12.271  106.870   9.7793   79.688   3.7337   71.916   3.2970 7.771896 4.981028 
1 1 1   15   22    2 o  106.009   2.3166  235.104   9.9606  213.623   15.122  251.566   13.238  101.656   3.6067  110.362   2.9083 -8.705360 4.633202 
1 1 1   15   22    3 o  234.723   2.4086  1139.06   22.717  1136.73   36.483  1140.54   29.031  234.470   3.7726  234.977   2.9955 -0.5069733 4.817206 
1 1 1   15   22    4 f   46.864   3.2390   44.360   6.0925   50.186   10.064   40.990   7.6544   49.218   4.9578   44.511   4.1695 4.707294 6.477977 
1 1 1   15   22    5 o  186.250   2.2579  714.749   16.845  725.107   27.387  708.446   21.364  187.290   3.5454  185.209   2.7968 2.080826 4.515714 
1 1 1   15   22    6 o  197.167   2.2981  803.143   18.210  804.194   29.256  802.478   23.267  197.227   3.5965  197.107   2.8620 0.1196442 4.596279 
1 1 1   15   22    7 o  140.886   2.2735  411.154   13.052  403.732   19.978  416.681   17.240  139.750   3.4660  142.021   2.9433 -2.271393 4.547050 
1 1 1   15   22    8 o  158.467   2.3285  517.985   15.093  527.220   22.954  510.951   20.033  159.687   3.4852  157.247   3.0888 2.439789 4.656963 
1 1 1   15   22    9 o   33.396   4.7717   24.561   6.1750   20.666   10.247   26.782   7.7377   30.864   7.9881   35.928   5.2217 -5.063873 9.543414 
1 1 1   15   22   10 o   17.901   4.3563   2.2148   5.4623 -19.6319   9.6842   12.408   6.6151   11.786   5.7864   24.017   6.5136 -12.23088 8.712573 
1 1 1   15   22   11 o  111.481   2.4837  256.826   11.359  259.405   17.005  254.749   15.263  111.969   3.6822  110.993   3.3341 0.9762421 4.967347 
1 1 1   15   22   12 o  104.920   2.5905  228.991   11.150  211.589   16.205  244.635   15.365  101.092   3.8867  108.748   3.4258 -7.656082 5.180918 
1 1 1   15   22   13 o   50.928   5.3240   62.143   7.8125   45.338   18.180   65.949   8.6521   45.416   9.9782   56.441   3.7167 -11.02511 10.64794 
1 1 1   15   22   14 o  304.966   3.2597  1936.18   38.743  1910.52   66.531  1949.35   47.657  303.117   5.3217  306.814   3.7661 -3.696777 6.519441 
1 1 1   15   22   15 o  108.185   2.5920  242.372   11.565  243.352   16.287  241.375   16.425  108.409   3.6425  107.962   3.6886 0.4469070 5.183944 
1 1 1   15   22   16 o   51.536   3.7749   55.489   7.9479   54.087   12.013   56.581   10.600   50.917   5.7201   52.155   4.9275 -1.238277 7.549799 
1 1 1   15   22   17 o   83.158   5.0548  134.049   16.325  113.831   19.500  181.421   29.849   73.675   6.4171   92.641   7.8119 -18.96576 10.10966 
1 1 1   15   22   18 o   75.495   3.4676  117.433   10.700  109.321   14.042  128.662   16.521   72.455   4.6990   78.535   5.1005 -6.080467 6.935117 
1 1 1   15   22   19 o   27.901   5.4594   15.147   7.0747   27.872   10.829   5.6699   9.3447   35.620   7.6024   20.182   7.8372 15.43769 10.91870 
1 1 1   15   22   20 o   44.464   4.3258   41.525   7.9064   42.718   11.736   40.533   10.699   45.017   6.3208   43.911   5.9073 1.106022 8.651505 
1 1 1   15   22   21 o   96.939   2.7935  196.471   11.070  165.594   15.570  228.037   15.742   89.135   4.2351  104.743   3.6440 -15.60794 5.587003 
1 1 1   15   22   22 o   73.651   4.3053  114.475   13.005  113.070   19.367  115.630   17.551   73.149   6.4194   74.152   5.7387 -1.002907 8.610533 
1 1 1   15   22   23 o  136.797   2.5600  389.814   14.434  377.862   20.551  401.451   20.279  134.698   3.6991  138.896   3.5398 -4.198181 5.119977 
1 1 1   15   22   24 o   77.688   3.4840  130.321   10.741  112.238   16.984  142.376   13.867   72.837   5.6534   82.538   4.0734 -9.700485 6.968050 
1 1 1   15   22   25 o   90.134   2.9713  170.079   11.039  168.457   15.848  171.608   15.385   89.691   4.2842   90.578   4.1183 -0.8872299 5.942586 
1 1 1   15   22   26 o   36.582   5.3881   31.318   8.0048   17.981   11.930   42.238   10.796   28.557   9.0384   44.607   5.8678 -16.04915 10.77613 
1 1 1   15   22   27 o   65.604   3.6625   90.354   9.8127   94.999   15.115   86.970   12.901   66.960   5.4730   64.248   4.8685 2.712875 7.325078 
1 1 1   15   22   28 o   47.958   4.7006   51.763   8.7031   39.025   12.874   62.481   11.810   41.651   7.7806   54.266   5.2768 -12.61514 9.401164 
1 1 1   15   22   29 o   86.951   3.0930  158.937   11.078  163.197   16.154  155.154   15.222   88.019   4.4496   85.884   4.2973 2.135712 6.185938 
1 1 1   15   22   30 o   68.672   3.5447  100.612   9.9824   89.541   14.227  111.350   14.010   64.807   5.3225   72.538   4.6830 -7.731064 7.089372 
1 1 1   15   22   31 o   50.410   7.2832   89.389   13.423  104.269   14.583   6.8387   34.348   69.945   5.0551   30.874   13.661 39.07066 14.56633 
1 1 1   15   22   32 o   33.959   6.2662   27.462   8.8124   27.537   13.460   27.406   11.658   33.806   9.3426   34.111   8.3533 -0.3048630 12.53238 
1 1 1   15   22   33 o   14.483   4.7933  -8.5125   7.1911 -12.8001   11.011  -5.3234   9.4960   14.110   6.7405   14.856   6.8167 -0.7454767 9.586524 
1 1 1   15   22   34 o   25.590   7.1979   7.1610   13.205 -15.2925   19.670   25.581   17.816   19.417   9.1992   31.762   11.073 -12.34459 14.39582 
1 1 1   15   22   35 o   22.485   6.6762   6.5172   9.7542   6.6319   11.565   6.2344   18.156   21.039   8.5382   23.930   10.266 -2.891209 13.35232 
1 1 1   15   22   36 o   26.186   6.9786   15.719   10.074   17.902   11.973   10.429   18.641   27.143   9.0878   25.228   10.593 1.915594 13.95712 
1 1 1   15   22   37 o   24.188   7.1812   4.4115   10.921  -2.7494   12.667   25.148   21.555   17.772   8.0452   30.604   11.898 -12.83237 14.36246 
1 1 1   15   22   38 o   16.897   5.7534 -11.3163   10.023  -8.4937   11.332 -21.4569   21.480   15.081   7.0953   18.713   9.0588 -3.631825 11.50673 
1 1 1   15   22   39 o   26.913   7.6382   17.611   11.903   16.230   13.866   21.477   23.202   25.473   9.6332   28.354   11.856 -2.880495 15.27639 
1 1 1   15   22   40 o   22.886   7.1875   6.9326   12.044   7.5999   13.634   4.5632   25.692   21.446   9.0350   24.326   11.181 -2.880587 14.37498 
1 1 1   15   23    0 f   33.914   5.3287   27.057   9.2126   27.057   9.2126   27.057   9.2126   33.914   7.5359   33.914   7.5359 0.000000 0.000000 
1 1 1   15   23    1 o  222.470   2.4961  1024.12   22.791  1030.79   30.797  1016.05   33.887  223.302   3.3438  221.638   3.7070 1.663559 4.992266 
1 1 1   15   23    2 o  239.040   2.5163  1183.42   24.595  1167.54   37.173  1195.78   32.801  237.567   3.7938  240.513   3.3066 -2.946152 5.032560 
1 1 1   15   23    3 o  186.261   2.2674  716.190   16.961  720.986   27.335  713.188   21.629  186.720   3.5495  185.802   2.8223 0.9173889 4.534842 
1 1 1   15   23    4 o  262.340   2.5339  1425.41   26.735  1414.18   42.762  1432.61   34.255  261.405   3.9663  263.275   3.1547 -1.869659 5.067863 
1 1 1   15   23    5 o  100.077   2.3382  208.001   9.4092  202.745   14.988  211.419   12.088   98.999   3.6707  101.154   2.8974 -2.154678 4.676405 
1 1 1   15   23    6 o  145.189   2.2340  438.573   13.086  421.583   20.568  450.128   16.962  142.773   3.4929  147.605   2.7862 -4.832031 4.467999 
1 1 1   15   23    7 o   85.422   2.7003  151.194   9.4937  147.939   13.794  154.124   13.086   84.536   3.9564   86.308   3.6761 -1.771606 5.400569 
1 1 1   15   23    8 o  145.842   2.5396  440.054   15.266  439.590   21.207  440.553   21.995  145.770   3.5272  145.913   3.6548 -0.1426239 5.079298 
1 1 1   15   23    9 o   35.633   4.9398   24.418   6.2623   34.366   12.727   21.240   7.1933   39.794   8.0314   31.473   5.7535 8.321077 9.879559 
1 1 1   15   23   10 o   77.900   2.6340  123.259   8.1404  134.163   13.760  117.389   10.097   80.464   4.1463   75.336   3.2495 5.127914 5.267930 
1 1 1   15   23   11 o  173.943   2.5296  625.412   18.133  591.807   25.161  661.724   26.155  169.083   3.6080  178.803   3.5466 -9.720581 5.059222 
1 1 1   15   23   12 o  117.189   2.3594  283.744   11.011  285.738   18.130  282.579   13.860  117.465   3.7423  116.914   2.8743 0.5510254 4.718705 
1 1 1   15   23   13 o   50.498   5.3542   39.567   7.2703   74.938   23.857   35.946   7.6334   59.379   9.7414   41.617   4.4471 17.76107 10.70849 
1 1 1   15   23   14 o   99.325   3.1260  205.771   11.998  202.465   20.934  207.388   14.641   98.601   5.1476  100.049   3.5481 -1.447647 6.251917 
1 1 1   15   23   15 o   98.942   2.7156  202.447   10.968  165.169   15.026  244.958   16.047   89.185   4.0851  108.698   3.5793 -19.51310 5.431298 
1 1 1   15   23   16 o  140.099   2.5038  405.951   14.444  388.650   19.754  425.828   21.174  136.909   3.4984  143.289   3.5829 -6.379761 5.007546 
1 1 1   15   23   17 o   29.444   5.1759   19.526   7.0939   5.8420   10.896   29.594   9.3460   21.338   8.4109   37.549   6.0347 -16.21144 10.35188 
1 1 1   15   23   18 f   70.863   3.5347  106.883   10.085  116.103   13.285   94.348   15.491   74.656   4.3146   67.070   5.6000 7.586433 7.069335 
1 1 1   15   23   19 o   26.211   6.0220   11.488   7.9780   2.9535   10.287   24.368   12.638   19.382   7.9805   33.040   9.0205 -13.65840 12.04399 
1 1 1   15   23   20 o   34.532   5.4999   26.383   7.6403   27.187   11.042   25.646   10.583   35.030   7.8384   34.033   7.7171 0.9973373 10.99972 
1 1 1   15   23   21 o   41.904   4.8764   39.928   7.8045   25.939   11.486   51.925   10.637   34.064   8.2606   49.743   5.1847 -15.67891 9.752861 
1 1 1   15   23   22 o  129.669   2.9822  354.945   15.363  338.616   25.054  364.786   19.449  127.000   4.7831  132.339   3.5632 -5.339249 5.964408 
1 1 1   15   23   23 o   79.202   3.7683  130.536   11.344  137.188   20.702  127.682   13.560   80.284   6.2520   78.120   4.2087 2.163986 7.536643 
1 1 1   15   23   24 o   85.931   3.3091  158.998   11.366  135.726   17.585  175.697   14.896   80.164   5.3185   91.697   3.9387 -11.53289 6.618152 
1 1 1   15   23   25 f   59.044   3.8114   74.722   9.1392   62.907   13.321   85.229   12.562   54.420   5.9350   63.669   4.7837 -9.249390 7.622835 
1 1 1   15   23   26 o   23.789   6.0202   11.139   7.4454   11.032   11.309   11.221   9.8919   24.018   8.7709   23.560   8.2488 0.4580326 12.04040 
1 1 1   15   23   27 o   93.566   3.0955  185.703   11.806  171.424   17.672  197.214   15.867   90.126   4.7541   97.006   3.9658 -6.879471 6.191010 
1 1 1   15   23   28 o   23.157   5.9591   10.408   7.3456   10.264   11.015   10.523   9.8576   23.323   8.6332   22.990   8.2166 0.3329716 11.91825 
1 1 1   15   23   29 o   49.080   4.2925   51.863   8.6862   52.156   12.464   51.586   12.112   49.189   6.1433   48.970   5.9970 0.2198982 8.585088 
1 1 1   15   23   30 o   45.955   6.2600   54.769   10.809   67.729   13.509   31.704   18.022   56.038   5.8448   35.871   11.072 20.16690 12.52004 
1 1 1   15   23   31 o   63.522   4.0982   86.707   10.666   81.724   14.149   93.267   16.233   61.538   5.5748   65.506   6.0084 -3.967777 8.196305 
1 1 1   15   23   32 o   35.197   6.0847   29.550   8.6727   29.411   13.484   29.647   11.326   34.809   9.2386   35.584   7.9211 -0.7745056 12.16945 
1 1 1   15   23   33 o   16.895   5.3421  -2.7622   7.7797  -8.6387   11.999   1.4996   10.219   15.864   7.4110   17.927   7.6961 -2.062922 10.68423 
1 1 1   15   23   34 o   29.742   6.7490   22.955   9.6101   11.689   18.724   26.983   11.197   25.985   10.740   33.498   8.1762 -7.512684 13.49804 
1 1 1   15   23   35 o   25.278   6.8927   13.897   10.003   16.491   11.849   7.4622   18.662   26.287   9.0378   24.269   10.409 2.017790 13.78532 
1 1 1   15   23   36 o   25.599   7.1211   14.294   10.270   14.531   11.957   13.624   20.059   24.891   9.0295   26.307   11.014 -1.415623 14.24225 
1 1 1   15   23   37 o   28.169   7.5863   17.685   11.251   12.712   13.296   30.226   21.114   24.051   9.3459   32.287   11.952 -8.236023 15.17254 
1 1 1   15   23   38 o   30.182   7.5360   19.164   10.908   10.017   12.681   45.185   21.388   22.286   8.9768   38.078   12.107 -15.79227 15.07195 
1 1 1   15   23   39 o   19.635   6.3039  -1.5430   11.461   6.9727   13.174 -28.0576   23.246   21.023   8.8704   18.246   8.9596 2.777132 12.60785 
1 1 1   15   24    0 o  163.969   2.2538  555.809   21.538  555.809   21.538  555.809   21.538  163.969   3.1874  163.969   3.1874 0.000000 0.000000 
1 1 1   15   24    1 o  183.773   2.5049  698.753   18.986  700.704   26.890  696.814   26.812  184.029   3.5427  183.518   3.5423 0.5114594 5.009850 
1 1 1   15   24    2 o  157.345   2.4583  512.192   15.953  515.221   22.547  509.155   22.575  157.813   3.4641  156.877   3.4891 0.9354248 4.916642 
1 1 1   15   24    3 o   39.836   4.4245   34.565   6.8672   26.213   10.062   41.847   9.3954   34.780   7.2496   44.892   5.0744 -10.11165 8.849037 
1 1 1   15   24    4 o  162.802   2.5723  557.691   15.875  525.036   28.373  572.574   19.154  159.154   4.3223  166.451   2.7901 -7.296478 5.144637 
1 1 1   15   24    5 o  106.797   2.2892  230.725   9.7544  255.872   16.320  216.750   12.167  111.192   3.5587  102.402   2.8807 8.790497 4.578482 
1 1 1   15   24    6 o   45.853   3.6860   46.479   6.3662   36.154   10.838   51.918   7.8661   41.633   6.3119   50.072   3.8089 -8.438221 7.372090 
1 1 1   15   24    7 o   93.508   2.4746  179.248   9.3825  190.055   14.868  172.096   12.095   95.802   3.7628   91.214   3.2150 4.588135 4.949194 
1 1 1   15   24    8 f  240.084   2.7717  1194.05   27.445  1210.01   38.913  1178.24   38.714  241.685   3.9037  238.482   3.9359 3.202469 5.543499 
1 1 1   15   24    9 o  162.263   2.6221  540.136   15.918  557.437   29.795  533.226   18.830  163.925   4.4069  160.602   2.8427 3.322296 5.244258 
1 1 1   15   24   10 o   86.437   2.7513  155.903   9.7089  146.245   14.540  163.674   13.042   83.969   4.1985   88.904   3.5569 -4.935020 5.502594 
1 1 1   15   24   11 o  142.052   2.6578  412.254   15.419  377.638   20.161  461.033   23.933  134.998   3.6209  149.106   3.8917 -14.10791 5.315643 
1 1 1   15   24   12 o   27.775   5.1443   17.926   5.8225   11.700   10.744   20.514   6.9279   24.676   8.5993   30.874   5.6487 -6.197512 10.28868 
1 1 1   15   24   13 o   53.116   3.8046   56.756   7.0606   63.023   14.923   54.949   8.0144   54.769   6.6062   51.462   3.7759 3.307732 7.609201 
1 1 1   15   24   14 o   89.927   2.7696  168.584   10.196  162.165   15.210  173.822   13.741   88.324   4.1754   91.531   3.6398 -3.207047 5.539130 
1 1 1   15   24   15 o  103.297   2.6253  221.545   11.183  227.246   15.895  215.956   15.737  104.618   3.6838  101.975   3.7416 2.642838 5.250698 
1 1 1   15   24   16 o   42.533   4.2374   38.269   7.3525   36.308   11.077   39.814   9.8300   41.484   6.4743   43.582   5.4687 -2.098194 8.474839 
1 1 1   15   24   17 o   24.231   5.6332   12.124   6.7198   7.2806   10.284   15.733   8.8768   21.651   8.2700   26.810   7.6510 -5.158472 11.26638 
1 1 1   15   24   18 o  156.166   2.4212  505.671   15.582  478.868   21.604  534.732   22.495  151.852   3.4494  160.481   3.3986 -8.629532 4.842400 
1 1 1   15   24   19 o   90.811   3.9857  171.774   14.928  171.774   14.928   0.0000   0.0000   90.811   3.9857  ?   ?       ?      ? 
1 1 1   15   24   20 o   96.252   3.1486  192.698   12.162  188.664   15.436  199.302   19.750   95.089   3.9360   97.416   4.9155 -2.326714 6.297141 
1 1 1   15   24   21 o   92.452   3.2575  178.927   12.081  177.675   15.373  180.948   19.534   92.211   4.0422   92.694   5.1094 -0.4833527 6.515024 
1 1 1   15   24   22 o   21.856   5.5331   8.1597   6.9782  -1.3631   10.980   14.613   9.0384   17.915   7.8319   25.796   7.8181 -7.881443 11.06629 
1 1 1   15   24   23 o   73.268   5.5235  125.275   11.997  103.035   28.684  129.990   13.207   67.697   10.273   78.840   4.0616 -11.14318 11.04709 
1 1 1   15   24   24 o   47.070   4.7531   49.968   8.5737   36.326   12.719   61.330   11.607   40.253   7.9430   53.888   5.2225 -13.63463 9.506104 
1 1 1   15   24   25 o  105.945   2.8070  235.138   12.262  242.835   17.478  227.676   17.208  107.666   3.9358  104.224   4.0032 3.442818 5.613926 
1 1 1   15   24   26 o   99.568   3.3475  207.209   13.450  199.805   17.189  218.902   21.600   97.506   4.2741  101.629   5.1532 -4.122673 6.694994 
1 1 1   15   24   27 o   35.165   5.4659   29.206   7.9031   18.738   11.980   37.271   10.516   28.711   9.0542   41.620   6.1259 -12.90860 10.93184 
1 1 1   15   24   28 o   54.893   4.0979   63.507   9.1748   72.744   14.339   57.103   11.939   58.141   5.9796   51.644   5.6049 6.497520 8.195780 
1 1 1   15   24   29 o   23.537   5.9784   11.168   7.5896   6.6532   11.240   14.951   10.290   21.279   8.4933   25.794   8.4160 -4.514244 11.95686 
1 1 1   15   24   30 o   15.574   5.0134  -5.5139   7.2260 -10.5402   10.459  -0.9239   9.9949   14.215   6.7267   16.933   7.4356 -2.717956 10.02683 
1 1 1   15   24   31 o   51.934   4.2754   58.831   9.1167   60.101   13.601   57.795   12.285   52.314   6.3033   51.553   5.7780 0.7619209 8.550851 
1 1 1   15   24   32 o   20.872   6.0223   5.1208   8.5160   11.192   11.873  -1.3116   12.221   23.497   8.9073   18.246   8.1074 5.250317 12.04451 
1 1 1   15   24   33 o   63.181   3.7471   87.005   9.6801   84.682   14.543   88.853   12.971   62.187   5.6700   64.175   4.9005 -1.987469 7.494296 
1 1 1   15   24   34 o   34.059   6.2693   33.662   10.145   6.4882   20.398   42.594   11.694   24.588   10.714   43.529   6.5137 -18.94117 12.53870 
1 1 1   15   24   35 o   51.547   4.3631   59.770   9.2681   59.153   13.331   60.346   12.894   51.189   6.3145   51.905   6.0228 -0.7168427 8.726193 
1 1 1   15   24   36 o   43.049   6.9041   50.186   11.434   53.253   13.647   42.965   20.943   48.011   6.8917   38.086   11.965 9.924644 13.80810 
1 1 1   15   24   37 o   26.646   7.3675   17.725   10.997   17.933   12.735   17.117   21.806   26.362   9.3477   26.931   11.390 -0.5691357 14.73500 
1 1 1   15   24   38 o   20.225   6.6127  -2.9011   11.826  -5.7361   14.152   3.6578   21.526   17.467   8.1225   22.982   10.437 -5.515190 13.22542 
1 1 1   15   25    0 o  161.024   2.4610  536.433   23.090  536.433   23.090  536.433   23.090  161.024   3.4804  161.024   3.4804 0.000000 0.000000 
1 1 1   15   25    1 o  109.649   2.8134  245.789   12.214  237.639   15.154  260.901   20.636  107.157   3.4288  112.142   4.4615 -4.984779 5.626876 
1 1 1   15   25    2 o  100.301   3.4273  208.210   14.178  208.210   14.178   0.0000   0.0000  100.301   3.4273  ?   ?       ?      ? 
1 1 1   15   25    3 o  142.150   2.3970  417.779   14.007  423.079   20.726  413.324   19.004  142.960   3.5151  141.340   3.2599 1.620117 4.794065 
1 1 1   15   25    4 o   74.307   2.9508  118.240   8.3391  104.412   14.543  125.014   10.179   70.878   4.9749   77.736   3.1747 -6.857239 5.901554 
1 1 1   15   25    5 o   73.275   3.0720  108.936   8.9594  120.687   15.076  102.520   11.140   76.213   4.7962   70.338   3.8399 5.875328 6.144002 
1 1 1   15   25    6 o  127.513   2.3956  336.390   12.554  339.740   18.597  333.586   17.017  128.076   3.5205  126.951   3.2499 1.124832 4.791209 
1 1 1   15   25    7 o   83.391   3.0821  143.126   10.360  150.429   16.686  138.546   13.215   85.050   4.7569   81.732   3.9202 3.318481 6.164121 
1 1 1   15   25    8 o   89.032   2.9711  164.182   10.467  166.154   17.510  163.085   13.058   89.360   4.7508   88.703   3.5691 0.6568451 5.942099 
1 1 1   15   25    9 o  127.588   2.7211  336.690   13.716  341.629   23.044  333.981   17.068  128.198   4.3583  126.977   3.2591 1.221107 5.442120 
1 1 1   15   25   10 o   29.312   5.7828   18.471   6.9071   19.060   12.344   18.203   8.3338   29.788   9.1584   28.836   7.0631 0.9515972 11.56567 
1 1 1   15   25   11 o   62.855   3.5146   84.781   8.4790   75.542   14.564   89.518   10.429   60.048   5.8806   65.662   3.8508 -5.613647 7.029216 
1 1 1   15   25   12 o   75.675   4.1375  133.295   9.3903  100.954   21.870  140.604   10.397   68.969   7.6885   82.382   3.0601 -13.41280 8.275049 
1 1 1   15   25   13 o  231.087   2.4717  1105.07   22.814  1121.82   37.360  1095.11   28.809  232.296   3.8994  229.877   3.0385 2.419312 4.943434 
1 1 1   15   25   14 o  115.870   2.6387  279.867   12.554  249.333   17.743  310.476   17.764  109.474   3.9295  122.267   3.5227 -12.79285 5.277363 
1 1 1   15   25   15 o   48.070   4.0533   50.770   7.6603   36.362   11.444   62.465   10.311   41.442   6.6953   54.698   4.5704 -13.25557 8.106578 
1 1 1   15   25   16 o  159.355   2.7556  520.923   17.908  481.779   23.320  577.181   27.957  152.227   3.7142  166.483   4.0715 -14.25597 5.511122 
1 1 1   15   25   17 o   86.078   2.7412  154.090   9.7044  156.627   14.320  151.935   13.197   86.705   4.0043   85.451   3.7445 1.254051 5.482364 
1 1 1   15   25   18 o   89.543   2.8298  169.303   10.310  140.686   14.802  196.271   14.369   82.001   4.3764   97.084   3.5884 -15.08240 5.659509 
1 1 1   15   25   19 o   43.305   4.3946   40.268   7.7541   36.639   11.552   43.245   10.461   41.390   6.7668   45.220   5.6090 -3.830322 8.789226 
1 1 1   15   25   20 o   82.085   5.8062  164.567   13.727  173.908   15.116  120.631   32.782   91.219   4.0178   72.951   10.895 18.26757 11.61245 
1 1 1   15   25   21 o   18.891   5.5047  -0.9688   7.9435   9.7524   10.489 -15.3874   12.164   22.995   8.4395   14.788   7.0697 8.207800 11.00938 
1 1 1   15   25   22 o   44.851   4.3674   43.085   7.9760   41.121   12.118   44.586   10.594   43.818   6.7052   45.885   5.5981 -2.067574 8.734899 
1 1 1   15   25   23 o   56.746   6.5618   65.916   10.386   83.448   28.496   63.231   11.153   58.766   12.158   54.727   4.9412 4.039631 13.12356 
1 1 1   15   25   24 o   67.842   4.5335  105.334   11.245   83.510   20.104  115.270   13.565   61.673   7.9034   74.011   4.4439 -12.33779 9.067093 
1 1 1   15   25   25 o  111.906   3.0561  268.903   13.675  237.788   21.411  290.340   17.772  106.010   4.8970  117.802   3.6577 -11.79274 6.112209 
1 1 1   15   25   26 o   95.912   2.8803  194.021   11.355  183.655   16.446  203.465   15.698   93.364   4.2709   98.460   3.8656 -5.095573 5.760519 
1 1 1   15   25   27 o   62.944   3.6060   84.874   9.2858   79.421   13.743   89.455   12.596   60.923   5.4693   64.965   4.7011 -4.042336 7.212002 
1 1 1   15   25   28 o   66.111   3.6201   93.453   9.8593   95.192   14.344   91.896   13.574   66.646   5.2183   65.575   5.0188 1.071098 7.240151 
1 1 1   15   25   29 o   28.671   6.6734   19.339   9.9970   27.406   12.738   6.4037   16.130   33.790   8.9849   23.551   9.8696 10.23983 13.34676 
1 1 1   15   25   30 o   32.929   5.6365   24.805   7.8440   37.339   11.850   15.029   10.465   40.246   7.4118   25.612   8.4938 14.63412 11.27294 
1 1 1   15   25   31 o   46.320   4.8561   46.645   9.1112   57.400   14.668   39.888   11.626   50.419   7.0534   42.221   6.6764 8.198460 9.712123 
1 1 1   15   25   32 o   31.041   6.2343   23.770   8.9963   33.643   12.396   12.785   13.076   37.430   8.2520   24.653   9.3471 12.77763 12.46852 
1 1 1   15   25   33 o   15.372   4.9340  -6.5751   7.3531 -18.4054   11.207   2.3661   9.7434   12.923   6.3197   17.820   7.5788 -4.896570 9.868031 
1 1 1   15   25   34 o   49.347   4.6531   56.020   9.2885   50.939   14.097   59.918   12.348   46.813   7.3010   51.882   5.7706 -5.068680 9.306170 
1 1 1   15   25   35 o   18.620   5.6836   1.6201   8.0635   6.6310   11.846  -2.7066   11.007   20.689   8.5459   16.551   7.4955 4.137753 11.36730 
1 1 1   15   25   36 o   52.908   6.1138   67.491   11.863   63.145   14.084   78.105   22.011   52.224   6.5388   53.592   10.332 -1.368206 12.22768 
1 1 1   15   25   37 o   25.365   7.2016   15.120   10.654   14.425   12.434   17.041   20.666   24.259   9.1341   26.471   11.136 -2.212109 14.40311 
1 1 1   15   26    0 o  137.571   2.8037  392.541   22.455  392.541   22.455  392.541   22.455  137.571   3.9650  137.571   3.9650 0.000000 0.000000 
1 1 1   15   26    1 o   17.209   5.1278  -0.1622   6.3217  -3.8791   8.5205   4.3895   9.4288   14.850   6.6716   19.568   7.7888 -4.717714 10.25557 
1 1 1   15   26    2 o   55.665   3.2210   64.531   7.3863   66.669   10.320   62.285   10.577   56.626   4.4186   54.704   4.6878 1.921715 6.441967 
1 1 1   15   26    3 o  145.148   2.3940  436.681   14.291  435.329   20.999  437.847   19.504  144.912   3.5135  145.385   3.2526 -0.4727173 4.787903 
1 1 1   15   26    4 o  136.700   2.4882  385.847   13.997  353.819   19.155  422.544   20.504  130.630   3.5553  142.770   3.4821 -12.13985 4.976406 
1 1 1   15   26    5 o   87.128   2.5429  161.572   8.8073  139.726   13.915  176.173   11.376   82.009   4.1139   92.246   2.9900 -10.23766 5.085702 
1 1 1   15   26    6 o   53.696   3.8777   63.419   7.5408   53.425   14.047   67.465   8.9379   50.381   6.7600   57.011   3.8011 -6.629616 7.755405 
1 1 1   15   26    7 o  170.770   3.5788  593.211   23.981  561.004   29.317  658.347   41.691  164.215   4.3285  177.325   5.7005 -13.11021 7.157589 
1 1 1   15   26    8 o  133.009   2.9547  368.563   16.165  358.707   23.559  377.331   22.221  131.279   4.3510  134.740   3.9986 -3.461304 5.909328 
1 1 1   15   26    9 o   89.233   2.9642  164.703   10.487  169.303   17.529  162.139   13.087   90.090   4.7175   88.376   3.5905 1.714828 5.928401 
1 1 1   15   26   10 o  102.299   3.0827  219.010   12.940  205.982   18.919  230.460   17.737   99.364   4.6165  105.234   4.0866 -5.869522 6.165422 
1 1 1   15   26   11 o  173.146   2.8359  627.294   19.899  605.264   30.874  642.947   26.025  170.373   4.3937  175.920   3.5868 -5.546814 5.671836 
1 1 1   15   26   12 o   80.604   3.8486  142.566   9.4289  127.030   22.612  145.835   10.374   77.338   7.0890   83.870   2.9989 -6.531639 7.697241 
1 1 1   15   26   13 o   39.342   4.5175   29.949   6.0889   39.746   13.133   27.267   6.8721   42.549   7.7699   36.136   4.6109 6.413147 9.035065 
1 1 1   15   26   14 o   20.654   5.5937   6.6779   6.5176   3.2193   11.461   8.3309   7.9234   20.366   8.4088   20.942   7.3790 -0.5758152 11.18740 
1 1 1   15   26   15 o   69.109   3.0242   99.928   8.5317   98.402   12.972  101.091   11.326   68.579   4.5861   69.640   3.9433 -1.061272 6.048308 
1 1 1   15   26   16 o   30.477   5.2921   19.634   6.6951   29.310   10.507   13.020   8.6870   36.375   7.2580   24.579   7.7037 11.79600 10.58423 
1 1 1   15   26   17 o   81.130   2.8510  138.102   9.4982  126.244   13.633  149.286   13.240   77.672   4.2557   84.589   3.7950 -6.917191 5.702053 
1 1 1   15   26   18 o   84.922   3.2684  147.408   11.229  132.307   14.290  171.781   18.154   79.469   4.3598   90.375   4.8704 -10.90640 6.536724 
1 1 1   15   26   19 o   65.930   3.2475   92.203   8.7341   81.626   12.808  101.397   11.941   62.254   4.9883   69.607   4.1594 -7.352509 6.494906 
1 1 1   15   26   20 o   40.206   4.7292   35.169   7.5463   34.545   11.618   35.624   9.9249   39.448   7.4130   40.964   5.8743 -1.515514 9.458333 
1 1 1   15   26   21 o   25.438   5.7128   12.334   7.9230   23.841   10.760  -1.2928   11.710   32.410   8.0782   18.466   8.0800 13.94385 11.42562 
1 1 1   15   26   22 o  103.128   3.3986  224.903   14.431  232.430   20.061  216.832   20.774  105.004   4.6321  101.251   4.9746 3.753067 6.797292 
1 1 1   15   26   23 o   20.421   5.7134   5.8694   7.1372   2.6334   11.472   7.9129   9.1163   19.801   8.3120   21.041   7.8410 -1.239738 11.42672 
1 1 1   15   26   24 f   42.516   6.1214   42.596   9.1887   38.009   18.238   44.157   10.637   39.597   10.847   45.434   5.6766 -5.837444 12.24285 
1 1 1   15   26   25 o   70.319   3.2959  105.120   9.4764  100.595   14.178  108.774   12.740   68.811   4.9957   71.827   4.3005 -3.015961 6.591810 
1 1 1   15   26   26 o   30.407   5.7561   22.110   7.6184   14.648   11.613   27.748   10.094   25.899   8.9450   34.914   7.2468 -9.015312 11.51213 
1 1 1   15   26   27 o   29.409   5.8665   20.882   7.8749   11.704   12.142   27.547   10.346   24.239   9.0458   34.579   7.4723 -10.34084 11.73294 
1 1 1   15   26   28 f   31.192   6.0190   23.444   8.0102   19.789   12.242   26.181   10.592   28.916   9.1562   33.469   7.8152 -4.552637 12.03800 
1 1 1   15   26   29 o   40.524   6.6241   39.909   10.796   36.591   14.396   44.176   16.322   38.704   9.1604   42.344   9.5708 -3.640297 13.24817 
1 1 1   15   26   30 o   42.451   5.2896   43.606   8.6499   30.790   13.055   53.634   11.549   35.394   8.9403   49.507   5.6558 -14.11308 10.57910 
1 1 1   15   26   31 o   19.437   5.7214   3.1731   7.5371   8.8088   11.966  -0.5333   9.7040   22.234   8.7982   16.640   7.3163 5.593729 11.44274 
1 1 1   15   26   32 o   64.179   4.7243   91.380   12.136   85.390   15.234  101.783   20.077   61.952   5.9619   66.407   7.3301 -4.455196 9.448576 
1 1 1   15   26   33 o   20.502   6.0376   5.7636   8.4690   6.8883   12.014   4.6525   11.941   21.005   8.6337   20.000   8.4421 1.005871 12.07518 
1 1 1   15   26   34 o   32.576   6.2048   27.234   8.5060   26.695   12.695   27.673   11.458   32.010   9.1547   33.143   8.3780 -1.132591 12.40969 
1 1 1   15   26   35 o   19.968   6.4297  -2.8994   9.5414   11.911   20.293  -7.1026   10.811   25.012   10.793   14.923   6.9917 10.08929 12.85936 
1 1 1   15   26   36 o   39.123   6.7154   47.271   11.479   56.850   13.675   24.422   21.121   49.235   6.7344   29.010   11.620 20.22481 13.43080 
1 1 1   15   27    0 o   12.526   5.4959   2.3232   8.0296   2.3232   8.0296   2.3232   8.0296   12.526   7.7723   12.526   7.7723 0.000000 0.000000 
1 1 1   15   27    1 o   22.459   5.4178   9.9568   6.0351   11.002   8.4597   8.8737   8.6123   23.184   7.6343   21.735   7.6894 1.449640 10.83553 
1 1 1   15   27    2 o   97.171   2.5158  195.471   10.068  185.553   13.801  206.755   14.721   94.546   3.5391   99.795   3.5765 -5.248543 5.031564 
1 1 1   15   27    3 o   71.315   2.7687  105.728   8.1435  107.050   11.573  104.432   11.461   71.757   3.9103   70.873   3.9209 0.8842850 5.537479 
1 1 1   15   27    4 o   61.523   3.0123   79.084   7.6178   73.732   10.961   84.084   10.595   59.473   4.4684   63.573   4.0407 -4.100220 6.024503 
1 1 1   15   27    5 o   67.883   3.2862   98.038   8.8230   89.088   14.331  103.501   11.196   65.212   5.3283   70.553   3.8476 -5.341103 6.572303 
1 1 1   15   27    6 o   66.972   4.0634   99.659   8.6423   85.641   19.412  103.124   9.6515   63.450   7.4179   70.493   3.3196 -7.042709 8.126769 
1 1 1   15   27    7 f  116.150   2.8650  282.021   13.411  275.389   21.227  286.426   17.302  114.886   4.4798  117.414   3.5728 -2.528130 5.730043 
1 1 1   15   27    8 o   61.300   3.5764   78.681   8.6703   78.629   14.466   78.710   10.831   61.153   5.7355   61.447   4.2738 -0.2940025 7.152748 
1 1 1   15   27    9 o   21.715   5.2826   7.0221   5.8600   15.795   9.7971   2.1349   7.3123   26.979   8.1314   16.450   6.7456 10.52872 10.56520 
1 1 1   15   27   10 o  102.323   2.8410  213.858   11.870  188.432   15.520  249.693   18.425   95.149   3.9548  109.497   4.0798 -14.34778 5.681978 
1 1 1   15   27   11 o   58.326   3.7766   72.479   8.3582   68.554   14.899   74.281   10.097   56.947   6.3436   59.704   4.1002 -2.757526 7.553272 
1 1 1   15   27   12 o  118.034   2.5201  291.254   12.187  275.327   18.004  304.723   16.557  114.971   3.7967  121.096   3.3150 -6.125000 5.040232 
1 1 1   15   27   13 o   41.461   4.8416   38.686   7.3436   33.660   12.953   41.067   8.9148   38.703   8.3588   44.220   4.8880 -5.516617 9.683111 
1 1 1   15   27   14 o   89.911   2.9416  168.690   10.701  170.868   16.898  167.231   13.827   90.277   4.5383   89.546   3.7438 0.7313461 5.883240 
1 1 1   15   27   15 o   55.446   3.9036   68.086   8.3971   53.923   13.532   76.955   10.708   50.260   6.5281   60.631   4.2820 -10.37068 7.807162 
1 1 1   15   27   16 o   32.669   6.0098   24.095   8.2468   28.871   11.859   19.622   11.476   35.755   8.2144   29.582   8.7746 6.172079 12.01959 
1 1 1   15   27   17 o   51.103   4.1973   54.637   8.7715   46.322   11.667   65.448   13.304   46.666   6.0614   55.539   5.8076 -8.873070 8.394608 
1 1 1   15   27   18 o   59.450   3.4807   74.945   8.4639   68.564   12.434   80.455   11.554   56.981   5.2909   61.920   4.5241 -4.939289 6.961347 
1 1 1   15   27   19 o   26.016   5.7917   14.886   6.8506   13.819   11.097   15.543   8.7080   25.640   8.7482   26.392   7.5923 -0.7521515 11.58334 
1 1 1   15   27   20 o   83.568   3.3324  146.600   11.349  142.767   14.860  151.964   17.580   82.394   4.3728   84.742   5.0298 -2.347557 6.664815 
1 1 1   15   27   21 o   25.548   5.8836   13.900   7.0243   16.406   11.024   12.187   9.1141   27.196   8.6969   23.899   7.9267 3.296486 11.76723 
1 1 1   15   27   22 o   90.096   5.1291  179.020   16.233  180.764   18.715  173.721   32.621   92.367   4.9125   87.826   9.0055 4.540855 10.25827 
1 1 1   15   27   23 o   58.075   3.6600   71.146   8.7271   79.220   13.106   64.715   11.698   60.997   5.2095   55.153   5.1423 5.844215 7.320014 
1 1 1   15   27   24 o   33.926   6.4704   26.177   8.3216   28.475   17.086   25.462   9.5280   34.335   10.811   33.517   7.1126 0.8179970 12.94088 
1 1 1   15   27   25 o   33.563   6.7008   25.879   8.7285   29.026   17.841   24.888   10.008   34.286   11.074   32.840   7.5471 1.446110 13.40158 
1 1 1   15   27   26 o   31.527   5.8835   23.383   7.6867   23.899   11.931   23.016   10.051   31.654   8.8134   31.400   7.7965 0.2548542 11.76694 
1 1 1   15   27   27 o   49.401   4.2990   54.004   8.6375   47.464   12.733   59.577   11.756   46.311   6.6664   52.491   5.4300 -6.179333 8.598049 
1 1 1   15   27   28 o   19.415   5.6389   3.5732   7.3162   9.2627   11.211  -0.6477   9.6560   22.228   8.5973   16.602   7.2989 5.626621 11.27777 
1 1 1   15   27   29 o   36.933   5.5344   32.225   8.1054   32.766   12.359   31.817   10.737   36.917   8.3165   36.949   7.3044 -0.3219986E-01 11.06878 
1 1 1   15   27   30 o   40.629   6.1058   39.223   9.4355   41.433   16.935   38.228   11.362   40.042   10.220   41.217   6.6839 -1.174755 12.21168 
1 1 1   15   27   31 o   62.708   3.9160   86.593   10.115   91.491   14.759   82.255   13.891   64.360   5.5600   61.057   5.5161 3.302811 7.832043 
1 1 1   15   27   32 o   51.116   4.4027   58.873   9.2255   59.483   13.832   58.383   12.382   51.113   6.5610   51.120   5.8727 -0.6378174E-02 8.805458 
1 1 1   15   27   33 o   51.166   4.8860   60.464   10.275   54.539   13.929   67.536   15.217   48.375   6.9813   53.958   6.8376 -5.583000 9.772004 
1 1 1   15   27   34 o   22.698   6.1117   9.8091   8.3446   19.518   12.551   2.1170   11.171   27.203   9.3034   18.193   7.9282 9.009638 12.22331 
1 1 1   15   27   35 o   24.117   7.4190   9.9014   13.833   13.998   19.818   6.0091   19.317   25.357   10.797   22.878   10.178 2.478937 14.83808 
1 1 1   15   28    0 o   52.319   3.3507   58.187   10.032   58.187   10.032   58.187   10.032   52.319   4.7386   52.319   4.7386 0.000000 0.000000 
1 1 1   15   28    1 o   54.481   3.2291   61.929   7.2121   53.203   10.000   71.385   10.411   50.449   4.8061   58.514   4.3138 -8.064655 6.458193 
1 1 1   15   28    2 o   64.273   2.9390   86.098   7.7864   89.326   10.999   82.856   11.024   65.494   4.0718   63.052   4.2392 2.441933 5.877961 
1 1 1   15   28    3 o   48.468   3.4534   49.496   6.8475   43.522   9.8619   55.056   9.5150   45.571   5.2470   51.364   4.4914 -5.793819 6.906786 
1 1 1   15   28    4 o   44.251   4.5324   44.796   7.3849   33.081   12.098   51.754   9.3235   38.710   7.8460   49.793   4.5399 -11.08227 9.064764 
1 1 1   15   28    5 o  112.544   2.6917  265.873   12.378  235.530   18.025  292.954   17.029  106.331   4.1101  118.757   3.4767 -12.42582 5.383334 
1 1 1   15   28    6 o   41.846   5.3352   37.445   8.9750   33.129   11.930   43.074   13.624   38.740   7.7370   44.953   7.3481 -6.213310 10.67033 
1 1 1   15   28    7 f   67.749   3.3087   94.055   9.0984   85.744   11.681  106.875   14.507   64.073   4.4203   71.425   4.9246 -7.351967 6.617405 
1 1 1   15   28    8 o   50.559   3.4160   52.437   6.9625   58.951   11.340   48.497   8.8207   52.960   5.1917   48.157   4.4410 4.802914 6.831987 
1 1 1   15   28    9 o   65.586   3.0624   91.937   8.0735   78.916   12.327  101.719   10.684   61.306   4.8750   69.866   3.7077 -8.559296 6.124770 
1 1 1   15   28   10 o   53.228   3.9157   60.543   8.2986   41.982   11.495   80.750   11.993   44.424   6.2735   62.032   4.6877 -17.60728 7.831456 
1 1 1   15   28   11 o   27.711   5.7920   17.225   6.6617   14.446   13.044   18.205   7.7484   26.770   9.4640   28.652   6.6799 -1.881966 11.58401 
1 1 1   15   28   12 o   61.006   3.2218   78.551   7.9149   75.707   12.503   80.453   10.225   59.960   5.0556   62.052   3.9951 -2.092350 6.443566 
1 1 1   15   28   13 o   16.978   5.2122  -5.1857   5.7855   8.1043   12.542  -8.7784   6.5208   23.173   9.0569   10.784   5.1612 12.38901 10.42430 
1 1 1   15   28   14 o   49.680   4.9013   59.200   8.5035   40.102   14.693   68.819   10.427   42.067   8.7532   57.292   4.4128 -15.22584 9.802612 
1 1 1   15   28   15 o   42.190   4.6073   40.634   7.3307   30.532   11.566   47.418   9.4777   36.898   7.8414   47.481   4.8397 -10.58260 9.214687 
1 1 1   15   28   16 o   80.984   3.0979  138.794   10.180  129.684   15.564  145.605   13.457   78.502   4.8070   83.465   3.9092 -4.962975 6.195898 
1 1 1   15   28   17 o   44.266   4.3912   42.410   7.6999   40.121   12.579   43.780   9.7371   43.056   7.0837   45.476   5.1914 -2.419319 8.782310 
1 1 1   15   28   18 o   72.550   3.1492  111.724   9.3355   97.578   13.480  124.761   12.941   67.978   4.8080   77.122   4.0685 -9.144203 6.298316 
1 1 1   15   28   19 o  134.165   2.7098  377.141   14.961  345.584   21.013  409.583   21.306  128.396   3.9679  139.933   3.6916 -11.53717 5.419624 
1 1 1   15   28   20 o   66.984   3.7273   95.813   10.194   98.311   13.609   92.620   15.388   68.143   4.8421   65.825   5.6679 2.317184 7.454578 
1 1 1   15   28   21 o   49.255   4.3170   53.108   8.2953   49.368   13.915   55.170   10.332   47.517   7.1003   50.993   4.9124 -3.475433 8.634067 
1 1 1   15   28   22 o   48.626   4.0604   51.583   7.9954   44.532   11.908   57.373   10.789   45.329   6.3692   51.924   5.0380 -6.595238 8.120865 
1 1 1   15   28   23 o   52.751   4.6439   60.335   9.8793   58.307   12.630   63.531   15.856   51.912   5.8991   53.590   7.1738 -1.677792 9.287758 
1 1 1   15   28   24 o   32.329   5.7977   24.065   7.6851   28.688   11.899   20.757   10.066   34.878   8.3771   29.780   8.0173 5.097757 11.59543 
1 1 1   15   28   25 o   66.203   4.5053  100.996   10.629   85.491   20.080  107.033   12.529   61.389   7.9306   71.017   4.2774 -9.628265 9.010590 
1 1 1   15   28   26 o   72.818   3.4808  116.051   10.243   94.864   14.955  134.771   14.058   66.081   5.4872   79.555   4.2843 -13.47417 6.961677 
1 1 1   15   28   27 o   42.893   4.7752   41.036   8.4256   44.814   12.444   37.837   11.450   44.709   6.7481   41.077   6.7582 3.632706 9.550430 
1 1 1   15   28   28 o   26.369   6.7474   16.057   9.3735   17.732   11.719   13.081   15.617   27.209   8.9868   25.528   10.067 1.681009 13.49489 
1 1 1   15   28   29 o   45.972   6.0731   50.999   10.762   51.082   13.452   50.851   17.937   47.427   6.8768   44.517   10.012 2.910183 12.14619 
1 1 1   15   28   30 o   30.201   6.6543   20.771   10.187   7.0457   13.504   38.899   15.519   21.763   9.0680   38.638   9.7411 -16.87488 13.30857 
1 1 1   15   28   31 o   45.671   6.1096   51.028   11.058   49.222   14.285   53.728   17.468   45.713   7.5764   45.629   9.5867 0.8358383E-01 12.21916 
1 1 1   15   28   32 o   34.787   6.3998   27.265   10.126   10.908   12.672   56.157   16.842   22.801   9.0441   46.774   9.0573 -23.97317 12.79962 
1 1 1   15   28   33 o   18.173   6.2389 -10.0764   11.388  -5.3102   12.241 -40.7314   31.044   16.409   7.6043   19.936   9.8928 -3.526997 12.47770 
1 1 1   15   29    0 o   71.067   2.7955  105.742   11.506  105.742   11.506  105.742   11.506   71.067   3.9534   71.067   3.9534 0.000000 0.000000 
1 1 1   15   29    1 o   55.893   3.1056   65.450   7.1515   62.191   10.137   68.680   10.091   54.484   4.5109   57.302   4.2697 -2.818665 6.211164 
1 1 1   15   29    2 o  110.128   2.4337  252.066   11.035  246.416   15.094  258.550   16.172  108.827   3.3629  111.428   3.5188 -2.600616 4.867311 
1 1 1   15   29    3 o   83.160   2.5590  144.259   8.7664  137.400   12.470  150.961   12.326   81.178   3.7245   85.141   3.5102 -3.963905 5.117936 
1 1 1   15   29    4 o   21.414   5.5745   7.6897   6.2171   10.691   10.651   6.1382   7.6570   23.673   8.5321   19.154   7.1765 4.519442 11.14898 
1 1 1   15   29    5 o  126.511   2.6699  334.133   13.910  328.393   20.131  339.378   19.243  125.426   3.8914  127.597   3.6566 -2.170990 5.339824 
1 1 1   15   29    6 o   86.187   3.2074  149.704   10.607  140.087   12.662  172.327   19.420   81.953   3.7461   90.421   5.2073 -8.468246 6.414779 
1 1 1   15   29    7 o   22.671   5.8364   9.5688   7.1224   11.661   9.2791   6.5680   11.112   23.744   8.0000   21.598   8.5001 2.145721 11.67272 
1 1 1   15   29    8 o   36.629   5.2079   28.111   7.6562   20.780   9.8414   39.350   12.185   30.415   7.8060   42.843   6.8959 -12.42803 10.41570 
1 1 1   15   29    9 f   92.558   2.5793  177.676   9.7512  185.526   14.996  171.925   12.835   94.258   3.8575   90.857   3.4251 3.401093 5.158607 
1 1 1   15   29   10 o   31.145   5.3923   22.551   6.9462   16.251   10.782   27.021   9.0823   27.232   8.5895   35.057   6.5214 -7.825134 10.78463 
1 1 1   15   29   11 o   50.909   3.9416   52.281   7.5117   61.158   14.406   48.966   8.8032   53.491   6.5298   48.327   4.4166 5.164738 7.883173 
1 1 1   15   29   12 o   23.170   5.5062   10.720   5.9105   12.467   10.439   9.8958   7.1705   24.657   8.4828   21.684   7.0225 2.973146 11.01247 
1 1 1   15   29   13 o   44.229   4.4554   46.008   7.1740   29.827   11.367   56.718   9.2485   36.440   7.7987   52.017   4.3108 -15.57682 8.910839 
1 1 1   15   29   14 o   32.953   5.0817   22.612   6.4992   31.597   11.143   17.980   8.0011   37.568   7.4547   28.339   6.9081 9.229391 10.16339 
1 1 1   15   29   15 o   57.291   3.4106   70.613   7.7888   63.587   12.364   75.236   10.029   54.688   5.4814   59.894   4.0599 -5.206470 6.821192 
1 1 1   15   29   16 o   32.678   5.1990   23.942   6.6275   24.345   11.068   23.716   8.2752   32.624   8.2269   32.732   6.3589 -0.1075935 10.39793 
1 1 1   15   29   17 o   73.799   3.0647  115.659   9.2355  101.143   13.393  128.819   12.752   69.217   4.6914   78.381   3.9447 -9.164467 6.129464 
1 1 1   15   29   18 o   47.563   4.2596   50.037   7.8854   43.698   13.034   53.697   9.9034   44.757   7.0606   50.369   4.7671 -5.611633 8.519265 
1 1 1   15   29   19 o   77.079   3.2563  129.524   9.8932  110.121   15.808  142.015   12.684   71.859   5.3339   82.299   3.7368 -10.43961 6.512609 
1 1 1   15   29   20 o   23.368   5.1238   11.024   6.7521  -4.5089   10.859   20.815   8.6213   16.456   7.4495   30.280   7.0370 -13.82420 10.24764 
1 1 1   15   29   21 o   18.706   5.0075   2.6241   6.7437 -18.9745   12.031   12.519   8.1433   13.729   6.6771   23.682   7.4644 -9.953291 10.01502 
1 1 1   15   29   22 o   67.531   3.3163   98.976   9.0466   83.185   13.437  112.068   12.235   62.246   5.2339   72.817   4.0738 -10.57117 6.632516 
1 1 1   15   29   23 o   24.225   5.7525   9.1099   6.8908   23.554   12.316   2.5288   8.3137   31.325   9.0346   17.124   7.1233 14.20119 11.50501 
1 1 1   15   29   24 o   63.715   4.2352   89.079   11.099   83.790   15.916   94.087   15.486   61.702   6.2540   65.728   5.7126 -4.025215 8.470328 
1 1 1   15   29   25 o   55.795   6.1988   64.309   10.464   91.089   26.433   59.332   11.395   59.321   11.214   52.268   5.2859 7.053539 12.39766 
1 1 1   15   29   26 o   56.090   7.0664  103.954   12.038   39.317   26.516  120.733   13.510   37.020   13.444   75.159   4.3583 -38.13892 14.13286 
1 1 1   15   29   27 o   56.793   4.0380   72.324   9.2302   61.400   13.878   80.990   12.361   52.401   6.4212   61.185   4.8981 -8.784676 8.076097 
1 1 1   15   29   28 o   25.468   6.6653   14.925   9.6748   19.920   12.468   7.3646   15.339   28.192   9.2672   22.744   9.5826 5.448877 13.33065 
1 1 1   15   29   29 o   33.386   6.1403   26.060   8.4585   38.838   14.033   18.770   10.600   39.288   8.8704   27.484   8.4929 11.80404 12.28062 
1 1 1   15   29   30 o   14.075   4.7409  -9.9141   7.3989 -12.2892   12.005  -8.4594   9.3954   14.666   7.0148   13.484   6.3794 1.181342 9.481766 
1 1 1   15   29   31 o   16.550   5.4480  -7.6175   9.0515  -0.7144   13.511 -13.2387   12.192   18.607   8.3764   14.494   6.9682 4.113207 10.89590 
1 1 1   15   29   32 o   23.417   6.5123   11.820   9.4513   17.789   13.532   6.1350   13.206   26.117   9.5858   20.718   8.8176 5.399633 13.02452 
1 1 1   15   30    0 o   76.097   2.6843  121.031   11.847  121.031   11.847  121.031   11.847   76.097   3.7962   76.097   3.7962 0.000000 0.000000 
1 1 1   15   30    1 f   90.231   2.5035  169.669   9.3161  172.397   13.256  167.006   13.095   90.949   3.5339   89.512   3.5470 1.436821 5.006950 
1 1 1   15   30    2 o   37.028   4.1805   29.071   6.3789   30.313   9.2596   27.949   8.8002   37.774   5.9433   36.282   5.8807 1.491928 8.360973 
1 1 1   15   30    3 o   18.317   5.2676   3.1529   5.9933   5.1155   10.147   2.1013   7.4274   20.198   8.0672   16.436   6.7759 3.762119 10.53528 
1 1 1   15   30    4 o   38.675   4.4593   30.994   6.9218   35.805   11.461   28.232   8.6846   40.868   6.7993   36.483   5.7715 4.384167 8.918582 
1 1 1   15   30    5 o   62.986   3.7930   84.330   9.0726   85.163   10.926   82.481   16.280   63.793   4.1528   62.179   6.3483 1.614456 7.585920 
1 1 1   15   30    6 o   66.690   3.4102   94.868   9.0318   98.959   11.484   88.234   14.623   68.793   4.0474   64.586   5.4897 4.207275 6.820408 
1 1 1   15   30    7 o   68.549   3.3721   99.359   9.1926  101.074   11.622   96.493   15.023   69.525   4.0531   67.574   5.3904 1.950996 6.744185 
1 1 1   15   30    8 o   86.221   4.4248  171.403   12.198  180.585   13.740  137.255   26.496   93.066   3.5796   79.375   8.0934 13.69074 8.849699 
1 1 1   15   30    9 o   34.290   5.7013   25.930   7.8585   22.095   10.230   31.450   12.274   31.281   7.9212   37.299   8.2020 -6.018148 11.40257 
1 1 1   15   30   10 o   35.490   7.4400   13.853   10.815   2.8961   11.974   62.379   25.198   20.331   8.5107   50.649   12.206 -30.31837 14.87994 
1 1 1   15   30   11 o   51.861   3.7657   61.041   7.4307   43.807   11.974   71.835   9.4762   45.156   6.4291   58.566   3.9230 -13.41007 7.531500 
1 1 1   15   30   12 o   40.915   4.4337   38.656   6.6144   30.203   11.262   43.107   8.1723   36.557   7.7121   45.273   4.3766 -8.716072 8.867433 
1 1 1   15   30   13 o   80.684   2.9096  138.791   9.5193  118.974   14.102  155.381   12.903   75.153   4.5494   86.216   3.6286 -11.06261 5.819263 
1 1 1   15   30   14 o  109.470   2.6390  251.656   11.846  220.468   16.722  283.080   16.785  102.540   3.9539  116.401   3.4962 -13.86122 5.277969 
1 1 1   15   30   15 o   52.745   3.5477   59.545   7.5036   56.604   11.929   61.470   9.6524   51.470   5.6193   54.020   4.3323 -2.549828 7.095454 
1 1 1   15   30   16 o   44.853   4.0910   44.545   7.1514   38.160   11.715   48.337   9.0288   41.885   6.7816   47.821   4.5777 -5.936321 8.182002 
1 1 1   15   30   17 o   74.647   3.0461  119.169   9.2285   98.276   13.336  138.368   12.784   68.101   4.7479   81.193   3.8175 -13.09129 6.092291 
1 1 1   15   30   18 o   19.624   5.4118   5.6049   6.0682   8.2030   10.339   4.2395   7.4950   21.671   8.2885   17.577   6.9607 4.094120 10.82363 
1 1 1   15   30   19 o   45.561   4.4531   45.153   8.3332   39.879   11.521   50.941   12.068   42.678   6.5450   48.444   6.0401 -5.766663 8.906141 
1 1 1   15   30   20 o   62.234   4.3330   90.869   9.6574   69.476   17.551  100.158   11.566   55.636   7.6487   68.833   4.0738 -13.19725 8.665982 
1 1 1   15   30   21 o   36.884   5.2253   36.929   7.5810   14.056   12.712   49.555   9.4444   25.601   9.3067   48.167   4.7540 -22.56664 10.45056 
1 1 1   15   30   22 o   99.715   2.8001  210.563   11.478  189.044   16.035  233.175   16.438   94.383   4.1192  105.047   3.7939 -10.66444 5.600169 
1 1 1   15   30   23 o   45.851   4.1307   46.477   7.6058   44.503   12.035   47.789   9.8143   44.688   6.5294   47.014   5.0614 -2.325676 8.261407 
1 1 1   15   30   24 o   34.065   5.4321   27.926   7.3192   25.051   11.784   29.732   9.3391   32.024   8.6969   36.105   6.5110 -4.081009 10.86415 
1 1 1   15   30   25 o   25.148   5.7961   11.572   8.2188  -2.2511   11.351   26.803   11.915   17.240   7.7260   33.057   8.6421 -15.81713 11.59212 
1 1 1   15   30   26 o   26.713   6.0961   18.650   8.6539  -1.2345   17.613   24.979   9.9360   21.155   9.5400   32.270   7.5921 -11.11490 12.19224 
1 1 1   15   30   27 o   18.739   5.7420   1.1026   8.4331   6.3960   11.587  -4.8600   12.297   20.593   8.4732   16.886   7.7516 3.706669 11.48402 
1 1 1   15   30   28 o   26.827   6.6582   17.736   9.1935   21.789   13.354   14.083   12.676   28.993   9.5938   24.662   9.2350 4.330982 13.31636 
1 1 1   15   30   29 o   38.524   6.4007   38.358   10.121   29.438   13.897   48.433   14.770   33.100   9.6116   43.947   8.4554 -10.84752 12.80142 
1 1 1   15   30   30 o   31.322   6.5520   26.604   9.9744   38.413   13.756   13.512   14.484   38.408   8.8635   24.236   9.6516 14.17208 13.10401 
1 1 1   15   30   31 o   21.676   6.6892   4.0905   12.259 -28.9825   25.591   13.940   13.966   19.107   9.3861   24.246   9.5333 -5.138262 13.37845 
1 1 1   15   31    0 o   28.514   5.9551   21.026   8.6110   21.026   8.6110   21.026   8.6110   28.514   8.4217   28.514   8.4217 0.000000 0.000000 
1 1 1   15   31    1 o   33.372   4.6338   24.502   6.2244   30.446   8.8739   18.744   8.7330   37.856   5.6835   28.889   7.3204 8.966959 9.267695 
1 1 1   15   31    2 o   17.521   5.1551   1.5232   6.0702   4.9558   9.6918  -0.6925   7.7867   19.746   7.8851   15.297   6.6427 4.449310 10.31018 
1 1 1   15   31    3 o   76.328   2.9842  120.864   9.2274  129.194   14.681  115.424   11.864   78.376   4.5416   74.279   3.8724 4.096893 5.968376 
1 1 1   15   31    4 o   92.141   2.4760  177.121   9.4075  173.439   13.148  180.983   13.466   91.161   3.4970   93.120   3.5061 -1.958527 4.951943 
1 1 1   15   31    5 o   84.873   3.2326  148.927   10.506  144.426   12.610  159.142   18.996   83.122   3.6783   86.623   5.3170 -3.500748 6.465276 
1 1 1   15   31    6 o  101.744   2.7704  209.626   11.239  190.631   13.946  244.812   18.981   95.534   3.5395  107.954   4.2631 -12.42004 5.540890 
1 1 1   15   31    7 o   45.047   4.3148   41.544   7.8236   34.812   9.8429   53.094   12.893   40.362   5.9128   49.733   6.2856 -9.370991 8.629557 
1 1 1   15   31    8 o   31.392   5.6032   23.687   7.4569   29.502   9.5417   14.564   11.952   36.526   6.5756   26.257   9.0744 10.26858 11.20635 
1 1 1   15   31    9 o   20.951   5.2688   7.3000   5.7102   13.234   9.3849   3.8122   7.1953   24.711   8.0363   17.191   6.8162 7.520529 10.53768 
1 1 1   15   31   10 o   76.286   3.4529  124.170   10.714  101.331   15.187  146.797   15.116   69.056   5.3323   83.515   4.3884 -14.45915 6.905893 
1 1 1   15   31   11 o   24.903   5.3383   14.067   5.9492   10.930   9.9440   15.816   7.4245   23.280   8.2596   26.526   6.7651 -3.246004 10.67650 
1 1 1   15   31   12 o   78.632   2.6912  131.137   8.5887  105.433   12.212  156.299   12.082   70.783   4.1829   86.481   3.3873 -15.69796 5.382392 
1 1 1   15   31   13 f   27.577   4.9977   18.369   6.0781   8.7311   10.422   23.337   7.4825   22.104   8.3533   33.050   5.4892 -10.94651 9.995405 
1 1 1   15   31   14 o   71.026   2.9587  108.416   8.4778   91.507   12.694  122.029   11.390   65.737   4.6821   76.315   3.6187 -10.57822 5.917462 
1 1 1   15   31   15 o   19.426   5.3315   6.1349   5.8050   3.7969   10.846   7.0735   6.8720   19.726   8.1652   19.125   6.8577 0.6005898 10.66295 
1 1 1   15   31   16 o   44.814   4.0214   41.949   7.1912   48.701   12.099   38.260   8.9423   47.331   6.1976   42.297   5.1260 5.034573 8.042727 
1 1 1   15   31   17 o   30.641   5.3899   22.417   6.6130   18.835   11.388   24.239   8.1229   28.389   8.8077   32.893   6.2152 -4.504444 10.77976 
1 1 1   15   31   18 o   75.003   3.0396  121.868   9.1607  104.554   13.974  134.919   12.131   69.950   4.8434   80.056   3.6741 -10.10628 6.079279 
1 1 1   15   31   19 o   50.496   4.6260   56.641   8.8486   35.474   11.954   82.295   13.160   39.133   7.6809   61.860   5.1581 -22.72754 9.252098 
1 1 1   15   31   20 o   51.684   4.0561   58.604   8.1482   57.145   13.938   59.361   10.043   50.697   6.6659   52.671   4.6231 -1.973724 8.112143 
1 1 1   15   31   21 o   33.109   5.2822   26.796   7.0220   20.201   11.602   30.608   8.8210   28.839   8.8808   37.379   5.7217 -8.540062 10.56445 
1 1 1   15   31   22 o   25.715   6.0921   13.485   7.1756   22.135   13.100   9.7771   8.5767   29.945   9.4705   21.486   7.6657 8.458214 12.18414 
1 1 1   15   31   23 o   19.504   5.6464   4.4318   6.6638   8.5846   12.340   2.7223   7.9174   22.267   8.8954   16.742   6.9568 5.525154 11.29277 
1 1 1   15   31   24 o   34.849   6.1125   29.835   8.7745   25.218   11.965   35.207   12.907   31.787   8.8172   37.911   8.4681 -6.124294 12.22506 
1 1 1   15   31   25 f   18.053   5.6713  -0.6078   8.4597   0.9269   12.159  -2.0479   11.778   18.694   8.2053   17.412   7.8312 1.282557 11.34259 
1 1 1   15   31   26 o   26.551   6.7302   17.368   9.3587   16.862   13.112   17.892   13.362   26.260   9.4666   26.843   9.5690 -0.5828419 13.46036 
1 1 1   15   31   27 o   21.487   7.2091 -10.0728   16.710  -5.3484   20.451 -19.5619   28.984   21.015   9.7696   21.958   10.604 -0.9431686 14.41821 
1 1 1   15   31   28 o   32.990   9.6059   29.574   13.864   0.0000   0.0000   29.574   13.864  ?   ?    32.990   9.6059      ?      ? 
1 1 1   15   31   29 o   39.297   7.2316   51.798   13.330   20.555   28.686   60.402   15.053   28.318   12.509   50.276   7.2595 -21.95848 14.46327 
1 1 1   15   32    0 o   26.996   6.0479   19.389   8.3776   19.389   8.3776   19.389   8.3776   26.996   8.5531   26.996   8.5531 0.000000 0.000000 
1 1 1   15   32    1 o   22.717   5.0598   10.038   5.7810   17.711   8.4172   3.1872   7.9535   28.016   7.2342   17.417   7.0762 10.59929 10.11962 
1 1 1   15   32    2 o   18.587   5.3447   3.6574   6.2383   4.6567   10.266   3.0723   7.8549   19.904   8.0560   17.270   7.0260 2.634520 10.68944 
1 1 1   15   32    3 o   38.876   3.9164   32.227   6.2597   31.837   9.1891   32.564   8.5504   38.603   5.7715   39.149   5.2954 -0.5462112 7.832722 
1 1 1   15   32    4 o   25.729   5.0800   14.089   5.8562   21.659   8.7923   8.0537   7.8512   31.013   7.0353   20.446   7.3301 10.56741 10.16004 
1 1 1   15   32    5 o   89.848   3.1552  167.583   10.914  163.036   13.170  177.549   19.497   88.269   3.6176   91.427   5.1705 -3.158043 6.310361 
1 1 1   15   32    6 o   98.257   2.8712  202.913   11.285  203.088   14.327  202.626   18.317   98.537   3.5253   97.976   4.5328 0.5610275 5.742331 
1 1 1   15   32    7 o   51.343   3.2877   55.186   6.9232   63.814   10.351   48.203   9.3126   54.961   4.5664   47.726   4.7310 7.235237 6.575325 
1 1 1   15   32    8 o   27.192   5.1849   16.205   5.8659   20.204   9.3690   13.627   7.5229   29.740   7.6074   24.643   7.0471 5.097404 10.36988 
1 1 1   15   32    9 o   54.904   3.6351   62.953   8.0786   48.045   10.730   82.463   12.275   47.418   5.4865   62.389   4.7702 -14.97094 7.270273 
1 1 1   15   32   10 o   44.735   4.7407   48.902   7.4489   31.804   12.658   57.961   9.2132   37.035   8.4705   52.435   4.2601 -15.40005 9.481446 
1 1 1   15   32   11 o   56.858   3.8388   67.723   8.8406   61.958   11.300   76.820   14.195   53.932   5.0798   59.783   5.7569 -5.850723 7.677621 
1 1 1   15   32   12 o   81.512   3.1253  140.297   10.035  139.426   12.463  141.905   16.923   81.465   3.7092   81.559   5.0310 -0.9362030E-01 6.250551 
1 1 1   15   32   13 o   47.522   4.4255   47.333   8.4077   42.086   10.458   56.918   14.137   44.140   5.7447   50.903   6.7334 -6.762630 8.850978 
1 1 1   15   32   14 o   71.911   2.8620  110.433   8.3898   96.363   12.249  122.866   11.515   67.390   4.4071   76.432   3.6527 -9.042076 5.724059 
1 1 1   15   32   15 o   68.149   3.0492  100.255   8.3784   88.028   12.767  109.505   11.104   64.197   4.8216   72.101   3.7341 -7.904289 6.098461 
1 1 1   15   32   16 o   18.792   5.2036   5.6830   5.7092   2.5359   10.266   7.0920   6.8695   18.572   7.8331   19.012   6.8522 -0.4397926 10.40725 
1 1 1   15   32   17 o   32.528   5.0897   24.841   6.4643   21.785   11.133   26.396   7.9399   30.169   8.5539   34.887   5.5181 -4.718029 10.17933 
1 1 1   15   32   18 o   18.326   4.8213   4.1066   6.0963 -15.4391   11.357   12.017   7.2255   13.729   6.6319   22.922   6.9999 -9.193056 9.642624 
1 1 1   15   32   19 o   26.962   5.7137   17.493   7.6768   5.9010   11.892   25.773   10.051   20.876   8.5864   33.049   7.5407 -12.17270 11.42750 
1 1 1   15   32   20 f   60.496   3.5140   80.924   8.4676   70.041   13.238   88.459   11.016   56.553   5.6756   64.438   4.1447 -7.885342 7.027915 
1 1 1   15   32   21 o   61.340   4.0607   81.578   10.159   75.158   13.232   90.794   15.854   58.620   5.4729   64.061   6.0003 -5.441090 8.121346 
1 1 1   15   32   22 o   33.582   6.4162   28.520   9.2542   34.465   13.054   22.513   13.122   37.351   8.6447   29.812   9.4836 7.538033 12.83231 
1 1 1   15   32   23 o   43.248   5.7262   45.373   9.8377   46.620   13.987   44.152   13.839   43.911   8.0187   42.585   8.1766 1.326084 11.45232 
1 1 1   15   32   24 o   25.850   5.9785   13.084   8.7594   29.503   12.707  -1.7846   12.092   34.030   8.9380   17.670   7.9424 16.35932 11.95700 
1 1 1   15   32   25 o   22.989   6.9539   7.9905   11.585  -6.5380   23.350   12.735   13.343   21.993   10.295   23.984   9.3508 -1.990408 13.90778 
1 1 1   15   32   26 o   19.892   6.3979  -0.9293   11.349 -29.8341   25.339   6.3243   12.693   19.074   9.3636   20.710   8.7210 -1.635868 12.79578 
1 1 1   15   32   27 o   44.249   7.9902   52.189   12.939   70.577   26.993   46.703   14.743   45.885   13.416   42.613   8.6831 3.272022 15.98048 
1 1 1   15   33    0 o   46.407   3.5891   46.644   9.4198   46.644   9.4198   46.644   9.4198   46.407   5.0758   46.407   5.0758 0.000000 0.000000 
1 1 1   15   33    1 o   50.735   3.7347   55.819   7.5398   50.959   12.059   58.937   9.6608   48.643   6.0108   52.826   4.4340 -4.183151 7.469308 
1 1 1   15   33    2 o   62.646   3.3175   84.139   8.3311   78.377   13.175   87.979   10.754   60.620   5.2695   64.672   4.0317 -4.051216 6.634924 
1 1 1   15   33    3 o   23.135   5.1114   11.145   5.9711   3.4724   8.6613   18.094   8.2429   18.047   7.3642   28.222   7.0905 -10.17477 10.22282 
1 1 1   15   33    4 o   56.361   3.9927   66.836   8.7297   64.374   10.595   72.040   15.405   55.123   4.6603   57.599   6.4845 -2.476505 7.985418 
1 1 1   15   33    5 o   57.914   3.9770   73.076   8.8325   75.193   10.791   68.779   15.374   59.649   4.3862   56.179   6.6353 3.470257 7.953999 
1 1 1   15   33    6 o   41.407   4.8920   38.684   7.7902   40.409   9.8629   35.824   12.702   43.398   5.5102   39.416   8.0848 3.982224 9.783975 
1 1 1   15   33    7 o   21.887   5.3383   9.8890   5.7557   11.067   9.1206   9.1092   7.4198   22.889   7.9259   20.884   7.1532 2.004864 10.67654 
1 1 1   15   33    8 o   29.073   5.0759   19.909   6.0468   16.033   9.5487   22.503   7.8131   26.443   8.0407   31.704   6.1973 -5.260380 10.15179 
1 1 1   15   33    9 o   89.762   3.0914  170.785   11.392  149.963   15.866  192.939   16.365   83.996   4.5799   95.528   4.1537 -11.53113 6.182899 
1 1 1   15   33   10 o   38.256   4.5283   33.511   6.6328   28.284   10.621   36.853   8.4925   34.995   7.5779   41.517   4.9596 -6.521900 9.056618 
1 1 1   15   33   11 f   72.922   3.2883  111.235   9.7422  102.091   12.547  125.116   15.459   69.346   4.3870   76.498   4.8997 -7.152397 6.576629 
1 1 1   15   33   12 o   42.583   4.6155   38.974   7.9882   34.705   10.283   45.473   12.686   39.816   6.2615   45.349   6.7827 -5.533112 9.231004 
1 1 1   15   33   13 o   51.476   4.2478   54.900   8.7810   44.612   11.017   72.821   14.540   45.249   5.9032   57.702   6.1096 -12.45251 8.495553 
1 1 1   15   33   14 o   25.878   6.0601   14.672   7.5411   10.700   9.8347   20.341   11.748   22.641   8.1929   29.114   8.9316 -6.472403 12.12012 
1 1 1   15   33   15 o   37.796   5.4769   32.728   8.1785   27.209   10.650   40.660   12.768   33.902   7.7815   41.690   7.7093 -7.787861 10.95381 
1 1 1   15   33   16 o   44.876   4.4178   48.861   7.1008   33.617   11.727   57.685   8.9223   37.716   7.7964   52.035   4.1573 -14.31940 8.835544 
1 1 1   15   33   17 f   26.429   6.2950   16.163   8.2075   12.550   11.296   20.203   11.946   24.049   8.7685   28.809   9.0344 -4.760294 12.58997 
1 1 1   15   33   18 o   16.529   5.3983  -6.6878   8.5939  -4.7556   12.621  -8.3579   11.734   17.373   7.9291   15.685   7.3279 1.687852 10.79666 
1 1 1   15   33   19 o   13.758   4.8550 -25.1513   8.9257 -21.2891   16.828 -26.6633   10.529   16.487   7.9899   11.029   5.5178 5.458022 9.710041 
1 1 1   15   33   20 o   23.327   6.1159   8.9059   9.2293  -7.1721   13.893   21.606   12.348   17.396   8.0757   29.257   9.1869 -11.86070 12.23174 
1 1 1   15   33   21 o   28.864   7.2622   22.152   12.276  -1.2320   23.828   30.601   14.323   23.554   10.804   34.174   9.7070 -10.62027 14.52441 
1 1 1   15   33   22 o   38.418   7.8186   41.509   12.160   39.642   25.755   42.044   13.794   35.577   13.195   41.259   8.3918 -5.682186 15.63727 
1 1 1   15   33   23 o   37.263   7.8039   39.303   12.087   39.642   24.367   39.192   13.920   35.303   12.877   39.223   8.8189 -3.919853 15.60773 
1 1 1   15   33   24 o   25.790   6.7939   15.208   11.933 -16.3853   22.228   28.000   14.145   19.585   9.4143   31.994   9.7979 -12.40859 13.58782 
1 1 1   15   33   25 o   19.931   6.3522   0.4639   11.024 -18.8372   22.158   6.8130   12.708   19.055   9.2185   20.806   8.7419 -1.750887 12.70445 
1 1 1   15   34    0 o   8.8310   4.3092  -5.3326   7.4391  -5.3326   7.4391  -5.3326   7.4391   8.8310   6.0941   8.8310   6.0941 0.000000 0.000000 
1 1 1   15   34    1 o   27.397   5.4568   17.722   6.4784   14.212   10.207   20.089   8.3833   25.187   8.3903   29.607   6.9792 -4.420229 10.91362 
1 1 1   15   34    2 f   35.318   4.4428   27.884   6.2532   22.650   8.8593   33.081   8.8274   31.456   7.0081   39.180   5.4627 -7.724239 8.885635 
1 1 1   15   34    3 o   28.534   5.2314   18.833   6.2117   17.976   8.7714   19.695   8.7980   27.868   7.4763   29.199   7.3195 -1.330315 10.46283 
1 1 1   15   34    4 o   97.926   3.3974  204.627   13.420  204.243   17.281  205.210   21.302   98.162   4.2684   97.690   5.2868 0.4717636 6.794870 
1 1 1   15   34    5 o   26.523   5.8870   16.909   7.5848   21.574   9.2556   7.3708   13.234   30.512   7.4251   22.534   9.1376 7.978094 11.77406 
1 1 1   15   34    6 o  117.533   2.4754  291.064   11.932  282.604   17.686  298.132   16.166  115.831   3.7019  119.235   3.2873 -3.404114 4.950849 
1 1 1   15   34    7 o   68.916   2.8357  100.170   8.0404  104.116   11.874   96.829   10.927   70.125   4.1055   67.707   3.9128 2.417862 5.671384 
1 1 1   15   34    8 o   58.016   3.0846   71.049   7.3447   76.498   11.074   66.770   9.8139   59.941   4.4793   56.091   4.2421 3.849976 6.169264 
1 1 1   15   34    9 o   53.758   4.1157   63.642   8.9555   58.779   13.702   67.269   11.833   51.625   6.4350   55.892   5.1330 -4.266777 8.231444 
1 1 1   15   34   10 o   11.884   4.1330 -20.5224   7.1232 -28.9225   10.098 -12.2017   10.050   10.416   5.2380   13.351   6.3944 -2.934918 8.265936 
1 1 1   15   34   11 o   27.434   5.6051   17.297   7.8536   29.296   10.666   3.0898   11.606   35.336   7.5480   19.532   8.2882 15.80367 11.21012 
1 1 1   15   34   12 o   41.520   5.4012   42.108   8.6945   52.565   11.607   28.738   13.124   48.968   5.7471   34.072   9.1468 14.89585 10.80243 
1 1 1   15   34   13 o   30.755   5.9844   21.994   7.7006   18.155   9.7915   28.219   12.467   27.579   8.0848   33.931   8.8254 -6.352257 11.96877 
1 1 1   15   34   14 o   15.568   5.0477  -9.1467   7.9344 -21.9110   11.724   1.6406   10.778   12.792   6.2975   18.344   7.8904 -5.552015 10.09542 
1 1 1   15   34   15 o   60.106   4.4545   79.477   10.980   71.776   14.623   89.432   16.626   56.847   6.2368   63.364   6.3618 -6.516487 8.908982 
1 1 1   15   34   16 o   41.872   5.6581   41.835   9.5010   34.190   13.500   49.339   13.374   37.129   8.9255   46.615   6.9562 -9.485699 11.31610 
1 1 1   15   34   17 o   32.728   6.3094   24.357   9.7913   45.845   15.128   8.8673   12.844   43.061   8.8149   22.394   9.0295 20.66695 12.61881 
1 1 1   15   34   18 o   42.844   9.3477   56.136   17.936   54.192   22.958   59.181   28.733   43.063   12.310   42.625   14.071 0.4377556 18.69547 
1 1 1   15   34   19 o   24.562   9.0862   13.926   12.197   0.0000   0.0000   13.926   12.197  ?   ?    24.562   9.0862      ?      ? 
1 1 1   15   34   20 o   56.985   6.0716   74.557   13.229   93.510   24.516   66.772   15.713   60.374   9.8453   53.596   7.1081 6.778496 12.14311 
1 1 1   15   34   21 o   62.615   6.6394  103.334   14.695   89.003   26.146  109.951   17.766   55.744   11.743   69.485   6.1992 -13.74121 13.27875 
1 1 1   15   34   22 o   22.553   7.0191   5.9328   10.961   10.393   22.905   4.6077   12.484   25.208   11.155   19.897   8.5231 5.311495 14.03828 
1 1 1   15   34   23 o   60.024   6.8978   97.882   14.136   86.625   26.708  102.262   16.660   53.192   12.402   66.856   6.0419 -13.66482 13.79567 
1 1 1   15   35    0 o   62.319   3.7097   83.685   13.265   83.685   13.265   83.685   13.265   62.319   5.2463   62.319   5.2463 0.000000 0.000000 
1 1 1   15   35    1 o   19.443   5.2331   6.8208   5.8082   6.7837   8.3622   6.8554   8.0734   19.498   7.4550   19.388   7.3461 0.1106873 10.46625 
1 1 1   15   35    2 o   72.644   2.7236  111.830   8.1525  108.999   11.684  114.516   11.381   71.698   3.9511   73.590   3.7497 -1.892426 5.447127 
1 1 1   15   35    3 o   21.266   5.7983   8.3941   7.0721   10.088   8.5929   4.8389   12.451   21.753   7.6823   20.780   8.6869 0.9725075 11.59655 
1 1 1   15   35    4 o   52.557   4.2321   58.097   8.6112   53.377   10.349   68.720   15.526   49.713   5.0472   55.400   6.7948 -5.686836 8.464297 
1 1 1   15   35    5 o   43.248   3.7576   40.297   6.6748   45.405   9.9385   36.100   9.0090   45.743   5.2678   40.752   5.3599 4.991005 7.515183 
1 1 1   15   35    6 o   56.212   3.2448   67.912   7.4902   66.076   11.021   69.488   10.211   55.391   4.8239   57.034   4.3409 -1.642765 6.489505 
1 1 1   15   35    7 o   22.820   5.2710   11.955   5.8440   8.0844   9.2888   14.491   7.5186   20.690   7.8700   24.950   7.0140 -4.259501 10.54200 
1 1 1   15   35    8 o   41.921   4.4675   41.591   6.9291   32.107   11.352   47.222   8.7478   36.894   7.7086   46.947   4.5177 -10.05377 8.934899 
1 1 1   15   35    9 o   27.467   7.3034   13.559   8.1285   25.606   23.344   11.897   8.6712   31.939   12.391   22.994   7.7336 8.945002 14.60673 
1 1 1   15   35   10 o   46.204   5.3527   48.668   9.8758   59.331   14.878   40.270   13.204   51.236   7.0405   41.172   8.0644 10.06359 10.70530 
1 1 1   15   35   11 o   24.859   5.8326   10.986   8.5190  -4.8239   12.147   26.291   11.951   16.999   7.7663   32.719   8.7041 -15.72026 11.66523 
1 1 1   15   35   12 o   49.173   5.2291   55.407   10.194   43.868   13.800   69.268   15.125   42.838   8.1073   55.509   6.6063 -12.67143 10.45811 
1 1 1   15   35   13 o   29.236   6.7363   22.489   10.571   3.8687   18.919   30.941   12.746   23.201   10.208   35.271   8.7926 -12.07030 13.47268 
1 1 1   15   35   14 o   22.233   6.6813   6.6523   9.9679   4.2784   19.042   7.5483   11.699   23.217   10.227   21.249   8.6000 1.968216 13.36261 
1 1 1   15   35   15 o   66.554   5.3266   99.850   13.931  116.826   24.231   91.469   17.026   69.616   8.4390   63.492   6.5018 6.124046 10.65323 
1 1 1   15   35   16 o   70.556   5.2405  115.393   13.789  117.663   25.407  114.445   16.418   69.223   8.8988   71.889   5.5373 -2.666000 10.48096 
1 1 1   15   35   17 o   38.187   7.5888   38.089   11.577   46.513   21.835   34.795   13.655   39.511   12.186   36.863   9.0481 2.648090 15.17769 
1 1 1   15   35   18 o   24.991   11.467   3.2796   26.876   0.0000   0.0000   3.2796   26.876  ?   ?    24.991   11.467      ?      ? 
1 1 1   15   35   19 o   26.557   6.5802   18.116   11.166 -15.6952   22.398   29.299   12.881   19.792   9.4969   33.323   9.1109 -13.53114 13.16049 
1 1 1   15   35   20 o   34.738   8.0941   32.015   12.184   50.477   23.900   25.532   14.163   39.080   12.830   30.397   9.8716 8.683035 16.18820 
1 1 1   15   35   21 o   17.687   5.8050  -6.0279   10.361 -37.1164   22.037   2.7945   11.739   16.652   8.2753   18.721   8.1431 -2.068935 11.60991 
1 1 1   15   36    0 o   46.098   4.5107   47.834   11.466   47.834   11.466   47.834   11.466   46.098   6.3791   46.098   6.3791 0.000000 0.000000 
1 1 1   15   36    1 o   48.443   3.4103   50.720   6.7925   48.439   9.8462   52.791   9.3826   47.300   5.0470   49.585   4.5879 -2.284412 6.820643 
1 1 1   15   36    2 o   65.611   2.9129   91.811   7.8737   87.427   11.175   96.134   11.096   63.994   4.2339   67.227   4.0017 -3.233047 5.825734 
1 1 1   15   36    3 o   71.163   3.5462  109.789   10.364  111.621   14.107  107.641   15.276   71.981   4.7519   70.344   5.2653 1.636482 7.092478 
1 1 1   15   36    4 o   48.186   4.3801   53.191   8.1424   45.901   13.562   57.300   10.182   44.829   7.3349   51.543   4.7895 -6.714481 8.760114 
1 1 1   15   36    5 o   20.628   5.6518   5.7911   6.3235   13.984   12.051   2.6781   7.4284   24.937   9.0621   16.319   6.7564 8.617237 11.30357 
1 1 1   15   36    6 o   23.697   5.8152   12.170   6.4473   14.285   12.171   11.345   7.6013   25.093   9.1090   22.301   7.2313 2.792112 11.63037 
1 1 1   15   36    7 o   73.961   3.5151  123.430   9.8342  105.243   16.980  132.608   12.063   68.873   5.9777   79.049   3.7000 -10.17591 7.030122 
1 1 1   15   36    8 o   25.150   5.9926   13.473   6.6262   19.344   13.181   11.488   7.6651   27.945   9.5344   22.355   7.2624 5.589817 11.98524 
1 1 1   15   36    9 o   15.257   7.1176  -7.3531   11.005   0.0000   0.0000  -7.3531   11.005  ?   ?    15.257   7.1176      ?      ? 
1 1 1   15   36   10 o   25.298   6.7882   12.951   9.4465   21.612   16.035   8.3481   11.691   29.003   10.467   21.593   8.6468 7.409754 13.57631 
1 1 1   15   36   11 o   51.726   5.8412   62.955   11.497   69.799   19.937   59.545   14.073   52.362   9.5851   51.091   6.6786 1.270988 11.68238 
1 1 1   15   36   12 o   29.593   6.9422   23.299   10.932   8.8489   17.913   31.875   13.800   24.066   10.257   35.120   9.3581 -11.05412 13.88443 
1 1 1   15   36   13 o   19.408   6.1786  -0.5376   9.8222  -1.7193   17.434   0.0119   11.889   20.682   9.3927   18.134   8.0297 2.548101 12.35712 
1 1 1   15   36   14 o   54.783   6.2670   74.388   12.407   74.659   22.654   74.272   14.829   52.383   10.843   57.183   6.2876 -4.800087 12.53396 
1 1 1   15   36   15 o   25.759   7.1108   11.701   10.216   28.953   19.165   4.8543   12.074   31.596   11.437   19.921   8.4534 11.67488 14.22159 
1 1 1   15   36   16 o   53.913   6.5976   77.344   12.716   67.420   22.826   81.810   15.311   48.028   11.644   59.798   6.2082 -11.76918 13.19530 
1 1 1   15   36   17 o   50.295   6.7889   64.936   12.503   71.091   23.229   62.426   14.836   49.149   11.639   51.441   6.9925 -2.292191 13.57782 
1 1 1   15   36   18 o   27.192   12.068   16.474   27.001   0.0000   0.0000   16.474   27.001  ?   ?    27.192   12.068      ?      ? 
1 1 1   15   37    0 o   17.219   6.9677   9.5130   11.055   9.5130   11.055   9.5130   11.055   17.219   9.8538   17.219   9.8538 0.000000 0.000000 
1 1 1   15   37    1 o   18.883   5.6071   3.9653   7.3923   3.1162   10.725   4.7335   10.203   18.672   7.9466   19.094   7.9128 -0.4228230 11.21429 
1 1 1   15   37    2 o   21.907   6.9049   4.5635   10.151   6.9146   10.874 -11.3713   28.308   20.500   8.2932   23.314   11.042 -2.813929 13.80986 
1 1 1   15   37    3 o   21.609   7.0707  -0.7754   11.266  -0.6632   12.274  -1.3754   28.380   18.194   8.1021   25.024   11.590 -6.830406 14.14134 
1 1 1   15   37    4 o   23.457   9.4212   10.706   13.924   10.706   13.924   0.0000   0.0000   23.457   9.4212  ?   ?       ?      ? 
1 1 1   15   37    5 f   24.542   6.4971   9.9663   9.4679   25.004   14.904  -0.2069   12.259   30.752   10.134   18.332   8.1340 12.41983 12.99428 
1 1 1   15   37    6 o   75.652   4.2788  125.856   12.888  138.643   21.559  118.746   16.077   77.874   6.7124   73.430   5.3083 4.444351 8.557692 
1 1 1   15   37    7 o   23.505   6.4719   11.313   9.4473   3.0627   15.135   16.578   12.092   20.992   9.1856   26.019   9.1196 -5.027544 12.94382 
1 1 1   15   37    8 o   17.895   5.7898  -4.4868   9.2667   0.4546   15.082  -7.4837   11.745   20.094   8.9624   15.695   7.3323 4.398819 11.57959 
1 1 1   15   37    9 o   20.337   8.5726   5.3270   12.285   0.0000   0.0000   5.3270   12.285  ?   ?    20.337   8.5726      ?      ? 
1 1 1   15   37   10 o   36.819   7.1586   34.998   10.886   45.691   18.254   29.096   13.561   40.489   10.751   33.150   9.4554 7.339046 14.31729 
1 1 1   15   37   11 o   44.023   6.7230   48.544   11.330   59.404   19.716   43.190   13.844   46.542   10.518   41.503   8.3761 5.039547 13.44600 
1 1 1   15   37   12 o   61.490   5.5270   89.246   13.553  100.881   22.623   82.732   16.927   63.539   8.6326   59.442   6.9043 4.097313 11.05406 
1 1 1   15   37   13 o   36.364   7.5006   34.691   11.208   48.701   20.471   28.692   13.394   40.141   11.668   32.586   9.4284 7.555058 15.00117 
1 1 1   15   37   14 o   52.024   6.7747   73.991   13.223   61.562   22.036   80.985   16.529   45.333   11.705   58.714   6.8256 -13.38048 13.54950 
1 1 1   15   37   15 o   26.331   7.0749   18.407   10.679   10.674   20.194   21.409   12.583   24.438   10.654   28.223   9.3116 -3.785292 14.14973 
1 1 1   15   38    5 o   18.651   6.3613 -11.4986   12.644  -4.4942   13.810 -47.7903   31.436   17.709   8.1609   19.592   9.7603 -1.883141 12.72256 
1 1 1   15   38    6 o   29.785   7.7869   26.686   14.034   33.740   15.591  -3.4239   32.214   34.749   10.206   24.821   11.763 9.927546 15.57386 
1 1 1   15   38    7 o   22.071   7.3576  -1.4793   13.376  -1.3474   14.609  -2.1627   33.257   18.979   8.6111   25.162   11.933 -6.183525 14.71525 
1 1 1   15   38    8 o   25.956   7.5522   14.407   15.137   26.883   17.074 -31.3904   32.714   30.501   10.823   21.410   10.536 9.091776 15.10434 
1 1 1   15   38    9 o   24.810   11.795  -3.0421   32.898   0.0000   0.0000  -3.0421   32.898  ?   ?    24.810   11.795      ?      ? 
1 1 1   15   38   10 o   20.618   6.8799  -7.0941   14.990   3.2961   16.716 -49.7431   33.867   21.206   9.4485   20.031   10.003 1.174955 13.75975 
1 1 1   15   38   11 o   36.573   9.3411   44.721   16.958   41.976   19.484   53.296   34.436   37.037   11.526   36.110   14.703 0.9272003 18.68228 
1 1 1   16    0    0 o  361.328   5.7927  2698.57  121.943  2698.57  121.943  2698.57  121.943  361.328   8.1921  361.328   8.1921 0.000000 0.000000 
1 1 1   16    0    1 o  170.668   2.4393  601.574   24.260  601.574   24.260  601.574   24.260  170.668   3.4497  170.668   3.4497 0.000000 0.000000 
1 1 1   16    0    2 o   76.976   2.3446  122.904   10.483  122.904   10.483  122.904   10.483   76.976   3.3158   76.976   3.3158 0.000000 0.000000 
1 1 1   16    0    3 o  143.038   2.3966  422.749   19.970  422.749   19.970  422.749   19.970  143.038   3.3893  143.038   3.3893 0.000000 0.000000 
1 1 1   16    0    4 o  159.931   2.0854  528.123   19.439  528.123   19.439  528.123   19.439  159.931   2.9492  159.931   2.9492 0.000000 0.000000 
1 1 1   16    0    5 o  497.432   3.6544  5107.71  106.004  5107.71  106.004  5107.71  106.004  497.432   5.1681  497.432   5.1681 0.000000 0.000000 
1 1 1   16    0    6 o   15.177   5.8366   6.6802   7.2964   6.6802   7.2964   6.6802   7.2964   15.177   8.2543   15.177   8.2543 0.000000 0.000000 
1 1 1   16    0    7 o   98.377   3.2221  200.971   18.399  200.971   18.399  200.971   18.399   98.377   4.5568   98.377   4.5568 0.000000 0.000000 
1 1 1   16    0    8 o  386.143   3.0325  3077.62   68.282  3077.62   68.282  3077.62   68.282  386.143   4.2886  386.143   4.2886 0.000000 0.000000 
1 1 1   16    0    9 o  333.543   2.7719  2296.25   53.910  2296.25   53.910  2296.25   53.910  333.543   3.9200  333.543   3.9200 0.000000 0.000000 
1 1 1   16    0   10 o  484.538   3.5872  4847.08  101.356  4847.08  101.356  4847.08  101.356  484.538   5.0730  484.538   5.0730 0.000000 0.000000 
1 1 1   16    0   11 o   30.324   5.6639   22.537   8.6552   22.537   8.6552   22.537   8.6552   30.324   8.0099   30.324   8.0099 0.000000 0.000000 
1 1 1   16    0   12 o  391.581   3.0680  3165.39   70.055  3165.39   70.055  3165.39   70.055  391.581   4.3388  391.581   4.3388 0.000000 0.000000 
1 1 1   16    0   13 o   65.487   2.7453   89.418   10.402   89.418   10.402   89.418   10.402   65.487   3.8825   65.487   3.8825 0.000000 0.000000 
1 1 1   16    0   14 o  278.348   2.5100  1599.38   40.736  1599.38   40.736  1599.38   40.736  278.348   3.5496  278.348   3.5496 0.000000 0.000000 
1 1 1   16    0   15 o   52.215   3.7668   58.034   11.199   58.034   11.199   58.034   11.199   52.215   5.3270   52.215   5.3270 0.000000 0.000000 
1 1 1   16    0   16 o  141.032   3.6559  412.424   29.982  412.424   29.982  412.424   29.982  141.032   5.1702  141.032   5.1702 0.000000 0.000000 
1 1 1   16    0   17 o   31.347   7.1797   25.832   11.605   25.832   11.605   25.832   11.605   31.347   10.154   31.347   10.154 0.000000 0.000000 
1 1 1   16    0   18 o   82.123   3.7736  141.047   17.901  141.047   17.901  141.047   17.901   82.123   5.3367   82.123   5.3367 0.000000 0.000000 
1 1 1   16    0   19 o  183.869   2.6415  698.650   28.304  698.650   28.304  698.650   28.304  183.869   3.7357  183.869   3.7357 0.000000 0.000000 
1 1 1   16    0   20 o   55.139   3.7774   64.558   11.887   64.558   11.887   64.558   11.887   55.139   5.3420   55.139   5.3420 0.000000 0.000000 
1 1 1   16    0   21 o   24.429   7.9179   18.034   12.325   18.034   12.325   18.034   12.325   24.429   11.198   24.429   11.198 0.000000 0.000000 
1 1 1   16    0   22 o   30.209   7.0812   24.231   11.099   24.231   11.099   24.231   11.099   30.209   10.014   30.209   10.014 0.000000 0.000000 
1 1 1   16    0   23 o   84.016   4.2793  148.222   20.721  148.222   20.721  148.222   20.721   84.016   6.0518   84.016   6.0518 0.000000 0.000000 
1 1 1   16    0   24 o  121.229   3.3851  305.053   23.852  305.053   23.852  305.053   23.852  121.229   4.7873  121.229   4.7873 0.000000 0.000000 
1 1 1   16    0   25 o   95.454   3.9293  190.286   21.708  190.286   21.708  190.286   21.708   95.454   5.5569   95.454   5.5569 0.000000 0.000000 
1 1 1   16    0   26 o   70.200   3.6175  103.476   14.632  103.476   14.632  103.476   14.632   70.200   5.1160   70.200   5.1160 0.000000 0.000000 
1 1 1   16    0   27 o  237.394   3.2014  1165.80   44.293  1165.80   44.293  1165.80   44.293  237.394   4.5275  237.394   4.5275 0.000000 0.000000 
1 1 1   16    0   28 o   53.486   9.5381   70.058   25.734   70.058   25.734   70.058   25.734   53.486   13.489   53.486   13.489 0.000000 0.000000 
1 1 1   16    0   29 o  165.510   2.6647  566.878   25.694  566.878   25.694  566.878   25.694  165.510   3.7684  165.510   3.7684 0.000000 0.000000 
1 1 1   16    0   30 o   60.008   4.2055   76.799   14.388   76.799   14.388   76.799   14.388   60.008   5.9475   60.008   5.9475 0.000000 0.000000 
1 1 1   16    0   31 o   78.041   3.6496  127.869   16.446  127.869   16.446  127.869   16.446   78.041   5.1613   78.041   5.1613 0.000000 0.000000 
1 1 1   16    0   32 o   52.958   5.1613   61.679   15.081   61.679   15.081   61.679   15.081   52.958   7.2992   52.958   7.2992 0.000000 0.000000 
1 1 1   16    0   33 o   68.525   9.6538  111.559   34.258  111.559   34.258  111.559   34.258   68.525   13.653   68.525   13.653 0.000000 0.000000 
1 1 1   16    0   34 o   83.724   8.0024  157.202   37.069  157.202   37.069  157.202   37.069   83.724   11.317   83.724   11.317 0.000000 0.000000 
1 1 1   16    0   35 o   30.983   7.8235   26.891   12.905   26.891   12.905   26.891   12.905   30.983   11.064   30.983   11.064 0.000000 0.000000 
1 1 1   16    0   36 o   23.257   7.9170   17.164   12.440   17.164   12.440   17.164   12.440   23.257   11.196   23.257   11.196 0.000000 0.000000 
1 1 1   16    0   37 o   25.203   8.1410   19.917   13.025   19.917   13.025   19.917   13.025   25.203   11.513   25.203   11.513 0.000000 0.000000 
1 1 1   16    0   38 o   28.604   7.6862   23.740   12.055   23.740   12.055   23.740   12.055   28.604   10.870   28.604   10.870 0.000000 0.000000 
1 1 1   16    0   39 o   54.989   4.8711   66.685   14.960   66.685   14.960   66.685   14.960   54.989   6.8888   54.989   6.8888 0.000000 0.000000 
1 1 1   16    0   40 o   27.922   11.908   24.511   35.368   24.511   35.368   24.511   35.368   27.922   16.841   27.922   16.841 0.000000 0.000000 
1 1 1   16    0   41 o   31.262   8.0652   28.425   13.549   28.425   13.549   28.425   13.549   31.262   11.406   31.262   11.406 0.000000 0.000000 
1 1 1   16    0   42 o   20.819   7.8065   14.398   12.752   14.398   12.752   14.398   12.752   20.819   11.040   20.819   11.040 0.000000 0.000000 
1 1 1   16    0   43 o   16.042   6.8452   6.6160   11.699   6.6160   11.699   6.6160   11.699   16.042   9.6806   16.042   9.6806 0.000000 0.000000 
1 1 1   16    0   44 o   26.233   10.594   25.796   25.492   25.796   25.492   25.796   25.492   26.233   14.982   26.233   14.982 0.000000 0.000000 
1 1 1   16    0   45 o   19.144   8.9641   2.7201   26.259   2.7201   26.259   2.7201   26.259   19.144   12.677   19.144   12.677 0.000000 0.000000 
1 1 1   16    0   46 o   14.126   7.2353 -49.0089   31.958 -49.0089   31.958 -49.0089   31.958   14.126   10.232   14.126   10.232 0.000000 0.000000 
1 1 1   16    1    0 o  192.227   2.4951  762.998   27.954  762.998   27.954  762.998   27.954  192.227   3.5285  192.227   3.5285 0.000000 0.000000 
1 1 1   16    1    1 o  191.140   2.4822  753.680   19.566  741.554   27.432  766.239   27.916  189.575   3.5084  192.705   3.5123 -3.129303 4.964413 
1 1 1   16    1    2 o  246.197   2.5280  1251.10   25.422  1253.53   33.710  1247.89   38.711  246.485   3.3159  245.909   3.8167 0.5759888 5.055933 
1 1 1   16    1    3 o  209.115   2.1961  902.197   18.941  902.260   26.792  902.134   26.782  209.122   3.1062  209.107   3.1053 0.1463318E-01 4.392220 
1 1 1   16    1    4 o  310.821   2.6320  1993.35   33.738  2010.96   48.162  1976.38   47.275  312.168   3.7407  309.474   3.7037 2.693665 5.264073 
1 1 1   16    1    5 o  426.393   3.2480  3753.21   57.120  3750.35   80.675  3756.08   80.885  426.231   4.5891  426.556   4.5976 -0.3248596 6.495983 
1 1 1   16    1    6 o  156.597   2.0735  505.929   13.392  506.035   18.910  505.822   18.968  156.613   2.9275  156.580   2.9372 0.3306580E-01 4.146962 
1 1 1   16    1    7 o  311.423   2.6400  2001.28   33.906  1986.32   47.549  2016.75   48.363  310.240   3.7160  312.606   3.7511 -2.365601 5.280079 
1 1 1   16    1    8 o  325.045   2.7083  2180.60   36.308  2175.23   51.202  2186.03   51.493  324.643   3.8240  325.447   3.8362 -0.8038635 5.416559 
1 1 1   16    1    9 o  188.829   2.1656  735.585   16.864  743.844   24.096  727.656   23.609  189.867   3.0770  187.791   3.0481 2.076355 4.331203 
1 1 1   16    1   10 o  182.803   2.3470  679.941   17.345  643.914   22.164  736.859   27.859  176.653   3.0420  188.952   3.5747 -12.29904 4.693908 
1 1 1   16    1   11 o   72.601   2.5427  108.867   7.6081  112.820   10.704  104.830   10.816   73.935   3.5102   71.266   3.6797 2.668938 5.085441 
1 1 1   16    1   12 o  308.699   2.6437  1966.89   33.656  1983.17   48.043  1951.20   47.164  309.952   3.7581  307.446   3.7194 2.505341 5.287462 
1 1 1   16    1   13 o  118.889   2.1757  291.211   10.659  276.034   14.749  307.800   15.421  115.651   3.0921  122.126   3.0615 -6.474243 4.351323 
1 1 1   16    1   14 o  211.718   2.4606  920.222   21.109  952.031   33.363  898.987   27.259  214.734   3.7670  208.702   3.1668 6.031601 4.921260 
1 1 1   16    1   15 o  348.023   3.3666  2485.34   48.079  2676.78   72.566  2335.55   64.190  359.862   4.8891  336.183   4.6294 23.67908 6.733133 
1 1 1   16    1   16 o  185.654   3.2066  714.798   23.966  723.696   30.819  701.185   38.118  187.168   3.9922  184.141   5.0190 3.027100 6.413152 
1 1 1   16    1   17 o  237.538   2.6872  1167.18   26.104  1151.62   39.430  1179.32   34.831  236.101   4.0492  238.975   3.5338 -2.874084 5.374354 
1 1 1   16    1   18 o  271.385   2.5903  1521.07   28.994  1516.56   40.972  1525.59   41.035  270.982   3.6659  271.788   3.6607 -0.8062134 5.180682 
1 1 1   16    1   19 o   92.067   2.6951  175.099   10.233  178.670   14.540  171.594   14.404   92.998   3.7908   91.136   3.8321 1.861862 5.390272 
1 1 1   16    1   20 o  303.856   2.9358  1906.46   36.484  1893.92   48.475  1922.85   55.409  302.748   3.8822  304.965   4.4052 -2.216888 5.871675 
1 1 1   16    1   21 o  125.146   2.9372  326.038   14.894  310.722   23.045  337.026   19.518  122.574   4.5583  127.718   3.7053 -5.144630 5.874324 
1 1 1   16    1   22 o  113.930   2.8649  267.856   13.327  264.994   17.600  271.703   20.406  113.237   3.7683  114.623   4.3163 -1.386452 5.729823 
1 1 1   16    1   23 o  260.532   2.6024  1402.72   27.963  1395.68   39.581  1409.74   39.511  259.877   3.6928  261.186   3.6678 -1.309326 5.204743 
1 1 1   16    1   24 o   96.505   2.8445  192.569   11.316  200.835   16.086  184.470   15.922   98.559   3.9571   94.451   4.0873 4.108871 5.688984 
1 1 1   16    1   25 o  114.020   3.4952  269.209   16.437  267.115   23.217  271.313   23.272  113.574   4.9564  114.465   4.9295 -0.8914261 6.990405 
1 1 1   16    1   26 o  187.329   2.6432  724.861   20.355  733.637   30.107  717.472   27.626  188.354   3.8755  186.303   3.5953 2.050842 5.286344 
1 1 1   16    1   27 o  104.028   3.3386  216.960   13.752  200.210   16.926  249.485   23.587   98.362   4.1723  109.695   5.2133 -11.33321 6.677285 
1 1 1   16    1   28 f   94.519   4.0642  193.657   15.113  151.729   23.579  222.891   19.689   85.331   6.6996  103.707   4.6030 -18.37589 8.128494 
1 1 1   16    1   29 o  125.662   4.3044  337.199   21.632  287.656   33.450  372.813   28.361  117.347   6.9114  133.977   5.1325 -16.63029 8.608704 
1 1 1   16    1   30 o  103.936   3.3023  222.887   14.026  214.860   18.474  233.807   21.549  101.778   4.4010  106.094   4.9246 -4.315628 6.604583 
1 1 1   16    1   31 o   49.898   4.8548   52.580   9.8589   42.485   13.813   63.062   14.076   44.907   7.4578   54.889   6.2176 -9.981506 9.709630 
1 1 1   16    1   32 o  133.972   3.0781  372.607   16.951  364.672   22.940  382.149   25.156  132.444   4.1995  135.499   4.5014 -3.055603 6.156170 
1 1 1   16    1   33 o  112.410   3.5548  271.547   15.555  240.511   25.932  288.993   19.442  106.967   5.8778  117.854   3.9997 -10.88697 7.109574 
1 1 1   16    1   34 o  145.303   3.3120  446.351   19.305  466.360   24.922  416.330   30.526  149.662   4.0374  140.943   5.2513 8.719315 6.623902 
1 1 1   16    1   35 o   26.438   5.9421   13.720   8.1518   2.6234   11.749   24.021   11.320   20.206   8.4420   32.670   8.3647 -12.46458 11.88423 
1 1 1   16    1   36 o   24.904   7.7045  -1.5889   15.130   5.1883   22.144  -7.5226   20.720   27.022   11.456   22.786   10.305 4.235926 15.40908 
1 1 1   16    1   37 o   28.746   8.5526   9.2622   11.742   11.660   35.988   8.9766   12.421   33.952   14.506   23.540   9.0650 10.41268 17.10527 
1 1 1   16    1   38 o   93.347   3.3416  183.797   12.850  185.422   17.788  182.023   18.581   93.834   4.5964   92.860   4.8516 0.9740219 6.683153 
1 1 1   16    1   39 o   23.063   6.2828   8.8908   8.4665   7.1816   12.406   10.381   11.584   22.447   8.9343   23.680   8.8358 -1.233183 12.56553 
1 1 1   16    1   40 o   29.924   6.8406   20.438   9.5768   21.872   14.408   19.303   12.818   30.754   9.9540   29.094   9.3858 1.659897 13.68125 
1 1 1   16    1   41 o   18.601   5.6206   0.0506   7.8915   6.2814   11.345  -5.7910   10.985   21.130   8.4979   16.071   7.3586 5.058788 11.24118 
1 1 1   16    1   42 o   18.497   5.6450   0.4076   7.9668  -3.4065   11.311   4.1629   11.223   17.040   7.6682   19.953   8.2864 -2.913778 11.29006 
1 1 1   16    1   43 o   29.304   7.9357   17.604   11.405   15.180   12.786   27.046   25.230   25.913   9.3470   32.694   12.827 -6.781548 15.87130 
1 1 1   16    1   44 o   28.402   8.4166   15.026   16.520   12.030   22.244   18.711   24.670   27.095   11.484   29.710   12.307 -2.615126 16.83328 
1 1 1   16    1   45 o   27.874   8.5001   9.6744   18.990   30.903   26.817 -11.6755   26.893   32.885   13.121   22.863   10.809 10.02150 17.00013 
1 1 1   16    1   46 o   23.878   11.374 -11.8485   30.891   0.0000   0.0000 -11.8485   30.891  ?   ?    23.878   11.374      ?      ? 
1 1 1   16    2    0 o  230.066   2.6395  1092.76   35.400  1092.76   35.400  1092.76   35.400  230.066   3.7328  230.066   3.7328 0.000000 0.000000 
1 1 1   16    2    1 o   48.598   3.5591   48.741   7.1196   53.053   10.206   44.653   9.9365   50.693   4.8815   46.504   5.1806 4.189480 7.118121 
1 1 1   16    2    2 o   93.825   2.3742  182.192   9.0779  185.403   12.008  177.908   13.869   94.797   3.0711   92.853   3.6214 1.943947 4.748303 
1 1 1   16    2    3 o  404.386   3.3726  3376.58   55.694  3380.38   73.787  3371.55   84.907  404.681   4.4208  404.091   5.0945 0.5905762 6.745125 
1 1 1   16    2    4 o  345.935   2.8096  2469.17   40.077  2443.74   55.975  2495.92   57.408  344.109   3.9439  347.760   4.0025 -3.650116 5.619123 
1 1 1   16    2    5 o  398.144   3.0886  3272.08   50.718  3268.97   71.624  3275.20   71.828  397.954   4.3638  398.333   4.3720 -0.3784180 6.177125 
1 1 1   16    2    6 o  361.010   2.8912  2689.91   43.049  2682.92   60.696  2697.00   61.066  360.538   4.0817  361.482   4.0959 -0.9436646 5.782460 
1 1 1   16    2    7 o  156.817   2.4056  504.328   15.504  544.889   23.150  471.343   20.877  162.497   3.4542  151.137   3.3491 11.36092 4.811221 
1 1 1   16    2    8 o  167.102   2.4594  576.216   16.950  579.628   24.073  572.861   23.869  167.593   3.4827  166.612   3.4735 0.9808350 4.918786 
1 1 1   16    2    9 o   95.444   2.2194  188.079   8.7308  184.194   12.494  191.787   12.205   94.479   3.2063   96.409   3.0695 -1.930305 4.438717 
1 1 1   16    2   10 o  228.876   2.2977  1080.96   21.689  1076.58   30.532  1085.43   30.816  228.408   3.2410  229.344   3.2577 -0.9363251 4.595310 
1 1 1   16    2   11 o  181.848   2.1696  682.221   16.270  674.591   22.753  690.203   23.274  180.809   3.0511  182.887   3.0854 -2.079041 4.339238 
1 1 1   16    2   12 o  397.184   3.0981  3257.67   50.750  3272.01   72.107  3243.58   71.440  398.049   4.3922  396.318   4.3705 1.730560 6.196137 
1 1 1   16    2   13 o  190.517   2.1985  748.482   17.268  773.622   24.836  724.953   24.027  193.611   3.1102  187.422   3.1082 6.188889 4.397058 
1 1 1   16    2   14 o  410.729   3.3092  3483.92   54.340  3491.58   88.524  3479.29   68.834  410.997   5.2222  410.460   4.0660 0.5366516 6.618451 
1 1 1   16    2   15 o  170.228   2.9496  602.255   19.240  608.592   23.311  588.714   34.074  171.697   3.2918  168.760   4.8954 2.937057 5.899261 
1 1 1   16    2   16 o  142.131   3.4508  419.746   20.122  445.783   27.662  390.488   29.324  146.858   4.5670  137.403   5.1743 9.454254 6.901507 
1 1 1   16    2   17 o  238.226   3.0655  1171.87   29.565  1177.34   46.538  1168.17   38.283  238.646   4.7281  237.806   3.9032 0.8396301 6.131056 
1 1 1   16    2   18 o   80.221   2.8748  132.955   9.5083  132.939   13.273  132.971   13.628   80.218   4.0117   80.224   4.1187 -0.5950928E-02 5.749544 
1 1 1   16    2   19 o   61.134   4.6364   77.407   11.683   81.339   16.808   73.731   16.250   62.638   6.5060   59.631   6.6072 3.006420 9.272699 
1 1 1   16    2   20 o  240.748   2.6462  1199.20   26.171  1218.34   35.623  1176.76   38.577  242.859   3.5564  238.636   3.9195 4.223022 5.292466 
1 1 1   16    2   21 o  164.054   4.7809  556.790   32.349   0.0000   0.0000  556.790   32.349  ?   ?   164.054   4.7809      ?      ? 
1 1 1   16    2   22 o  162.144   2.9619  543.580   19.447  543.462   25.214  543.754   30.554  162.163   3.7699  162.126   4.5693 0.3752136E-01 5.923729 
1 1 1   16    2   23 o  138.520   2.4544  396.374   14.021  391.563   19.673  401.341   19.989  137.667   3.4647  139.374   3.4774 -1.707352 4.908803 
1 1 1   16    2   24 o  270.171   2.6539  1508.43   29.568  1524.61   42.272  1492.92   41.373  271.586   3.7738  268.755   3.7325 2.830292 5.307827 
1 1 1   16    2   25 o  151.120   2.8613  457.537   17.234  528.550   29.102  419.184   21.387  159.828   4.4147  142.411   3.6411 17.41730 5.722524 
1 1 1   16    2   26 o  184.434   2.7728  702.969   20.794  700.512   27.193  706.428   32.268  184.089   3.5815  184.778   4.2340 -0.6892395 5.545580 
1 1 1   16    2   27 o   95.004   3.8218  188.599   14.526  193.158   18.548  181.369   23.358   96.571   4.6568   93.436   6.0612 3.134148 7.643560 
1 1 1   16    2   28 o  150.989   4.2671  474.189   26.572  478.869   37.555  469.498   37.601  151.743   6.0006  150.236   6.0682 1.506409 8.534103 
1 1 1   16    2   29 o  153.147   2.9778  483.357   18.446  499.488   29.303  472.770   23.740  155.184   4.5783  151.110   3.8090 4.074127 5.955612 
1 1 1   16    2   30 o   58.822   4.1367   72.270   9.9183   86.877   14.282   58.663   13.785   64.626   5.3581   53.018   6.3039 11.60863 8.273337 
1 1 1   16    2   31 o  106.359   5.5433  278.371   18.692  175.436   38.172  310.839   21.438   90.381   10.240  122.337   4.2488 -31.95589 11.08662 
1 1 1   16    2   32 o  129.139   2.8726  345.837   15.280  360.673   22.316  332.740   20.967  131.730   4.1073  126.548   4.0171 5.182289 5.745149 
1 1 1   16    2   33 o   84.680   4.1148  153.932   13.179  142.258   23.468  159.309   15.927   81.947   6.9433   87.412   4.4177 -5.464844 8.229609 
1 1 1   16    2   34 o   24.515   6.0801   10.522   7.9603   17.703   11.582   4.0921   10.959   28.601   8.8837   20.428   8.3037 8.173386 12.16029 
1 1 1   16    2   35 o   35.389   6.0002   28.256   8.6585   30.801   12.304   25.759   12.187   37.026   8.2663   33.752   8.6993 3.274235 12.00043 
1 1 1   16    2   36 o   65.771   5.7430  104.042   12.768  115.821   15.181   75.567   23.604   74.185   4.9615   57.356   10.359 16.82933 11.48594 
1 1 1   16    2   37 o   56.052   5.9658   68.508   11.870   71.703   22.893   67.333   13.882   55.812   10.325   56.291   5.9792 -0.4795647 11.93170 
1 1 1   16    2   38 o   73.614   3.7182  114.851   11.275  115.459   16.379  114.302   15.543   73.750   5.3847   73.477   5.1288 0.2730713 7.436406 
1 1 1   16    2   39 o   21.594   6.1057   6.1662   8.2207   8.1336   12.156   4.5083   11.159   22.768   8.9118   20.420   8.3486 2.347969 12.21142 
1 1 1   16    2   40 o   44.267   6.8239   56.078   12.609   73.251   15.113   16.733   22.875   58.223   6.2932   30.310   12.110 27.91331 13.64786 
1 1 1   16    2   41 o   24.813   6.7339   8.9288   11.622   21.305   13.316 -30.6479   23.811   30.045   9.5530   19.581   9.4932 10.46366 13.46773 
1 1 1   16    2   42 o   22.655   7.2096   0.5900   10.474   0.1786   11.372   2.8918   26.898   18.377   8.0039   26.932   11.994 -8.554455 14.41911 
1 1 1   16    2   43 o   48.127   7.0223   52.310   12.161   46.654   14.007   69.623   24.508   45.218   7.5107   51.035   11.868 -5.817104 14.04455 
1 1 1   16    2   44 o   26.550   8.2679   5.0544   17.272  -3.5315   22.152   18.369   27.586   22.967   10.491   30.133   12.782 -7.165972 16.53582 
1 1 1   16    2   45 o   31.326   8.9817   24.121   18.910   8.5321   26.572   40.117   26.917   26.667   11.895   35.984   13.461 -9.317091 17.96342 
1 1 1   16    2   46 o   28.810   9.4838   9.0961   27.636 -12.4475   48.385   19.527   33.668   27.758   13.474   29.861   13.349 -2.103489 18.96759 
1 1 1   16    3    0 o  429.849   3.7732  3814.70   94.571  3814.70   94.571  3814.70   94.571  429.849   5.3361  429.849   5.3361 0.000000 0.000000 
1 1 1   16    3    1 o  246.380   2.7083  1252.33   27.515  1270.17   39.407  1235.36   38.437  248.090   3.8512  244.669   3.8089 3.420898 5.416610 
1 1 1   16    3    2 f  301.105   2.7911  1873.11   34.361  1886.75   45.769  1855.50   52.016  302.377   3.6700  299.832   4.2063 2.545044 5.582226 
1 1 1   16    3    3 o  328.753   2.9459  2228.88   39.476  2218.96   51.944  2242.45   60.737  327.908   3.8408  329.598   4.4679 -1.689850 5.891810 
1 1 1   16    3    4 o  311.098   2.6371  1997.18   33.835  1991.52   47.623  2002.94   48.081  310.654   3.7169  311.542   3.7419 -0.8881531 5.274183 
1 1 1   16    3    5 o  163.406   2.0916  550.891   14.097  554.092   19.938  547.692   19.933  163.881   2.9498  162.931   2.9662 0.9496460 4.183270 
1 1 1   16    3    6 o  281.576   2.4981  1636.09   29.011  1640.02   41.157  1632.20   40.899  281.912   3.5397  281.240   3.5259 0.6719360 4.996166 
1 1 1   16    3    7 o  253.312   2.3745  1324.10   24.808  1324.51   35.089  1323.69   35.078  253.351   3.3581  253.273   3.3580 0.7833862E-01 4.748954 
1 1 1   16    3    8 o  230.071   2.2894  1091.90   21.719  1108.61   31.122  1076.04   30.324  231.785   3.2555  228.357   3.2197 3.428558 4.578743 
1 1 1   16    3    9 o   28.432   4.9830   17.209   5.9221   22.743   8.5894   12.194   8.1761   32.579   6.6180   24.284   7.4513 8.295265 9.965935 
1 1 1   16    3   10 o  309.973   2.6453  1983.09   33.818  1972.33   47.535  1994.12   48.121  309.122   3.7284  310.823   3.7536 -1.700989 5.290611 
1 1 1   16    3   11 o  214.724   2.2518  951.280   19.940  939.261   27.942  963.754   28.466  213.342   3.1755  216.105   3.1937 -2.762848 4.503700 
1 1 1   16    3   12 o  168.556   2.1631  586.139   15.036  575.982   21.048  596.722   21.486  167.065   3.0547  170.046   3.0635 -2.980774 4.326190 
1 1 1   16    3   13 o  402.570   3.1295  3347.36   51.961  3349.38   73.498  3345.34   73.471  402.692   4.4252  402.448   4.4263 0.2431030 6.258978 
1 1 1   16    3   14 o  274.002   2.6136  1547.58   28.661  1560.64   46.638  1539.65   36.331  274.891   4.1135  273.114   3.2253 1.776550 5.227175 
1 1 1   16    3   15 o  114.278   2.6972  270.096   12.692  278.169   17.625  261.399   18.292  116.060   3.6819  112.496   3.9425 3.564507 5.394382 
1 1 1   16    3   16 o  136.946   2.6512  387.708   14.698  385.461   23.079  389.241   19.064  136.591   4.0966  137.300   3.3665 -0.7090912 5.302393 
1 1 1   16    3   17 o  178.381   3.6556  657.149   26.895   0.0000   0.0000  657.149   26.895  ?   ?   178.381   3.6556      ?      ? 
1 1 1   16    3   18 o  159.898   2.7155  522.746   17.264  548.119   28.811  508.532   21.564  162.862   4.2891  156.935   3.3316 5.926910 5.431026 
1 1 1   16    3   19 o   86.526   2.8522  154.811   10.168  146.393   14.364  163.266   14.396   84.162   4.1379   88.890   3.9266 -4.727821 5.704428 
1 1 1   16    3   20 o  250.741   3.3894  1315.69   33.954  1236.23   54.437  1366.28   43.440  244.370   5.4011  257.111   4.0964 -12.74138 6.778794 
1 1 1   16    3   21 o   88.017   2.8609  159.849   10.376  167.558   15.056  152.875   14.320   90.034   4.0545   86.000   4.0372 4.034500 5.721724 
1 1 1   16    3   22 o  204.251   2.7814  862.470   23.383  864.469   32.077  860.203   34.157  204.519   3.8027  203.983   4.0600 0.5362396 5.562778 
1 1 1   16    3   23 o   74.608   5.6116  117.940   16.002  121.547   19.464  110.416   28.109   76.544   6.1653   72.671   9.3780 3.872139 11.22311 
1 1 1   16    3   24 o  202.598   3.1575  837.272   26.114  931.239   40.608  771.010   34.100  212.128   4.6414  193.068   4.2823 19.05978 6.315083 
1 1 1   16    3   25 o  110.500   2.7397  252.297   12.468  271.668   17.876  233.948   17.398  114.634   3.7809  106.365   3.9658 8.268646 5.479337 
1 1 1   16    3   26 o  255.750   2.6442  1352.34   27.892  1350.31   39.376  1354.39   39.515  255.559   3.7358  255.942   3.7433 -0.3836823 5.288475 
1 1 1   16    3   27 o  117.053   3.8683  292.253   16.924  304.184   20.296  265.027   30.660  121.245   4.0586  112.861   6.5866 8.384148 7.736638 
1 1 1   16    3   28 o   93.937   4.0030  185.925   14.184  176.946   25.631  189.889   17.029   92.129   6.7453   95.745   4.3124 -3.615852 8.005973 
1 1 1   16    3   29 o   57.391   6.1763   66.290   11.988   78.287   25.683   62.948   13.555   59.807   10.810   54.975   5.9783 4.832081 12.35268 
1 1 1   16    3   30 o   54.369   4.3939   61.742   9.8195   55.438   13.772   68.260   14.005   51.515   6.4817   57.223   5.9339 -5.707405 8.787725 
1 1 1   16    3   31 o  130.381   3.1206  354.827   16.665  338.987   24.742  367.982   22.548  127.638   4.6999  133.125   4.1065 -5.487221 6.241217 
1 1 1   16    3   32 o  146.237   3.2935  454.082   19.349  491.703   25.353  401.604   29.944  153.828   3.9960  138.646   5.2364 15.18158 6.586967 
1 1 1   16    3   33 o   76.376   3.8027  125.468   11.649  142.845   15.552  103.254   17.583   82.735   4.5575   70.018   6.0887 12.71710 7.605495 
1 1 1   16    3   34 o   73.515   5.4775  116.023   16.442   97.355   23.171  134.956   23.335   67.324   8.3445   79.706   7.0981 -12.38263 10.95510 
1 1 1   16    3   35 o   89.943   3.2498  169.593   12.053  165.057   17.000  174.179   17.091   88.717   4.6459   91.168   4.5453 -2.451080 6.499533 
1 1 1   16    3   36 o   48.843   7.1524   71.958   12.515   86.004   14.138   21.100   26.902   63.811   5.3719   33.875   13.258 29.93596 14.30477 
1 1 1   16    3   37 o   40.973   7.2320   36.344   11.123   45.711   21.606   32.967   12.974   43.781   11.729   38.165   8.4638 5.616531 14.46405 
1 1 1   16    3   38 o   20.582   5.8671   4.5074   7.9044  -0.7983   11.571   9.1498   10.823   18.492   8.0633   22.672   8.5250 -4.179726 11.73420 
1 1 1   16    3   39 o   40.436   5.7329   36.921   9.2008   40.862   13.715   33.696   12.407   42.418   8.1353   38.453   8.0797 3.964981 11.46581 
1 1 1   16    3   40 o   89.737   4.2705  167.590   15.043  155.298   18.352  192.757   26.261   85.380   5.2116   94.094   6.7667 -8.714752 8.541010 
1 1 1   16    3   41 o   37.728   7.4478   41.526   12.672   48.360   13.610  -2.9758   34.729   46.763   7.0564   28.694   13.118 18.06934 14.89557 
1 1 1   16    3   42 o   41.596   6.8092   50.801   11.835   62.450   13.747   17.449   23.261   53.393   6.2427   29.799   12.103 23.59440 13.61848 
1 1 1   16    3   43 o   42.824   7.8827   45.181   12.438   42.253   14.146   55.160   26.114   41.967   8.4647   43.681   13.300 -1.713295 15.76548 
1 1 1   16    3   44 o   42.193   9.4500   53.910   21.641   18.649   32.875   80.875   28.749   31.077   13.570   53.309   13.156 -22.23200 18.90004 
1 1 1   16    3   45 o   32.163   9.5146   23.145   21.468   4.6190   27.814   50.448   33.766   26.105   11.859   38.222   14.882 -12.11736 19.02922 
1 1 1   16    3   46 o   27.381   9.3673 -15.9592   26.138   39.906   51.707 -35.1343   30.293   34.056   15.728   20.706   10.179 13.35043 18.73469 
1 1 1   16    4    0 o  265.574   2.8059  1456.01   43.444  1456.01   43.444  1456.01   43.444  265.574   3.9682  265.574   3.9682 0.000000 0.000000 
1 1 1   16    4    1 o  247.256   2.7131  1261.65   27.668  1263.61   39.184  1259.71   39.074  247.447   3.8394  247.065   3.8345 0.3816528 5.426246 
1 1 1   16    4    2 o  277.138   2.6760  1581.14   30.167  1562.06   39.408  1608.15   46.884  275.139   3.4727  279.138   4.0723 -3.999023 5.351935 
1 1 1   16    4    3 o  488.296   3.8873  4928.45   77.639  4956.38  103.510  4892.52  117.393  489.927   5.1226  486.664   5.8485 3.262543 7.774697 
1 1 1   16    4    4 o  381.790   3.2374  3012.63   50.571  3037.17   67.533  2981.30   76.303  383.589   4.2686  379.991   4.8686 3.597290 6.474848 
1 1 1   16    4    5 o  106.762   2.1241  235.041   9.3504  227.641   13.063  242.816   13.390  105.040   3.0153  108.485   2.9926 -3.444893 4.248231 
1 1 1   16    4    6 o  136.085   2.0696  382.006   11.615  387.953   16.570  376.261   16.285  137.126   2.9299  135.044   2.9238 2.082001 4.139183 
1 1 1   16    4    7 o  192.704   2.1578  766.185   17.150  760.143   24.161  772.321   24.347  191.938   3.0521  193.470   3.0512 -1.531418 4.315638 
1 1 1   16    4    8 o  226.206   2.2792  1055.70   21.261  1067.16   30.366  1044.69   29.779  227.409   3.2375  225.004   3.2089 2.404861 4.558354 
1 1 1   16    4    9 o  109.328   2.1610  246.589   9.7373  233.958   13.659  259.641   13.885  106.480   3.1101  112.175   3.0011 -5.694504 4.322021 
1 1 1   16    4   10 o  166.981   2.1280  575.332   14.655  572.454   20.668  578.243   20.784  166.561   3.0085  167.401   3.0103 -0.8400269 4.255909 
1 1 1   16    4   11 o  379.329   2.9999  2970.94   46.931  2955.25   65.912  2987.08   66.838  378.315   4.2242  380.343   4.2607 -2.027649 5.999805 
1 1 1   16    4   12 o  152.373   2.2751  478.348   14.183  472.759   18.844  485.650   21.540  151.355   3.0187  153.390   3.4047 -2.035004 4.550169 
1 1 1   16    4   13 o  266.509   2.5665  1464.99   27.370  1471.82   44.515  1460.84   34.706  266.973   4.0427  266.044   3.1629 0.9281616 5.132979 
1 1 1   16    4   14 o  257.199   2.5336  1369.20   26.238  1350.09   41.770  1381.65   33.721  255.679   3.9610  258.719   3.1601 -3.040527 5.067105 
1 1 1   16    4   15 o  237.177   2.7814  1161.64   27.187  1153.42   37.652  1170.60   39.297  236.307   3.8632  238.046   4.0026 -1.738922 5.562799 
1 1 1   16    4   16 o  202.375   2.6053  836.121   21.263  891.025   34.302  801.859   27.097  207.681   4.0046  197.068   3.3338 10.61230 5.210650 
1 1 1   16    4   17 o  189.969   2.6191  742.727   20.152  758.980   31.804  731.824   26.048  191.674   4.0230  188.264   3.3547 3.409637 5.238184 
1 1 1   16    4   18 o   47.529   4.4203   46.866   8.6404   47.802   11.851   45.804   12.625   48.046   5.9804   47.013   6.5108 1.032776 8.840599 
1 1 1   16    4   19 o  132.960   2.4584  365.180   13.480  361.721   19.150  368.578   18.978  132.333   3.5086  133.586   3.4444 -1.252335 4.916727 
1 1 1   16    4   20 o   65.924   4.9102   89.911   13.351   0.0000   0.0000   89.911   13.351  ?   ?    65.924   4.9102      ?      ? 
1 1 1   16    4   21 o  181.484   2.4189  680.389   18.106  672.299   25.569  688.524   25.641  180.401   3.4365  182.568   3.4053 -2.166672 4.837897 
1 1 1   16    4   22 o  187.067   2.5289  724.756   19.458  693.784   28.194  752.928   26.889  183.226   3.7308  190.909   3.4150 -7.682770 5.057769 
1 1 1   16    4   23 o  220.119   3.3944  1018.63   29.425  1059.53   36.946  947.701   48.656  226.385   3.9569  213.854   5.5164 12.53101 6.788796 
1 1 1   16    4   24 f  302.715   2.9578  1895.77   36.726  1889.56   54.845  1900.82   49.451  302.219   4.3999  303.211   3.9542 -0.9918213 5.915685 
1 1 1   16    4   25 o   58.314   4.9680   69.448   10.890   73.896   20.355   67.664   12.889   59.499   8.2947   57.130   5.4701 2.369370 9.936000 
1 1 1   16    4   26 o  103.545   2.9021  221.753   12.393  217.792   17.391  225.839   17.664  102.605   4.1095  104.485   4.0989 -1.879135 5.804203 
1 1 1   16    4   27 o  151.916   3.4814  478.594   19.549  478.851   23.019  477.930   37.023  152.163   3.6679  151.669   5.9184 0.4940186 6.962822 
1 1 1   16    4   28 f  149.111   2.6580  460.089   16.345  451.285   23.031  469.023   23.201  147.671   3.7814  150.551   3.7364 -2.880417 5.315998 
1 1 1   16    4   29 o  130.400   3.6521  352.304   19.612  373.962   28.691  333.306   26.871  134.147   5.1855  126.652   5.1440 7.494148 7.304153 
1 1 1   16    4   30 o  121.011   3.1415  303.668   15.543  305.601   23.621  302.193   20.641  121.301   4.7214  120.720   4.1456 0.5802078 6.283090 
1 1 1   16    4   31 o  103.695   2.9686  223.355   12.695  221.229   17.814  225.550   18.097  103.196   4.1854  104.194   4.2110 -0.9982224 5.937231 
1 1 1   16    4   32 o   59.889   4.0355   75.104   9.9580   76.196   14.452   74.116   13.740   60.286   5.8124   59.492   5.5996 0.7934265 8.070940 
1 1 1   16    4   33 o   33.571   6.3042   25.454   9.0796   31.660   12.437   18.370   13.286   37.765   8.2180   29.377   9.5623 8.388220 12.60844 
1 1 1   16    4   34 o   67.619   3.6537   95.788   10.186   97.449   14.638   94.229   14.184   68.179   5.2055   67.059   5.1284 1.119980 7.307415 
1 1 1   16    4   35 o   90.373   3.1509  171.259   11.733  176.095   16.400  166.187   16.793   91.719   4.3354   89.027   4.5735 2.692131 6.301785 
1 1 1   16    4   36 o   46.131   5.4222   48.095   9.7527   57.433   13.234   36.994   14.428   51.940   6.1775   40.323   8.9128 11.61709 10.84434 
1 1 1   16    4   37 o   18.887   5.7182   0.0649   7.9693   3.6320   11.807  -2.9204   10.801   20.608   8.5237   17.166   7.6248 3.442160 11.43644 
1 1 1   16    4   38 o   18.661   5.5107   0.2597   7.4548   7.8858   10.814  -6.6453   10.290   21.957   8.4576   15.364   7.0669 6.593524 11.02144 
1 1 1   16    4   39 o   35.327   7.1828   32.637   11.869   41.080   13.902   9.9428   22.793   42.449   8.2378   28.205   11.769 14.24347 14.36554 
1 1 1   16    4   40 o   50.131   6.9375   70.492   12.105   82.836   14.118   36.221   23.524   62.225   5.5009   38.037   12.738 24.18779 13.87507 
1 1 1   16    4   41 o   23.938   7.5773   4.0577   11.163   6.3862   11.787 -16.1811   34.751   21.388   8.6408   26.487   12.450 -5.098991 15.15464 
1 1 1   16    4   42 o   29.540   6.7552   22.360   11.111   31.739   12.557 -11.4939   23.856   36.530   8.4947   22.549   10.506 13.98123 13.51038 
1 1 1   16    4   43 o   33.714   7.1394   32.904   11.918   40.564   13.348   2.7844   26.469   41.313   8.1229   26.114   11.743 15.19880 14.27877 
1 1 1   16    4   44 o   34.750   8.8127   27.354   17.686   4.6628   23.258   58.468   27.234   25.264   11.207   44.235   13.604 -18.97188 17.62533 
1 1 1   16    4   45 o   35.812   10.864   41.991   27.326   56.042   48.654   35.516   33.026   37.644   16.471   33.979   14.172 3.664978 21.72846 
1 1 1   16    4   46 o   28.854   9.4533   10.662   27.764 -26.9711   51.716   25.899   32.908   26.813   13.205   30.895   13.531 -4.082329 18.90656 
1 1 1   16    4   47 f   29.191   12.852   23.403   30.027   0.0000   0.0000   23.403   30.027  ?   ?    29.191   12.852      ?      ? 
1 1 1   16    5    0 o  195.437   2.5127  788.711   28.622  788.711   28.622  788.711   28.622  195.437   3.5535  195.437   3.5535 0.000000 0.000000 
1 1 1   16    5    1 o  384.726   3.4864  3056.13   55.321  3055.70   78.220  3056.56   78.252  384.698   4.9298  384.753   4.9311 -0.5432129E-01 6.972749 
1 1 1   16    5    2 o  255.470   2.5751  1345.31   26.817  1337.01   35.278  1356.67   41.275  254.550   3.3602  256.390   3.9032 -1.839447 5.150280 
1 1 1   16    5    3 o  226.590   2.4456  1059.78   22.618  1061.70   29.925  1057.23   34.544  226.838   3.1985  226.341   3.7004 0.4976959 4.891132 
1 1 1   16    5    4 o  181.546   2.3024  680.419   17.059  682.473   22.570  677.681   26.054  181.874   3.0088  181.219   3.4859 0.6546936 4.604785 
1 1 1   16    5    5 o  162.832   2.2691  548.707   15.082  558.881   20.047  535.438   22.894  164.584   2.9532  161.081   3.4460 3.503098 4.538257 
1 1 1   16    5    6 o  553.792   3.9923  6334.77   91.160  6277.04  127.146  6395.85  130.771  551.205   5.5927  556.378   5.6987 -5.173035 7.984601 
1 1 1   16    5    7 o  227.496   2.2732  1067.96   21.329  1065.96   30.152  1069.96   30.175  227.283   3.2165  227.709   3.2130 -0.4263000 4.546345 
1 1 1   16    5    8 o  294.511   2.5632  1789.94   31.131  1804.79   44.428  1775.61   43.635  295.710   3.6427  293.312   3.6070 2.397430 5.126362 
1 1 1   16    5    9 o  199.260   2.2017  819.130   18.092  830.674   25.830  808.011   25.350  200.637   3.1214  197.882   3.1061 2.755325 4.403462 
1 1 1   16    5   10 o  220.945   2.2710  1007.33   20.694  1016.69   29.450  998.190   29.086  221.959   3.2170  219.930   3.2065 2.028503 4.542062 
1 1 1   16    5   11 o  223.458   2.2862  1030.50   21.070  1037.30   29.925  1023.81   29.672  224.189   3.2364  222.727   3.2300 1.462143 4.572435 
1 1 1   16    5   12 o  122.314   2.3861  312.645   11.859  281.616   17.833  337.247   15.879  116.794   3.7019  127.834   3.0117 -11.04007 4.772266 
1 1 1   16    5   13 o  250.881   2.7673  1297.17   28.585  1341.13   41.921  1258.97   39.079  254.839   3.9884  246.923   3.8372 7.916824 5.534595 
1 1 1   16    5   14 o   88.184   3.9782  160.624   14.469  160.624   14.469   0.0000   0.0000   88.184   3.9782  ?   ?       ?      ? 
1 1 1   16    5   15 o  333.059   3.2677  2293.06   44.886  2306.45   63.300  2279.52   63.657  334.041   4.5945  332.077   4.6477 1.964203 6.535363 
1 1 1   16    5   16 o   97.058   3.2979  194.698   13.197  201.808   18.789  187.774   18.541   98.809   4.6104   95.307   4.7168 3.502670 6.595761 
1 1 1   16    5   17 o   71.457   4.0174  105.807   11.741  124.193   16.897   88.643   16.326   77.483   5.2873   65.430   6.0499 12.05364 8.034728 
1 1 1   16    5   18 o  272.786   2.8054  1538.26   31.256  1532.17   47.592  1542.88   41.447  272.273   4.2380  273.298   3.6770 -1.024689 5.610831 
1 1 1   16    5   19 o   58.564   3.8354   70.736   9.1395   72.606   14.217   69.419   11.932   59.204   5.8221   57.924   4.9944 1.279755 7.670818 
1 1 1   16    5   20 f   83.407   3.3439  145.042   11.226  138.450   17.729  149.454   14.503   81.783   5.2561   85.031   4.1353 -3.248802 6.687879 
1 1 1   16    5   21 o  129.480   2.8605  344.325   14.761  355.257   24.402  338.016   18.538  131.052   4.5146  127.909   3.5139 3.142990 5.720955 
1 1 1   16    5   22 o   78.126   3.1649  126.525   10.174  121.236   14.708  131.378   14.087   76.547   4.6587   79.705   4.2852 -3.157677 6.329818 
1 1 1   16    5   23 o   47.739   4.6321   46.823   9.0407   38.932   12.173   56.529   13.501   43.287   6.8181   52.190   6.2721 -8.902950 9.264194 
1 1 1   16    5   24 o   33.985   7.8316   23.515   12.592   23.385   17.382   23.658   18.268   33.799   10.932   34.171   11.217 -0.3710403 15.66325 
1 1 1   16    5   25 o  142.831   2.5340  421.671   14.926  430.426   21.182  413.037   21.036  144.306   3.5590  141.356   3.6081 2.949509 5.067991 
1 1 1   16    5   26 o   78.590   4.2779  136.026   12.759  152.383   15.871  106.147   21.451   85.797   4.4852   71.384   7.2859 14.41245 8.555791 
1 1 1   16    5   27 o   80.940   3.3365  135.863   11.131  139.576   15.602  132.015   15.884   82.076   4.6090   79.804   4.8257 2.272141 6.673088 
1 1 1   16    5   28 f   91.874   4.3900  176.469   16.535  198.416   23.376  154.493   23.392   97.670   5.8030   86.078   6.5889 11.59210 8.779999 
1 1 1   16    5   29 o  111.068   3.5684  261.087   15.352  241.835   26.226  271.122   18.934  107.744   5.9016  114.392   4.0132 -6.647888 7.136880 
1 1 1   16    5   30 o  193.529   5.3551  779.993   42.744   0.0000   0.0000  779.993   42.744  ?   ?   193.529   5.3551      ?      ? 
1 1 1   16    5   31 o   44.264   5.0809   42.115   8.9894   36.390   12.754   47.768   12.673   40.825   7.8597   47.703   6.4409 -6.878662 10.16170 
1 1 1   16    5   32 o   64.742   3.8484   88.652   10.099   69.901   14.251  107.568   14.314   57.691   5.9893   71.793   4.8341 -14.10222 7.696797 
1 1 1   16    5   33 o   46.735   5.3229   47.983   9.8212   53.606   13.274   41.181   14.599   50.377   6.3886   43.092   8.5159 7.284985 10.64586 
1 1 1   16    5   34 o   81.133   3.3369  137.693   11.164  137.724   15.641  137.662   15.940   81.154   4.6730   81.113   4.7647 0.4048920E-01 6.673775 
1 1 1   16    5   35 o   42.031   6.9884   36.798   10.648   32.627   12.242   49.755   21.577   38.151   8.0340   45.911   11.437 -7.759777 13.97684 
1 1 1   16    5   36 o   56.289   4.2561   67.343   9.8781   65.146   13.852   69.616   14.090   55.341   6.0689   57.237   5.9686 -1.895618 8.512106 
1 1 1   16    5   37 o   85.618   3.2707  153.965   11.514  138.383   16.043  170.521   16.536   81.092   4.7966   90.144   4.4476 -9.051941 6.541328 
1 1 1   16    5   38 o   29.008   8.3728   11.997   15.822   8.6833   21.530   15.888   23.331   27.472   11.448   30.544   12.221 -3.071726 16.74560 
1 1 1   16    5   39 o   32.773   7.6580   21.792   10.680   17.927   12.247   34.064   21.821   28.232   9.1801   37.314   12.260 -9.082123 15.31598 
1 1 1   16    5   40 o   81.131   4.7821  153.063   13.960  166.475   16.677  121.672   25.514   88.684   4.5595   73.578   8.4073 15.10596 9.564130 
1 1 1   16    5   41 o   23.738   6.9695   7.8053   10.580   11.344   12.012  -4.4352   22.340   23.987   8.9884   23.488   10.654 0.4984913 13.93901 
1 1 1   16    5   42 o   23.197   7.0798   0.5510   9.7926  -3.4696   10.847   18.265   22.768   16.601   7.4865   29.792   12.019 -13.19105 14.15957 
1 1 1   16    5   43 o   20.241   6.4052  -0.2194   10.391   5.9197   11.453 -28.7864   24.706   20.654   8.4527   19.828   9.6260 0.8260288 12.81040 
1 1 1   16    5   44 o   30.689   6.0380   25.119   12.072   44.001   13.534 -48.3343   26.694   43.027   7.9184   18.351   9.1176 24.67579 12.07610 
1 1 1   16    5   45 o   38.442   9.5035   43.777   22.335   4.7608   32.193   79.988   31.014   27.122   12.484   49.762   14.332 -22.63961 19.00699 
1 1 1   16    5   46 o   26.745   9.0616  -2.4006   26.422  -9.3848   51.565   0.0860   30.768   28.099   13.701   25.390   11.863 2.709194 18.12325 
1 1 1   16    5   47 o   22.638   10.848 -11.2318   29.006   0.0000   0.0000 -11.2318   29.006  ?   ?    22.638   10.848      ?      ? 
1 1 1   16    6    0 o   95.018   2.5515  187.055   14.095  187.055   14.095  187.055   14.095   95.018   3.6084   95.018   3.6084 0.000000 0.000000 
1 1 1   16    6    1 o  135.021   2.4011  376.144   13.371  380.750   19.036  371.659   18.784  135.837   3.3978  134.205   3.3936 1.631287 4.802219 
1 1 1   16    6    2 o   42.946   3.6377   37.633   6.3700   35.266   8.3002   41.024   9.9359   41.327   4.8696   44.566   5.4056 -3.239067 7.275491 
1 1 1   16    6    3 o  309.486   2.8380  1981.92   36.027  2028.16   48.797  1926.50   53.416  313.480   3.7741  305.491   4.2395 7.989105 5.676001 
1 1 1   16    6    4 o   67.082   2.7399   93.111   7.4655   94.244   9.7768   91.528   11.562   67.578   3.5077   66.587   4.2099 0.9912949 5.479756 
1 1 1   16    6    5 o  136.706   2.3991  385.172   13.518  402.657   19.512  369.031   18.747  139.686   3.3868  133.725   3.3990 5.960144 4.798236 
1 1 1   16    6    6 o  190.159   2.1620  745.816   16.953  760.856   24.302  731.561   23.660  192.025   3.0685  188.293   3.0466 3.732162 4.324051 
1 1 1   16    6    7 o  286.810   2.5301  1697.74   29.929  1697.74   42.268  1697.73   42.384  286.810   3.5732  286.809   3.5830 0.1342773E-02 5.060196 
1 1 1   16    6    8 o  124.262   2.1153  318.247   10.835  333.327   15.609  304.227   15.051  127.099   2.9777  121.424   3.0053 5.675369 4.230657 
1 1 1   16    6    9 o   79.628   2.5491  130.870   8.3337  130.830   11.260  130.919   12.392   79.618   3.4291   79.638   3.7727 -0.2048492E-01 5.098218 
1 1 1   16    6   10 o  386.520   3.2831  3083.62   51.721  3071.54   68.055  3100.15   79.579  385.671   4.2783  387.370   4.9809 -1.699188 6.566101 
1 1 1   16    6   11 o  152.816   2.2734  481.749   14.215  483.797   21.521  480.164   18.933  153.096   3.4082  152.535   3.0094 0.5605469 4.546703 
1 1 1   16    6   12 o  385.457   3.2585  3076.14   51.623  2979.30   75.540  3160.98   70.710  379.720   4.8233  391.194   4.3825 -11.47354 6.516986 
1 1 1   16    6   13 o  270.707   2.5824  1517.87   28.148  1491.14   44.769  1535.35   36.197  268.691   4.0398  272.722   3.2180 -4.031036 5.164819 
1 1 1   16    6   14 o  119.544   3.5054  296.548   17.209  309.872   23.609  281.445   25.136  122.436   4.6752  116.651   5.2244 5.785164 7.010891 
1 1 1   16    6   15 o  184.363   2.7245  703.340   20.657  766.001   29.244  640.941   29.183  192.586   3.6817  176.140   4.0170 16.44606 5.449017 
1 1 1   16    6   16 o  104.688   2.6099  227.222   11.223  213.049   16.284  240.046   15.490  101.558   3.8875  107.818   3.4832 -6.260269 5.219736 
1 1 1   16    6   17 o  325.329   3.0794  2167.35   40.285  2275.69   65.328  2100.87   51.172  331.758   4.7744  318.900   3.8905 12.85776 6.158805 
1 1 1   16    6   18 o   80.796   3.0755  135.822   10.125  128.819   15.343  141.224   13.475   78.922   4.7134   82.670   3.9520 -3.747864 6.150964 
1 1 1   16    6   19 o  282.987   4.2120  1655.34   49.161   0.0000   0.0000  1655.34   49.161  ?   ?   282.987   4.2120      ?      ? 
1 1 1   16    6   20 o  253.682   2.8540  1329.54   29.851  1354.68   42.914  1305.98   41.551  255.999   4.0644  251.364   4.0079 4.634689 5.708094 
1 1 1   16    6   21 o  145.200   2.4743  435.539   14.817  439.559   21.100  431.628   20.812  145.861   3.5073  144.540   3.4910 1.320557 4.948567 
1 1 1   16    6   22 o  167.562   2.5213  577.658   17.327  602.895   26.138  557.875   23.143  170.799   3.7104  164.325   3.4146 6.473801 5.042519 
1 1 1   16    6   23 f   72.250   3.5840  109.022   10.524  114.270   13.954  102.100   16.027   74.313   4.5527   70.187   5.5364 4.125557 7.167922 
1 1 1   16    6   24 o  172.219   2.9306  603.782   19.869  582.300   24.465  645.410   34.056  167.858   3.5337  176.579   4.6762 -8.721054 5.861207 
1 1 1   16    6   25 o   99.438   2.9189  204.453   11.961  216.301   17.110  193.128   16.728  102.260   4.0567   96.617   4.1979 5.643227 5.837743 
1 1 1   16    6   26 o  164.905   3.4418  578.373   22.122  613.902   27.640  515.055   36.899  172.278   3.8900  157.533   5.6792 14.74515 6.883678 
1 1 1   16    6   27 o  138.512   2.6426  396.924   15.095  396.437   21.158  397.428   21.541  138.429   3.7058  138.595   3.7684 -0.1654816 5.285255 
1 1 1   16    6   28 o  124.851   2.7999  322.647   14.414  315.074   20.116  330.639   20.665  123.347   3.9540  126.355   3.9654 -3.008385 5.599869 
1 1 1   16    6   29 o   67.902   4.6243   92.102   11.943  107.187   22.280   86.020   14.146   71.491   7.5562   64.314   5.3330 7.176804 9.248615 
1 1 1   16    6   30 o  100.417   3.5690  214.143   14.228  192.990   22.856  227.527   18.180   96.142   5.7639  104.691   4.2104 -8.549446 7.137962 
1 1 1   16    6   31 o   21.497   5.8311   4.3355   7.9961  -5.5902   11.548   13.478   11.083   17.104   7.7179   25.891   8.7430 -8.786293 11.66215 
1 1 1   16    6   32 f   47.356   4.7339   47.353   9.2212   52.066   13.217   42.882   12.872   49.692   6.4487   45.020   6.9322 4.671875 9.467855 
1 1 1   16    6   33 o   92.680   3.1625  179.308   12.082  172.688   17.095  185.916   17.078   90.949   4.5574   94.411   4.3859 -3.461777 6.325016 
1 1 1   16    6   34 o   49.183   4.9251   50.633   9.8933   44.633   12.946   59.057   15.340   45.770   6.8576   52.596   7.0712 -6.825939 9.850288 
1 1 1   16    6   35 o   21.171   6.6213   0.3059   9.8348   4.7075   10.723 -22.9986   24.675   20.409   8.2429   21.932   10.364 -1.522781 13.24254 
1 1 1   16    6   36 o   93.182   4.7317  185.171   18.143  169.560   24.838  203.028   26.565   88.948   6.7705   97.416   6.6117 -8.468407 9.463304 
1 1 1   16    6   37 o   27.598   6.3758   16.821   10.253   27.253   11.537 -22.3773   22.365   34.630   8.2036   20.566   9.7623 14.06447 12.75154 
1 1 1   16    6   38 o   45.258   9.5429   50.979   19.034   60.053   29.225   44.295   25.084   48.373   13.907   42.143   13.071 6.230553 19.08580 
1 1 1   16    6   39 o   62.414   6.0911   96.079   13.178  109.493   16.036   68.182   23.126   71.629   5.4280   53.198   10.906 18.43053 12.18227 
1 1 1   16    6   40 o   68.483   5.4884  114.043   13.221  127.770   15.830   82.381   24.041   77.455   4.9552   59.512   9.7946 17.94337 10.97672 
1 1 1   16    6   41 o   34.906   7.5129   31.348   11.328   33.935   12.945   22.887   23.409   37.921   8.4882   31.891   12.399 6.029871 15.02586 
1 1 1   16    6   42 o   71.500   9.3280  124.662   15.797  121.551   16.621  153.722   50.795   74.904   5.3802   68.095   17.863 6.808434 18.65598 
1 1 1   16    6   43 o   27.818   7.7717   16.040   11.502   16.048   12.842   16.007   25.856   26.371   9.3832   29.265   12.392 -2.893890 15.54339 
1 1 1   16    6   44 o   51.607   7.2489   66.676   12.925   65.548   14.809   70.284   26.479   53.871   6.6652   49.343   12.875 4.528294 14.49786 
1 1 1   16    6   45 o   23.117   7.8355 -17.7083   21.443  -9.1947   30.794 -25.7231   29.878   24.409   11.548   21.825   10.593 2.584089 15.67091 
1 1 1   16    6   46 o   26.643   8.7673   0.7487   25.442 -55.7921   47.736   23.183   30.069   23.609   11.802   29.678   12.968 -6.069601 17.53461 
1 1 1   16    6   47 o   49.312   14.762   88.886   32.370   0.0000   0.0000   88.886   32.370  ?   ?    49.312   14.762      ?      ? 
1 1 1   16    7    0 o   94.850   2.5669  186.415   14.154  186.415   14.154  186.415   14.154   94.850   3.6302   94.850   3.6302 0.000000 0.000000 
1 1 1   16    7    1 o   33.114   5.0285   23.712   6.6667   26.818   9.2629   20.373   9.6024   35.454   6.5768   30.774   7.6084 4.679516 10.05693 
1 1 1   16    7    2 o  256.132   2.5803  1353.35   26.953  1349.90   35.535  1358.02   41.358  255.763   3.3686  256.501   3.9094 -0.7380981 5.160511 
1 1 1   16    7    3 o  351.995   3.0752  2556.86   44.142  2550.32   58.185  2565.73   67.753  351.495   4.0135  352.495   4.6603 -1.000793 6.150315 
1 1 1   16    7    4 o  120.914   2.2604  300.980   11.125  297.392   14.556  306.018   17.250  120.055   2.9397  121.772   3.4345 -1.716927 4.520793 
1 1 1   16    7    5 o  353.940   3.0852  2587.66   44.599  2595.08   59.136  2577.88   67.915  354.557   4.0439  353.322   4.6605 1.235535 6.170370 
1 1 1   16    7    6 o  337.530   3.0000  2346.94   41.188  2321.55   53.814  2382.85   63.996  335.362   3.8906  339.699   4.5676 -4.337646 6.000017 
1 1 1   16    7    7 o  230.592   2.8174  1090.08   25.065  1119.08   44.365  1076.49   30.379  232.787   4.6207  228.396   3.2249 4.390823 5.634811 
1 1 1   16    7    8 o  137.391   2.1164  389.540   11.991  382.156   16.951  396.938   16.966  136.087   3.0200  138.695   2.9659 -2.608521 4.232866 
1 1 1   16    7    9 o  113.007   2.1549  263.483   10.041  271.599   14.303  255.596   14.101  114.723   3.0228  111.290   3.0720 3.432175 4.309792 
1 1 1   16    7   10 o  182.404   2.1682  686.575   16.311  678.369   22.946  694.957   23.190  181.302   3.0686  183.506   3.0640 -2.203506 4.336357 
1 1 1   16    7   11 o  203.212   2.4234  856.067   20.154  820.311   30.087  885.169   27.143  199.333   3.6596  207.092   3.1778 -7.758591 4.846747 
1 1 1   16    7   12 o  301.495   3.0987  1898.76   35.601  1822.76   63.386  1933.78   43.028  296.933   5.1757  306.057   3.4087 -9.123535 6.197332 
1 1 1   16    7   13 o  148.605   3.1256  452.114   18.872  352.722   25.462  573.273   28.113  130.628   4.7261  166.582   4.0917 -35.95433 6.251246 
1 1 1   16    7   14 o   39.645   6.1185   35.768   9.2750   40.074   11.184   26.288   16.597   43.990   6.1644   35.299   10.571 8.690845 12.23707 
1 1 1   16    7   15 o  165.906   2.3067  571.873   15.466  549.609   24.190  587.264   20.113  163.137   3.5952  168.675   2.8911 -5.537857 4.613471 
1 1 1   16    7   16 o   38.716   4.8183   31.639   7.5010   35.186   10.676   28.179   10.542   41.216   6.2800   36.217   7.3093 4.999409 9.636607 
1 1 1   16    7   17 o  115.062   2.8335  272.366   13.075  278.647   21.235  268.530   16.593  116.100   4.4347  114.023   3.5283 2.076210 5.667061 
1 1 1   16    7   18 o  201.678   2.4034  840.045   19.991  844.079   28.366  836.063   28.178  202.158   3.4021  201.197   3.3957 0.9616852 4.806758 
1 1 1   16    7   19 o  170.314   3.6438  599.263   25.596   0.0000   0.0000  599.263   25.596  ?   ?   170.314   3.6438      ?      ? 
1 1 1   16    7   20 o  334.600   2.8756  2314.44   39.685  2322.41   56.281  2306.56   55.965  335.172   4.0713  334.028   4.0623 1.143646 5.751282 
1 1 1   16    7   21 o  228.120   2.9743  1076.04   27.983  1076.76   39.769  1075.33   39.381  228.193   4.2255  228.047   4.1870 0.1464233 5.948589 
1 1 1   16    7   22 o  241.300   2.5446  1202.62   25.312  1221.54   36.499  1185.09   35.132  243.122   3.6399  239.479   3.5569 3.643311 5.089276 
1 1 1   16    7   23 o  210.285   2.6147  912.786   22.564  925.511   33.749  902.500   30.341  211.587   3.8673  208.984   3.5201 2.602737 5.229484 
1 1 1   16    7   24 o   75.840   3.5677  119.764   11.008  123.176   14.543  115.188   16.844   77.142   4.5709   74.538   5.4791 2.603493 7.135408 
1 1 1   16    7   25 o  193.465   2.5143  773.587   20.060  780.056   28.606  767.328   28.139  194.258   3.5703  192.671   3.5410 1.587524 5.028526 
1 1 1   16    7   26 o  144.304   3.4893  438.614   18.766  448.412   22.343  415.154   34.574  147.248   3.6790  141.360   5.9301 5.888199 6.978625 
1 1 1   16    7   27 o   55.133   4.2493   64.161   9.4308   80.396   13.373   48.102   13.301   62.233   5.2103   48.033   6.7140 14.19963 8.498535 
1 1 1   16    7   28 o  106.394   2.9446  234.745   12.909  223.279   18.276  246.160   18.236  103.786   4.2696  109.002   4.0564 -5.215393 5.889268 
1 1 1   16    7   29 o   65.631   6.6843   85.041   12.866  104.192   33.340   81.690   13.946   68.606   12.231   62.655   5.3968 5.950806 13.36863 
1 1 1   16    7   30 o  131.885   2.7684  360.925   15.058  356.337   21.236  365.565   21.355  131.039   3.9292  132.730   3.9009 -1.691864 5.536775 
1 1 1   16    7   31 o   72.206   3.6638  108.910   10.871  108.636   16.064  109.140   14.766   72.082   5.4032   72.329   4.9497 -0.2465286 7.327634 
1 1 1   16    7   32 o  101.692   3.0418  215.516   12.757  217.825   18.043  213.209   18.040  102.242   4.2788  101.141   4.3245 1.100410 6.083558 
1 1 1   16    7   33 o   81.043   3.4213  137.233   11.429  139.919   16.500  134.756   15.846   81.792   4.8912   80.293   4.7851 1.499031 6.842564 
1 1 1   16    7   34 o   38.428   5.7848   32.267   9.0971   23.649   12.342   42.520   13.461   32.357   8.9477   44.500   7.3343 -12.14309 11.56954 
1 1 1   16    7   35 o   28.469   7.6434   14.888   10.845   16.131   12.079   9.7183   24.637   27.453   9.1262   29.484   12.264 -2.031126 15.28671 
1 1 1   16    7   36 o   23.956   6.2394   10.454   8.1394   8.5202   11.232   12.592   11.812   22.678   8.6473   25.235   8.9968 -2.557198 12.47876 
1 1 1   16    7   37 o   60.715   5.4722   81.527   11.919   82.672   13.899   78.344   23.172   62.411   5.3996   59.018   9.5196 3.393616 10.94432 
1 1 1   16    7   38 o   46.718   9.3490   54.168   18.719   64.891   28.808   46.332   24.626   50.416   13.559   43.021   12.875 7.394890 18.69801 
1 1 1   16    7   39 o   42.699   7.2166   39.250   11.505   33.100   13.452   55.999   22.199   37.685   8.8123   47.713   11.431 -10.02772 14.43313 
1 1 1   16    7   40 o   30.915   6.9048   24.365   10.639   31.079   12.277   4.1206   21.317   36.461   8.3441   25.368   11.004 11.09293 13.80954 
1 1 1   16    7   41 o   41.876   7.2647   44.696   11.880   47.376   13.913   37.481   22.829   46.043   7.3265   37.709   12.547 8.334019 14.52938 
1 1 1   16    7   42 o   28.457   8.2534   17.030   12.156   20.134   12.529 -32.6971   50.150   28.828   9.2773   28.086   13.653 0.7419567 16.50681 
1 1 1   16    7   43 o   35.192   7.7006   35.202   12.595   40.105   14.136   16.327   27.738   40.674   8.6903   29.711   12.715 10.96312 15.40130 
1 1 1   16    7   44 o   27.238   7.9577   15.687   13.147   18.058   14.502   4.7467   31.151   27.269   9.9362   27.207   12.433 0.6200600E-01 15.91537 
1 1 1   16    7   45 o   34.513   10.027   38.203   23.188   29.617   33.401   46.190   32.216   32.262   13.884   36.764   14.472 -4.502014 20.05470 
1 1 1   16    7   46 o   22.968   8.1036 -39.5560   24.879  -2.0731   46.469 -54.6175   29.456   27.648   13.370   18.288   9.1613 9.360430 16.20722 
1 1 1   16    7   47 o   25.625   8.8432 -10.0550   24.161   25.929   50.456 -20.7605   27.521   30.418   14.503   20.831   10.123 9.587790 17.68635 
1 1 1   16    8    0 o   29.301   6.2078   21.901   9.2428   21.901   9.2428   21.901   9.2428   29.301   8.7792   29.301   8.7792 0.000000 0.000000 
1 1 1   16    8    1 o  201.843   2.5295  839.491   21.039  808.596   29.025  873.698   30.541  197.937   3.5553  205.749   3.5990 -7.812027 5.058970 
1 1 1   16    8    2 o  146.528   2.3991  442.924   14.496  433.789   20.269  452.488   20.740  144.983   3.3897  148.074   3.3960 -3.091568 4.798224 
1 1 1   16    8    3 o  349.739   3.2704  2525.84   47.174  2528.06   66.723  2523.62   66.705  349.893   4.6236  349.585   4.6264 0.3076782 6.540709 
1 1 1   16    8    4 f   95.626   2.3823  189.312   9.2981  193.113   12.361  184.360   14.111   96.740   3.0980   94.511   3.6200 2.228363 4.764674 
1 1 1   16    8    5 o  320.705   2.9102  2120.13   38.007  2103.17   49.841  2143.69   58.753  319.203   3.7858  322.208   4.4211 -3.004944 5.820457 
1 1 1   16    8    6 o  210.554   2.3976  915.372   20.615  917.959   27.322  911.953   31.412  210.911   3.1409  210.196   3.6233 0.7143402 4.795118 
1 1 1   16    8    7 o  159.589   2.1137  525.120   13.907  509.847   19.330  541.509   20.023  157.186   2.9817  161.993   2.9969 -4.806686 4.227496 
1 1 1   16    8    8 f  215.660   2.4317  956.205   21.330  982.283   33.236  937.943   27.814  218.135   3.6942  213.184   3.1633 4.950668 4.863482 
1 1 1   16    8    9 o  213.764   2.4431  934.042   21.124  988.966   33.730  898.597   27.096  218.867   3.7365  208.662   3.1485 10.20552 4.886169 
1 1 1   16    8   10 o  147.345   2.3037  447.985   13.822  447.267   18.152  448.977   21.325  147.215   2.9895  147.476   3.5060 -0.2604218 4.607483 
1 1 1   16    8   11 o  169.370   2.1449  591.979   14.981  586.764   20.962  597.424   21.417  168.609   3.0143  170.132   3.0522 -1.522858 4.289747 
1 1 1   16    8   12 o   75.771   2.6759  115.851   8.1460  130.322   13.409  107.386   10.256   79.425   4.0932   72.116   3.4479 7.308891 5.351848 
1 1 1   16    8   13 o  212.712   2.6099  929.893   22.840  864.084   31.037  1007.63   33.732  204.544   3.6790  220.879   3.7028 -16.33492 5.219719 
1 1 1   16    8   14 o   78.762   2.9058  127.726   9.4098  142.938   13.714  114.193   12.935   83.182   3.9974   74.341   4.2186 8.840370 5.811687 
1 1 1   16    8   15 o  203.448   2.3600  854.313   19.251  855.943   31.130  853.303   24.496  203.576   3.7075  203.320   2.9212 0.2560120 4.720030 
1 1 1   16    8   16 o  162.383   2.4479  544.904   16.340  540.143   24.060  548.981   22.260  161.715   3.6073  163.052   3.3101 -1.337601 4.895887 
1 1 1   16    8   17 o  203.915   2.8481  857.935   23.932  893.950   34.736  825.390   33.020  207.980   4.0494  199.850   4.0060 8.129761 5.696125 
1 1 1   16    8   18 o  256.889   3.2231  1360.76   31.636  1375.01   56.789  1354.35   38.095  257.729   5.3424  256.049   3.6073 1.680389 6.446232 
1 1 1   16    8   19 o  356.656   3.4042  2622.59   49.866  2730.26   74.586  2535.56   67.057  363.211   4.9789  350.102   4.6439 13.10855 6.808451 
1 1 1   16    8   20 o  148.396   2.4154  453.037   14.752  487.474   21.714  423.514   20.105  153.611   3.4273  143.182   3.4044 10.42995 4.830775 
1 1 1   16    8   21 o  416.339   3.2956  3586.56   56.586  3603.87   80.587  3569.72   79.475  417.324   4.6820  415.355   4.6392 1.968719 6.591128 
1 1 1   16    8   22 o  123.230   2.6051  314.040   13.231  301.363   18.754  326.604   18.670  120.746   3.7657  125.714   3.6008 -4.967468 5.210268 
1 1 1   16    8   23 o  282.392   3.0255  1649.45   35.236  1664.34   50.192  1634.99   49.477  283.645   4.2904  281.138   4.2669 2.507446 6.050951 
1 1 1   16    8   24 o  128.308   2.8435  344.152   14.790  363.310   19.536  318.430   22.636  132.576   3.5727  124.040   4.4246 8.535683 5.686952 
1 1 1   16    8   25 o  242.487   2.8037  1216.83   27.802  1220.52   37.016  1212.06   42.111  242.957   3.6940  242.016   4.2187 0.9409180 5.607433 
1 1 1   16    8   26 o   80.553   3.3506  134.440   11.130  131.309   15.560  137.720   15.926   79.594   4.7398   81.513   4.7371 -1.919937 6.701176 
1 1 1   16    8   27 o  150.606   3.0475  476.073   18.396  442.542   29.149  498.271   23.716  146.048   4.8390  155.165   3.7058 -9.117081 6.095005 
1 1 1   16    8   28 o   93.639   3.0556  181.818   11.784  169.240   16.527  194.826   16.807   90.331   4.4359   96.947   4.2034 -6.616051 6.111166 
1 1 1   16    8   29 o  100.451   4.6415  200.661   15.870  230.324   35.049  193.011   17.799  104.492   8.1325   96.410   4.4762 8.082130 9.283049 
1 1 1   16    8   30 o   92.410   3.8697  184.561   13.932  200.443   17.550  157.493   22.911   98.193   4.3334   86.627   6.4125 11.56571 7.739455 
1 1 1   16    8   31 o   71.752   3.6159  106.528   10.647  119.272   16.044   96.499   14.233   75.543   5.1495   67.962   5.0776 7.581123 7.231843 
1 1 1   16    8   32 o   41.579   5.2756   37.555   8.8072   35.291   12.861   39.554   12.086   39.947   8.0833   43.211   6.7814 -3.264103 10.55116 
1 1 1   16    8   33 o   88.639   3.2534  164.264   11.868  162.694   17.312  165.657   16.302   88.198   4.7592   89.079   4.4372 -0.8810806 6.506776 
1 1 1   16    8   34 o   22.309   5.7662   3.0709   8.6165   19.212   11.863 -14.9521   12.536   29.393   8.9678   15.226   7.2507 14.16710 11.53234 
1 1 1   16    8   35 o   34.427   6.4188   30.676   11.051   42.799   12.842  -3.9294   21.698   44.644   6.9745   24.211   10.778 20.43266 12.83757 
1 1 1   16    8   36 o   33.021   7.4502   24.893   10.587   26.494   12.011   19.315   22.417   34.141   8.5488   31.901   12.204 2.239340 14.90043 
1 1 1   16    8   37 o   26.807   7.1021   14.074   10.553   18.477   12.193   0.9264   21.070   28.706   9.1430   24.909   10.870 3.796846 14.20423 
1 1 1   16    8   38 o   73.058   5.5350  119.514   16.343  137.718   22.394   98.768   23.906   79.678   6.8143   66.437   8.7242 13.24115 11.07008 
1 1 1   16    8   39 o   62.653   5.9303   95.455   12.630  104.559   14.998   73.254   23.421   70.057   5.1906   55.248   10.664 14.80917 11.86056 
1 1 1   16    8   40 o   25.745   7.4004   7.0169   10.601   2.5838   12.046   22.244   22.325   19.877   8.4397   31.613   12.159 -11.73617 14.80080 
1 1 1   16    8   41 o   76.507   4.7367  128.747   13.650  127.872   16.312  130.791   24.930   77.138   5.1272   75.877   7.9660 1.260880 9.473397 
1 1 1   16    8   42 o   29.957   8.6349   19.690   12.958   21.777   13.447  -7.4820   48.515   29.721   9.6157   30.192   14.345 -0.4708691 17.26987 
1 1 1   16    8   43 o   32.821   8.0398   28.184   12.197   29.552   13.484   22.028   28.606   34.379   9.2895   31.263   13.125 3.115694 16.07955 
1 1 1   16    8   44 o   48.826   8.0285   76.058   15.074   84.376   16.984   45.192   32.718   60.803   6.7726   36.849   14.559 23.95411 16.05709 
1 1 1   16    8   45 o   30.065   8.6368  -5.9385   21.740   63.839   31.812 -67.0826   29.779   42.430   14.796   17.701   8.9133 24.72985 17.27361 
1 1 1   16    8   46 o   33.905   10.491   40.353   24.967   66.128   51.643   32.492   28.522   36.200   16.329   31.610   13.175 4.590471 20.98157 
1 1 1   16    9    0 o  280.313   2.8868  1622.31   47.177  1622.31   47.177  1622.31   47.177  280.313   4.0826  280.313   4.0826 0.000000 0.000000 
1 1 1   16    9    1 o  316.888   3.0842  2073.24   40.308  2088.56   57.413  2058.36   56.603  318.040   4.3769  315.736   4.3466 2.304779 6.168493 
1 1 1   16    9    2 o  170.932   2.6101  603.590   17.312  604.582   21.167  601.585   30.085  171.171   2.9983  170.694   4.2734 0.4773254 5.220276 
1 1 1   16    9    3 o  181.977   2.7727  683.875   20.352  684.815   26.187  682.443   32.340  182.155   3.4856  181.799   4.3131 0.3553467 5.545458 
1 1 1   16    9    4 f  249.888   3.0673  1290.65   30.986  1283.21   48.866  1295.64   40.071  249.253   4.7534  250.523   3.8781 -1.270187 6.134699 
1 1 1   16    9    5 o  264.556   3.1541  1444.96   33.688  1443.16   43.398  1447.70   53.438  264.388   3.9798  264.725   4.8943 -0.3373413 6.308192 
1 1 1   16    9    6 o  136.357   2.6045  384.585   13.741  386.031   16.764  381.622   23.987  136.773   2.9717  135.941   4.2781 0.8317719 5.208991 
1 1 1   16    9    7 o   26.515   5.3207   14.515   6.0756   11.829   8.0026   18.171   9.3349   23.932   7.3766   29.097   7.6699 -5.164692 10.64147 
1 1 1   16    9    8 o   94.163   2.5035  187.848   9.4687  152.691   14.182  216.125   12.719   85.992   3.9986  102.335   3.0134 -16.34331 5.006983 
1 1 1   16    9    9 o  382.199   3.0120  3017.06   47.478  3006.70   66.824  3027.61   67.470  381.539   4.2465  382.859   4.2727 -1.320435 6.023999 
1 1 1   16    9   10 o  141.471   2.0917  412.700   12.199  396.802   16.975  429.680   17.543  138.655   2.9684  144.286   2.9479 -5.630844 4.183445 
1 1 1   16    9   11 o  163.643   2.3043  547.073   15.262  582.123   24.343  524.371   19.591  167.901   3.5153  159.385   2.9802 8.516708 4.608563 
1 1 1   16    9   12 o  211.086   2.4639  920.048   21.293  920.513   32.120  919.683   28.441  211.117   3.6888  211.055   3.2673 0.6124878E-01 4.927746 
1 1 1   16    9   13 o  172.290   2.5837  612.664   18.336  605.906   25.241  620.215   26.682  171.290   3.5729  173.290   3.7331 -1.999649 5.167365 
1 1 1   16    9   14 o  255.617   2.6754  1348.34   28.027  1360.41   42.163  1338.79   37.516  256.619   3.9836  254.615   3.5725 2.004013 5.350872 
1 1 1   16    9   15 o  105.940   2.9585  249.732   11.467  191.108   20.445  276.636   13.850   96.116   5.1573  115.764   2.9008 -19.64751 5.917100 
1 1 1   16    9   16 o  168.190   2.4364  584.113   16.834  585.823   24.963  582.687   22.797  168.404   3.5940  167.975   3.2905 0.4285889 4.872804 
1 1 1   16    9   17 o  207.480   2.6490  894.685   22.461  844.883   33.577  935.016   30.216  202.193   4.0264  212.766   3.4433 -10.57286 5.297939 
1 1 1   16    9   18 o   94.592   3.7112  179.964   12.917  196.924   25.191  173.914   15.045   97.452   6.2673   91.731   3.9767 5.720413 7.422483 
1 1 1   16    9   19 o  145.622   2.4686  438.798   14.786  477.306   20.952  400.587   20.871  152.008   3.3419  139.236   3.6343 12.77238 4.937219 
1 1 1   16    9   20 o   79.772   3.1600  131.361   10.323  133.883   15.621  129.405   13.755   80.437   4.7086   79.107   4.2157 1.330070 6.320042 
1 1 1   16    9   21 o  189.074   2.4372  738.645   19.005  731.453   26.864  745.850   26.891  188.150   3.4618  189.996   3.4316 -1.845840 4.874380 
1 1 1   16    9   22 o  111.246   3.1114  261.055   13.769  235.433   22.032  277.475   17.638  106.627   5.0099  115.866   3.6909 -9.239159 6.222707 
1 1 1   16    9   23 o  246.126   2.7388  1252.04   27.659  1258.07   41.314  1247.15   37.234  246.630   4.0615  245.622   3.6754 1.007523 5.477622 
1 1 1   16    9   24 o  189.273   3.5278  749.831   25.535  763.107   30.953  721.547   45.181  192.091   3.9069  186.454   5.8751 5.637329 7.055537 
1 1 1   16    9   25 o  114.075   6.9392  278.448   17.562  279.364   18.322  268.096   61.596  116.212   3.8226  111.939   13.342 4.273026 13.87845 
1 1 1   16    9   26 o  211.512   2.5752  925.206   22.461  907.768   31.405  943.467   32.137  209.473   3.6350  213.550   3.6487 -4.076553 5.150407 
1 1 1   16    9   27 o  122.646   2.7657  311.539   13.989  313.409   19.726  309.646   19.842  123.020   3.8878  122.272   3.9345 0.7471390 5.531322 
1 1 1   16    9   28 o   83.435   4.7165  145.599   16.218  142.214   23.217  148.825   22.665   82.461   6.8264   84.409   6.5102 -1.948380 9.433027 
1 1 1   16    9   29 o   78.613   3.6976  132.131   11.674  107.395   17.464  152.111   15.696   71.675   5.9077   85.552   4.4484 -13.87749 7.395228 
1 1 1   16    9   30 o  135.331   3.6247  382.102   20.222  399.477   28.867  365.360   28.336  138.373   5.0580  132.290   5.1933 6.082138 7.249427 
1 1 1   16    9   31 o  133.804   3.4969  376.890   19.141  422.053   26.695  329.099   27.461  142.251   4.5500  125.357   5.3113 16.89367 6.993793 
1 1 1   16    9   32 o  108.748   2.9226  245.790   13.089  256.515   19.155  236.394   17.928  110.955   4.1858  106.542   4.0799 4.413094 5.845187 
1 1 1   16    9   33 o   27.376   6.0539   14.566   8.1231   25.321   12.172   5.9302   10.907   33.528   8.7203   21.225   8.3996 12.30256 12.10772 
1 1 1   16    9   34 o   63.005   6.8479  104.932   13.274  118.737   15.285   62.576   26.773   75.136   4.9322   50.875   12.777 24.26114 13.69585 
1 1 1   16    9   35 o  110.387   4.2779  259.190   19.460  245.811   27.378  272.852   27.665  107.436   6.1786  113.339   5.9182 -5.903206 8.555721 
1 1 1   16    9   36 o   31.668   6.6391   25.344   10.231   33.145   11.723   0.4217   20.953   38.467   7.6584   24.870   10.847 13.59717 13.27816 
1 1 1   16    9   37 o   27.582   7.5040   5.2337   10.645  -1.9594   11.988   32.038   23.142   18.378   8.1044   36.785   12.632 -18.40682 15.00794 
1 1 1   16    9   38 o   32.830   7.5812   20.841   10.462   15.780   11.960   37.331   21.589   26.848   9.0824   38.812   12.141 -11.96387 15.16233 
1 1 1   16    9   39 o   28.576   7.5721   15.738   10.696   14.242   12.243   20.559   21.982   25.877   9.1666   31.274   12.055 -5.397123 15.14414 
1 1 1   16    9   40 o   40.192   7.3703   41.622   11.694   44.233   13.673   34.508   22.566   43.827   7.8525   36.557   12.475 7.269997 14.74059 
1 1 1   16    9   41 o   19.600   6.5484  -7.0128   10.663  -4.6817   11.642 -19.1559   26.570   16.822   7.6535   22.378   10.628 -5.556290 13.09687 
1 1 1   16    9   42 o   71.751   5.3938   97.299   13.788   79.464   15.487  165.453   30.275   59.868   6.2722   83.634   8.7769 -23.76570 10.78768 
1 1 1   16    9   43 o   27.898   7.3940   19.008   11.882   24.568   13.191  -4.9108   27.361   31.220   9.4411   24.577   11.382 6.643091 14.78801 
1 1 1   16    9   44 o   19.614   6.7573 -13.4577   11.705 -14.6597   12.740  -6.9505   29.641   14.788   7.1131   24.441   11.491 -9.652675 13.51459 
1 1 1   16    9   45 o   31.033   9.3452   25.645   22.031   6.8494   32.053   42.475   30.332   26.885   12.405   35.181   13.980 -8.295195 18.69040 
1 1 1   16    9   46 o   27.901   8.9277   15.016   21.750   30.666   33.669   3.8071   28.494   30.869   13.599   24.933   11.571 5.936682 17.85540 
1 1 1   16   10    0 o  511.100   5.2998  5401.59  157.919  5401.59  157.919  5401.59  157.919  511.100   7.4950  511.100   7.4950 0.000000 0.000000 
1 1 1   16   10    1 o   66.254   4.2609   95.468   10.128  100.986   11.912   81.075   19.238   69.934   4.1298   62.573   7.4543 7.361027 8.521819 
1 1 1   16   10    2 o  358.832   3.1212  2655.87   45.583  2638.98   59.712  2679.46   70.568  357.508   4.0496  360.156   4.7506 -2.648895 6.242425 
1 1 1   16   10    3 o  273.774   2.6671  1546.15   29.747  1539.68   39.089  1555.05   45.854  273.117   3.4701  274.431   4.0512 -1.314301 5.334145 
1 1 1   16   10    4 o  157.790   2.2679  514.444   14.595  517.862   19.288  509.865   22.323  158.413   2.9521  157.166   3.4438 1.247101 4.535874 
1 1 1   16   10    5 o  553.817   4.3148  6346.54   97.638  6363.45  129.630  6324.37  148.433  554.783   5.6652  552.851   6.5096 1.932251 8.629618 
1 1 1   16   10    6 o  182.280   2.3189  686.363   17.238  689.611   22.766  682.000   26.389  182.798   3.0196  181.762   3.5201 1.035889 4.637822 
1 1 1   16   10    7 o  177.857   2.6436  654.988   18.209  658.582   22.245  647.689   31.699  178.636   3.0193  177.079   4.3403 1.557022 5.287129 
1 1 1   16   10    8 o  174.598   2.6261  633.806   17.849  642.891   21.966  616.153   30.621  176.490   3.0177  172.706   4.2988 3.783386 5.252219 
1 1 1   16   10    9 o  128.179   2.2686  334.600   11.803  364.057   18.722  315.171   15.205  132.788   3.4184  123.569   2.9834 9.219536 4.537230 
1 1 1   16   10   10 f  182.853   2.5219  688.719   18.992  658.159   26.024  723.543   27.780  178.527   3.5343  187.180   3.5984 -8.653107 5.043815 
1 1 1   16   10   11 o  238.842   2.4315  1181.59   23.384  1160.83   37.191  1195.16   30.071  237.068   3.8037  240.617   3.0301 -3.548492 4.863056 
1 1 1   16   10   12 o  256.457   2.6235  1357.18   27.489  1366.96   41.912  1349.80   36.416  257.241   3.9504  255.673   3.4534 1.568192 5.247007 
1 1 1   16   10   13 o   82.998   2.7267  142.622   9.2982  138.071   13.637  146.576   12.711   81.751   4.0444   84.245   3.6583 -2.494072 5.453466 
1 1 1   16   10   14 o  418.390   3.3391  3624.03   56.026  3599.15   90.329  3639.59   71.426  417.092   5.2508  419.688   4.1263 -2.595520 6.678152 
1 1 1   16   10   15 o  256.625   2.5296  1367.12   26.196  1326.62   41.260  1394.47   33.906  253.379   3.9482  259.870   3.1634 -6.491516 5.059176 
1 1 1   16   10   16 o  215.814   2.6781  961.962   23.832  948.035   33.242  976.691   34.185  214.210   3.7625  217.418   3.8122 -3.207901 5.356274 
1 1 1   16   10   17 o  234.557   3.1152  1140.25   28.040  1130.36   49.695  1144.88   33.963  233.693   5.1559  235.421   3.4978 -1.728119 6.230375 
1 1 1   16   10   18 o  182.695   3.1811  698.566   22.786  663.429   38.267  717.868   28.362  179.003   5.1832  186.386   3.6894 -7.382965 6.362167 
1 1 1   16   10   19 o   77.489   2.9698  124.219   9.4823  117.605   13.380  130.892   13.440   75.411   4.3020   79.567   4.0954 -4.156517 5.939620 
1 1 1   16   10   20 o  117.083   2.7722  285.078   13.262  269.412   19.847  297.715   17.825  114.137   4.2159  120.028   3.6007 -5.891441 5.544306 
1 1 1   16   10   21 o  219.863   2.6413  998.388   23.834  1006.81   35.580  991.532   32.101  220.680   3.9091  219.046   3.5532 1.633347 5.282674 
1 1 1   16   10   22 o  107.521   3.5255  239.354   15.623  252.012   22.311  227.177   21.884  110.316   4.9036  104.725   5.0666 5.591118 7.050930 
1 1 1   16   10   23 o   39.286   5.5450   33.190   8.6618   36.033   12.632   30.668   11.900   40.916   7.7698   37.657   7.9132 3.258560 11.08998 
1 1 1   16   10   24 o   50.124   4.5020   52.205   9.3024   51.551   12.915   52.910   13.410   49.803   6.2876   50.446   6.4451 -0.6426888 9.004086 
1 1 1   16   10   25 o  246.133   5.0590  1284.70   38.777  1296.04   42.745  1231.98   92.164  250.201   4.1422  242.066   9.2313 8.135757 10.11798 
1 1 1   16   10   26 o  203.387   2.5758  855.138   21.596  829.142   29.938  883.338   31.181  200.171   3.6262  206.603   3.6592 -6.432022 5.151659 
1 1 1   16   10   27 o   24.282   6.3208   10.004   8.3315   10.315   11.616   9.6741   11.956   24.371   8.8910   24.193   8.9867 0.1774960 12.64163 
1 1 1   16   10   28 o  168.291   2.8089  588.003   19.263  581.988   29.541  592.453   25.408  167.469   4.2768  169.113   3.6428 -1.643402 5.617892 
1 1 1   16   10   29 o  134.065   2.7118  372.981   14.994  370.962   21.206  374.999   21.205  133.700   3.8456  134.430   3.8244 -0.7301331 5.423573 
1 1 1   16   10   30 o  183.656   3.3248  709.501   24.243  679.375   39.650  727.487   30.637  180.226   5.3341  187.085   3.9705 -6.858871 6.649665 
1 1 1   16   10   31 f   50.584   4.3704   53.849   9.1073   55.999   13.281   51.941   12.513   51.523   6.2497   49.646   6.1109 1.877460 8.740791 
1 1 1   16   10   32 o   77.234   3.4497  125.097   10.953  114.238   15.550  135.792   15.432   73.847   5.1053   80.622   4.6409 -6.774986 6.899469 
1 1 1   16   10   33 o   94.920   3.0891  188.118   12.072  204.656   17.534  173.213   16.645   98.899   4.2985   90.942   4.4377 7.957184 6.178191 
1 1 1   16   10   34 o   54.472   6.3252   60.283   12.151   54.408   13.911   79.196   24.960   50.427   6.6887   58.518   10.738 -8.091022 12.65048 
1 1 1   16   10   35 o   41.154   8.9457   29.166   11.678   25.182   12.377   61.513   35.268   33.255   8.8630   49.053   15.542 -15.79817 17.89136 
1 1 1   16   10   36 o   30.273   7.3231   20.236   10.311   21.625   11.880   15.992   20.762   30.746   8.8745   29.800   11.651 0.9460621 14.64626 
1 1 1   16   10   37 o   17.732   5.8412  -9.5910   9.9963  -1.3584   11.197 -41.9105   22.186   17.961   7.8792   17.503   8.6254 0.4587727 11.68242 
1 1 1   16   10   38 o   58.549   5.3000   69.541   11.726   61.537   13.735   91.054   22.519   53.395   6.2368   63.702   8.5709 -10.30688 10.59991 
1 1 1   16   10   39 o   47.043   8.0542   55.810   15.475   59.293   21.260   51.885   22.567   49.077   10.797   45.009   11.954 4.067703 16.10834 
1 1 1   16   10   40 o   31.953   7.2320   26.529   11.421   32.756   13.237   8.3874   22.593   37.051   8.7936   26.854   11.484 10.19700 14.46396 
1 1 1   16   10   41 o   37.634   8.3436   31.436   12.081   26.228   13.445   53.260   27.522   32.537   9.4554   42.732   13.750 -10.19464 16.68716 
1 1 1   16   10   42 o   27.311   7.7446   8.0860   10.995   1.8207   12.231   34.453   25.092   19.368   8.3681   35.254   13.034 -15.88597 15.48911 
1 1 1   16   10   43 o   53.237   7.3029   65.292   16.035   65.292   16.035   0.0000   0.0000   53.237   7.3029  ?   ?       ?      ? 
1 1 1   16   10   44 o   36.969   8.9705   33.021   13.338   27.123   14.640   61.826   32.352   31.969   9.9976   41.969   14.897 -10.00026 17.94108 
1 1 1   16   10   45 o   47.800   8.1611   72.662   15.206   77.787   17.289   55.146   31.959   57.298   7.3156   38.302   14.591 18.99659 16.32217 
1 1 1   16   10   46 o   22.864   7.7703 -11.7898   21.223  -8.9102   31.875 -14.0831   28.445   23.699   11.360   22.029   10.604 1.670048 15.54062 
1 1 1   16   11    0 o  332.201   3.1707  2278.92   61.412  2278.92   61.412  2278.92   61.412  332.201   4.4840  332.201   4.4840 0.000000 0.000000 
1 1 1   16   11    1 o  201.467   2.3650  838.825   19.463  845.398   25.855  830.229   29.568  202.392   3.0973  200.542   3.5748 1.849884 4.729902 
1 1 1   16   11    2 o  369.444   3.1744  2816.88   47.777  2803.66   62.775  2835.08   73.657  368.461   4.1307  370.427   4.8211 -1.965729 6.348720 
1 1 1   16   11    3 o  127.061   2.2530  332.131   11.646  326.800   15.207  339.692   18.112  125.840   2.9300  128.281   3.4232 -2.441544 4.505938 
1 1 1   16   11    4 o  445.378   3.8793  4100.58   71.250  4134.47  101.736  4067.97   99.818  447.177   5.5160  443.578   5.4560 3.598419 7.758525 
1 1 1   16   11    5 o  302.880   2.8144  1894.63   34.787  1895.66   45.991  1893.26   53.183  303.006   3.6801  302.753   4.2591 0.2530823 5.628739 
1 1 1   16   11    6 o  358.026   3.5520  2622.76   48.673  2578.61   58.521  2721.84   87.667  353.342   4.0156  362.711   5.8602 -9.369080 7.104017 
1 1 1   16   11    7 o  250.927   2.5763  1300.79   26.367  1304.12   34.817  1296.30   40.375  251.329   3.3588  250.524   3.9075 0.8058472 5.152695 
1 1 1   16   11    8 o  194.078   2.3430  775.677   18.502  765.698   24.184  789.762   28.732  192.595   3.0445  195.561   3.5622 -2.966919 4.685962 
1 1 1   16   11    9 o  190.144   2.1583  746.159   16.924  758.755   24.174  734.054   23.700  191.717   3.0572  188.571   3.0473 3.145859 4.316525 
1 1 1   16   11   10 o  117.208   2.2560  284.044   10.642  281.665   16.988  285.581   13.653  116.789   3.5268  117.627   2.8142 -0.8381042 4.511959 
1 1 1   16   11   11 o  223.929   2.6128  1034.81   24.109  1053.70   34.980  1017.71   33.274  225.868   3.7549  221.989   3.6342 3.879272 5.225596 
1 1 1   16   11   12 o  111.738   2.7282  256.689   12.485  248.234   16.581  267.759   18.971  109.632   3.6670  113.844   4.0404 -4.211838 5.456313 
1 1 1   16   11   13 o   93.647   2.6356  181.626   10.146  174.051   14.772  188.391   13.960   91.786   3.9021   95.507   3.5440 -3.721390 5.271215 
1 1 1   16   11   14 o  134.723   2.4130  369.145   13.295  420.946   20.486  331.458   17.474  142.759   3.4793  126.687   3.3442 16.07243 4.825914 
1 1 1   16   11   15 o  144.237   2.2633  425.282   13.076  447.437   21.438  412.157   16.501  147.178   3.5317  141.297   2.8314 5.880157 4.526543 
1 1 1   16   11   16 o  208.412   2.3841  891.368   19.810  919.439   32.721  875.126   24.890  210.946   3.7609  205.878   2.9312 5.067566 4.768242 
1 1 1   16   11   17 o  198.910   3.1848  837.049   25.299  733.494   39.701  907.844   32.827  188.230   5.1139  209.591   3.7974 -21.36148 6.369640 
1 1 1   16   11   18 o  220.295   2.7894  1002.65   25.265  1009.52   37.288  996.825   34.353  220.973   4.0913  219.618   3.7926 1.354218 5.578743 
1 1 1   16   11   19 o  204.424   2.4364  863.195   20.539  851.081   28.753  875.816   29.349  202.961   3.4349  205.887   3.4562 -2.925873 4.872750 
1 1 1   16   11   20 o  198.000   3.1100  799.873   25.077  879.395   39.344  745.461   32.545  206.141   4.6276  189.859   4.1561 16.28185 6.219931 
1 1 1   16   11   21 f  107.351   2.8709  237.327   12.588  245.252   19.328  231.489   16.589  108.882   4.3038  105.820   3.8008 3.062744 5.741893 
1 1 1   16   11   22 o  191.837   2.4795  760.463   19.616  750.696   27.464  770.633   28.026  190.582   3.4940  193.093   3.5191 -2.511108 4.959009 
1 1 1   16   11   23 o   98.570   2.9016  201.286   11.774  195.705   17.038  206.386   16.289   97.249   4.2479   99.891   3.9536 -2.641396 5.803106 
1 1 1   16   11   24 o  152.492   2.7742  481.017   17.439  476.966   24.224  485.374   25.125  151.833   3.8683  153.151   3.9776 -1.318115 5.548450 
1 1 1   16   11   25 o   64.708   7.4438  103.445   13.324  109.644   14.586   72.184   32.754   72.703   4.8641   56.713   14.070 15.99075 14.88753 
1 1 1   16   11   26 o   55.588   4.1395   64.457   9.4527   57.526   13.297   71.538   13.441   52.535   6.1367   58.641   5.5571 -6.105797 8.278948 
1 1 1   16   11   27 o  198.184   3.4548  814.992   28.100  825.652   41.988  806.345   37.817  199.288   5.1084  197.079   4.6525 2.209000 6.909505 
1 1 1   16   11   28 o   93.275   3.3660  180.878   12.862  182.462   19.380  179.630   17.194   93.593   5.0206   92.957   4.4848 0.6354675 6.731976 
1 1 1   16   11   29 o   60.745   3.8177   77.145   9.5614   75.449   13.591   78.807   13.453   60.071   5.4858   61.419   5.3108 -1.348690 7.635318 
1 1 1   16   11   30 o  100.676   4.1828  213.422   17.331  198.694   24.619  227.890   24.401   97.152   6.1440  104.201   5.6776 -7.048370 8.365685 
1 1 1   16   11   31 o   28.033   6.0900   16.022   8.3493   25.671   11.839   6.4730   11.777   33.921   8.4838   22.145   8.7394 11.77580 12.17996 
1 1 1   16   11   32 o   78.045   3.6576  130.508   11.513  103.529   16.718  154.848   15.879   70.038   5.7874   86.053   4.4741 -16.01486 7.315113 
1 1 1   16   11   33 o  101.474   4.0673  230.055   16.022  169.249   25.004  272.411   20.869   88.926   6.8175  114.022   4.4376 -25.09650 8.134511 
1 1 1   16   11   34 o   91.256   3.2328  175.005   12.150  170.228   17.512  179.439   16.870   90.002   4.7177   92.510   4.4214 -2.508209 6.465661 
1 1 1   16   11   35 o   38.233   7.1622   43.139   11.960   51.071   12.672 -21.5327   36.183   48.905   6.2824   27.560   12.873 21.34529 14.32434 
1 1 1   16   11   36 o   37.310   7.6275   31.612   11.469   29.739   13.460   36.580   21.916   35.808   9.0958   38.812   12.247 -3.003677 15.25497 
1 1 1   16   11   37 f   16.651   5.7314 -18.9643   9.3238 -21.1502   10.532 -11.0420   20.050   12.101   5.9594   21.200   9.7919 -9.099490 11.46282 
1 1 1   16   11   38 o   21.277   6.5794   1.4540   10.041   4.4272   11.493  -8.1351   20.640   20.474   8.4333   22.079   10.101 -1.604719 13.15877 
1 1 1   16   11   39 o   33.367   8.5322   26.726   15.069   23.082   20.475   31.031   22.257   31.609   11.757   35.125   12.368 -3.516291 17.06442 
1 1 1   16   11   40 o   32.313   7.7850   23.672   11.210   21.052   12.948   31.511   22.401   29.657   9.4191   34.969   12.398 -5.312536 15.57008 
1 1 1   16   11   41 o   39.427   7.3172   45.390   12.372   51.944   13.931   20.933   26.910   47.969   7.0416   30.885   12.829 17.08446 14.63441 
1 1 1   16   11   42 o   21.046   6.8669  -3.3086   11.365  -3.3164   12.741  -3.2781   25.139   17.883   8.0845   24.210   11.102 -6.327171 13.73387 
1 1 1   16   11   43 o   31.682   10.030   26.408   14.692   26.408   14.692   0.0000   0.0000   31.682   10.030  ?   ?       ?      ? 
1 1 1   16   11   44 o   28.558   8.1620   19.927   13.295   20.844   14.678   15.739   31.380   28.342   10.037   28.773   12.874 -0.4314346 16.32407 
1 1 1   16   11   45 o   14.546   7.0303 -15.0755   12.808 -15.0755   12.808   0.0000   0.0000   14.546   7.0303  ?   ?       ?      ? 
1 1 1   16   12    0 o  359.450   3.3342  2668.64   69.879  2668.64   69.879  2668.64   69.879  359.450   4.7153  359.450   4.7153 0.000000 0.000000 
1 1 1   16   12    1 o  170.209   2.2797  599.041   15.845  605.399   21.040  590.711   24.082  171.266   2.9785  169.151   3.4519 2.114548 4.559303 
1 1 1   16   12    2 o  219.663   2.4206  996.526   21.710  998.602   28.753  993.774   33.110  219.947   3.1696  219.380   3.6593 0.5675659 4.841111 
1 1 1   16   12    3 o  294.463   2.7638  1791.86   33.238  1798.35   44.076  1783.32   50.609  295.112   3.6212  293.814   4.1762 1.298645 5.527551 
1 1 1   16   12    4 o  183.255   2.3054  692.881   17.230  690.527   22.710  696.074   26.447  182.903   3.0105  183.607   3.4924 -0.7036438 4.610873 
1 1 1   16   12    5 o  100.933   2.3344  210.279   9.6077  209.984   12.665  210.679   14.745  100.858   3.0446  101.007   3.5395 -0.1493301 4.668794 
1 1 1   16   12    6 o  230.949   2.4729  1102.79   23.339  1111.85   31.045  1091.02   35.394  232.063   3.2435  229.835   3.7337 2.227386 4.945815 
1 1 1   16   12    7 o  257.910   2.5887  1375.41   27.291  1386.45   36.335  1361.12   41.340  259.125   3.3998  256.695   3.9047 2.429504 5.177339 
1 1 1   16   12    8 f  336.984   3.0021  2344.73   41.225  2335.43   54.209  2357.48   63.484  336.243   3.9089  337.725   4.5576 -1.482727 6.004245 
1 1 1   16   12    9 o  275.187   3.0521  1568.46   33.045  1552.74   55.705  1577.00   41.047  274.035   4.9286  276.338   3.6014 -2.302521 6.104163 
1 1 1   16   12   10 o  202.895   2.3337  843.493   18.878  874.875   31.223  825.412   23.700  205.818   3.6781  199.973   2.8735 5.844940 4.667486 
1 1 1   16   12   11 f  110.684   2.3875  255.409   10.791  228.674   15.854  278.490   14.730  105.223   3.6531  116.146   3.0750 -10.92268 4.775000 
1 1 1   16   12   12 o  149.460   2.3613  461.216   14.507  462.414   21.421  460.200   19.718  149.631   3.4709  149.289   3.2024 0.3421478 4.722563 
1 1 1   16   12   13 o  104.842   2.8374  228.035   12.145  233.781   16.183  220.626   18.376  106.377   3.6885  103.307   4.3127 3.070015 5.674865 
1 1 1   16   12   14 o  161.254   2.2689  540.348   14.776  519.645   23.160  554.562   19.190  158.608   3.5403  163.899   2.8388 -5.290558 4.537863 
1 1 1   16   12   15 o  367.524   3.0987  2773.20   45.052  2862.33   75.799  2724.51   56.022  371.924   4.9413  363.123   3.7406 8.801422 6.197453 
1 1 1   16   12   16 o  206.816   2.5299  883.930   21.456  882.109   32.096  885.402   28.849  206.602   3.7666  207.030   3.3786 -0.4280243 5.059843 
1 1 1   16   12   17 o  159.243   2.6494  520.050   17.288  558.125   26.299  491.075   22.942  164.325   3.8804  154.162   3.6082 10.16252 5.298754 
1 1 1   16   12   18 o   88.779   3.7041  161.692   13.498  146.318   18.071  181.093   20.301   84.053   5.2128   93.505   5.2639 -9.452438 7.408258 
1 1 1   16   12   19 o   62.483   3.9834   78.794   9.9928   72.285   12.551   90.067   16.516   59.077   5.1509   65.888   6.0776 -6.811810 7.966740 
1 1 1   16   12   20 o   72.046   3.6579  103.673   10.635   89.833   13.444  126.813   17.383   65.865   4.9488   78.227   5.3878 -12.36175 7.315701 
1 1 1   16   12   21 o   79.188   3.2427  129.189   10.533  135.467   15.891  124.270   14.066   80.883   4.7635   77.492   4.4011 3.391617 6.485360 
1 1 1   16   12   22 o  124.866   2.5753  322.262   13.253  304.989   18.579  340.157   18.910  121.455   3.7088  128.278   3.5741 -6.823288 5.150694 
1 1 1   16   12   23 o   74.341   3.3028  114.473   10.104  104.485   14.118  124.961   14.467   71.006   4.8209   77.676   4.5158 -6.669701 6.605581 
1 1 1   16   12   24 o   43.813   6.7090   46.648   10.865   53.520   12.746   28.381   20.780   50.719   6.0929   36.908   11.955 13.81107 13.41798 
1 1 1   16   12   25 o  114.175   3.0651  271.522   14.168  277.389   18.470  263.134   22.085  115.741   3.8691  112.610   4.7550 3.130600 6.130256 
1 1 1   16   12   26 o   66.304   3.9819   88.859   10.717   71.509   13.936  113.976   16.767   58.597   5.7663   74.011   5.4928 -15.41419 7.963707 
1 1 1   16   12   27 o   60.409   3.9270   76.162   9.7768   74.019   13.966   78.222   13.691   59.559   5.6854   61.260   5.4187 -1.700722 7.854095 
1 1 1   16   12   28 o  121.742   2.7927  306.836   14.001  290.944   19.176  324.981   20.491  118.380   3.9275  125.103   3.9712 -6.723724 5.585325 
1 1 1   16   12   29 o   62.125   3.8198   81.245   9.7293   73.711   14.060   88.167   13.477   59.284   5.7503   64.965   5.0297 -5.680702 7.639589 
1 1 1   16   12   30 o  133.491   3.6214  373.450   19.924  363.345   28.466  383.154   27.895  131.671   5.2417  135.311   4.9984 -3.639923 7.242889 
1 1 1   16   12   31 o   35.079   5.9706   27.531   8.5453   25.413   12.197   29.573   11.976   33.701   8.7116   36.458   8.1669 -2.756783 11.94111 
1 1 1   16   12   32 o   19.629   5.7666   1.9133   7.9435  -3.7803   11.591   6.9559   10.908   17.562   7.8431   21.697   8.4558 -4.135868 11.53320 
1 1 1   16   12   33 o  137.716   3.9769  397.462   22.222  379.987   28.683  423.698   35.146  134.238   5.1806  141.194   6.0352 -6.956131 7.953732 
1 1 1   16   12   34 o   44.368   4.8765   42.130   8.9103   44.240   13.046   40.284   12.199   45.389   6.9687   43.347   6.8233 2.041428 9.752934 
1 1 1   16   12   35 o   81.169   4.3435  140.449   13.071  139.725   15.429  142.288   24.599   81.454   4.5927   80.883   7.3737 0.5709000 8.687071 
1 1 1   16   12   36 o   56.692   6.5278   71.551   12.900   69.935   14.933   76.304   25.607   57.029   6.3489   56.356   11.408 0.6728859 13.05565 
1 1 1   16   12   37 o   41.605   7.1167   40.000   10.930   38.705   12.651   43.813   21.705   41.339   7.7032   41.871   11.969 -0.5320930 14.23346 
1 1 1   16   12   38 o   48.370   6.6248   56.697   11.249   58.885   13.097   50.546   21.961   52.126   6.0920   44.615   11.766 7.510784 13.24965 
1 1 1   16   12   39 o   33.339   8.2765   25.572   15.184   41.279   21.488   9.9089   21.458   39.739   12.057   26.940   11.341 12.79912 16.55302 
1 1 1   16   12   40 o   23.670   7.3265   4.0774   11.203   3.2697   12.497   7.3848   25.288   20.217   8.5905   27.122   11.871 -6.904762 14.65292 
1 1 1   16   12   41 o   37.248   8.1195   35.308   12.266   33.960   13.853   40.204   26.400   37.100   9.1178   37.396   13.438 -0.2960510 16.23905 
1 1 1   16   12   42 o   53.910   7.2571   94.372   14.234  116.798   16.724   35.423   27.113   72.904   5.5618   34.916   13.406 37.98798 14.51422 
1 1 1   16   12   43 o   18.714   8.3642  -0.8271   13.209  -0.8271   13.209   0.0000   0.0000   18.714   8.3642  ?   ?       ?      ? 
1 1 1   16   12   44 o   32.274   8.5569   19.743   13.295   9.0935   14.915   60.916   29.328   22.813   9.5198   41.736   14.222 -18.92296 17.11389 
1 1 1   16   12   45 o   40.863   8.7866   49.914   14.524   46.192   16.426   63.251   31.093   41.196   9.8084   40.531   14.581 0.6648865 17.57330 
1 1 1   16   13    0 f  208.096   2.5525  894.463   30.961  894.463   30.961  894.463   30.961  208.096   3.6097  208.096   3.6097 0.000000 0.000000 
1 1 1   16   13    1 o  279.243   2.6835  1611.95   30.618  1620.63   40.676  1600.60   46.508  280.142   3.5204  278.345   4.0512 1.797852 5.367032 
1 1 1   16   13    2 o  324.029   2.9247  2162.63   38.482  2132.10   50.036  2206.83   60.210  321.289   3.7759  326.769   4.4675 -5.479828 5.849415 
1 1 1   16   13    3 o  276.108   2.6719  1574.91   30.098  1576.63   39.762  1572.60   46.061  276.317   3.4889  275.899   4.0478 0.4172974 5.343884 
1 1 1   16   13    4 o  354.940   3.0851  2606.11   44.779  2624.22   59.682  2582.78   67.736  356.402   4.0601  353.478   4.6461 2.923737 6.170137 
1 1 1   16   13    5 o  109.721   2.2723  249.479   10.154  254.766   13.423  242.404   15.527  111.096   2.9294  108.347   3.4746 2.749657 4.544668 
1 1 1   16   13    6 f  144.391   2.4076  430.289   14.334  440.517   20.543  420.582   20.012  146.062   3.4100  142.720   3.3996 3.342590 4.815134 
1 1 1   16   13    7 o  108.656   2.2853  244.159   10.106  246.340   13.290  241.168   15.562  109.243   2.9496  108.070   3.4914 1.173538 4.570520 
1 1 1   16   13    8 o  181.144   2.3090  677.549   17.052  677.959   22.477  676.994   26.172  181.225   3.0072  181.064   3.5047 0.1612091 4.617986 
1 1 1   16   13    9 o  209.132   2.4467  901.493   20.939  916.312   31.771  890.114   27.842  210.632   3.6572  207.632   3.2511 2.999802 4.893336 
1 1 1   16   13   10 o  323.988   2.9555  2165.62   39.041  2193.33   60.103  2145.40   51.349  325.728   4.4738  322.249   3.8634 3.479126 5.911068 
1 1 1   16   13   11 o   99.570   2.4470  207.174   9.9073  187.275   14.875  223.037   13.282   95.207   3.7882  103.932   3.0984 -8.725357 4.893946 
1 1 1   16   13   12 o   94.486   2.8982  186.283   11.139  197.225   14.854  172.221   16.839   97.707   3.6860   91.265   4.4735 6.441994 5.796445 
1 1 1   16   13   13 o  158.646   2.2602  518.160   14.382  526.481   23.311  513.047   18.274  159.646   3.5403  157.645   2.8106 2.001221 4.520318 
1 1 1   16   13   14 o  452.361   4.0867  4220.78   68.417  4283.97  129.839  4196.49   80.500  454.223   6.9306  450.498   4.3325 3.724792 8.173348 
1 1 1   16   13   15 o  123.256   2.8089  321.872   13.646  285.370   22.197  344.048   17.301  117.450   4.5822  129.062   3.2502 -11.61182 5.617899 
1 1 1   16   13   16 o  176.940   2.7251  633.924   18.598  684.013   33.307  611.230   22.419  181.850   4.4408  172.030   3.1597 9.819717 5.450150 
1 1 1   16   13   17 o  257.991   3.1626  1365.89   32.827  1328.49   41.768  1426.32   53.091  253.491   3.9949  262.491   4.9039 -9.000275 6.325141 
1 1 1   16   13   18 o  123.171   2.8354  315.282   14.039  306.356   22.361  321.089   18.036  121.686   4.4555  124.655   3.5081 -2.968277 5.670795 
1 1 1   16   13   19 o  285.502   2.6933  1681.28   31.658  1625.88   43.244  1745.27   46.471  280.458   3.7385  290.546   3.8780 -10.08850 5.386522 
1 1 1   16   13   20 o  117.689   2.5607  286.313   12.429  285.617   17.661  286.996   17.495  117.546   3.6428  117.832   3.5999 -0.2866135 5.121449 
1 1 1   16   13   21 o  271.939   3.5488  1526.78   38.824  1556.57   62.459  1508.02   49.563  273.958   5.5277  269.920   4.4520 4.037872 7.097620 
1 1 1   16   13   22 o  137.829   2.5724  392.657   14.619  399.959   20.983  385.769   20.380  139.072   3.6582  136.587   3.6176 2.485229 5.144868 
1 1 1   16   13   23 o  228.251   3.0739  1077.49   28.534  1069.26   37.299  1089.09   44.306  227.284   3.9789  229.217   4.6865 -1.933441 6.147721 
1 1 1   16   13   24 o   70.631   4.4522  110.176   11.972  123.942   14.959   85.656   19.965   77.299   4.6922   63.963   7.5678 13.33584 8.904390 
1 1 1   16   13   25 o   85.063   4.4937  151.388   15.722  142.523   22.614  159.683   21.873   82.601   6.6378   87.525   6.0593 -4.924347 8.987459 
1 1 1   16   13   26 o   91.120   3.3961  167.607   12.493  150.074   15.823  196.628   20.357   85.015   4.5125   97.224   5.0766 -12.20871 6.792210 
1 1 1   16   13   27 o   59.145   4.2002   73.049   10.192   74.781   15.291   71.665   13.671   59.734   6.2066   58.555   5.6608 1.178871 8.400440 
1 1 1   16   13   28 o   57.818   4.0686   70.352   9.6470   62.285   13.717   78.247   13.570   54.467   6.1062   61.170   5.3786 -6.703316 8.137252 
1 1 1   16   13   29 o   81.238   3.3148  137.655   11.091  140.600   16.187  135.049   15.227   82.035   4.7840   80.441   4.5896 1.594017 6.629554 
1 1 1   16   13   30 o  103.195   3.4851  221.624   14.119  226.500   24.075  219.068   17.431  103.836   5.6215  102.554   4.1210 1.281853 6.970236 
1 1 1   16   13   31 o   93.974   3.0603  184.480   11.856  190.243   17.061  179.098   16.489   95.390   4.3365   92.558   4.3192 2.831444 6.120535 
1 1 1   16   13   32 o  114.952   4.1588  298.927   17.000  240.943   32.008  321.709   20.063  105.782   7.3363  124.121   3.9191 -18.33918 8.317502 
1 1 1   16   13   33 o   92.783   4.1181  184.685   14.568  188.210   17.650  177.152   25.805   94.709   4.5184   90.858   6.8861 3.850723 8.236194 
1 1 1   16   13   34 o   23.238   6.0692   9.7998   7.7873   6.7120   11.425   12.479   10.642   21.790   8.6052   24.686   8.5609 -2.895319 12.13832 
1 1 1   16   13   35 o   24.131   6.9968   6.8233   9.8018   6.0523   11.248   9.2573   19.985   21.255   8.4920   27.008   11.122 -5.752701 13.99353 
1 1 1   16   13   36 o   40.314   9.2091   35.355   11.887   34.736   12.367   42.872   43.071   39.054   7.9480   41.573   16.615 -2.519508 18.41812 
1 1 1   16   13   37 o   47.450   6.7063   57.389   11.472   64.030   13.598   40.994   21.368   54.493   6.0502   40.407   11.971 14.08644 13.41263 
1 1 1   16   13   38 o   58.620   5.2735   69.384   11.765   58.961   13.805   97.048   22.490   51.906   6.4483   65.334   8.3462 -13.42740 10.54704 
1 1 1   16   13   39 o   31.964   8.4228   23.311   15.082   15.232   20.417   33.015   22.376   28.280   11.391   35.649   12.411 -7.369034 16.84550 
1 1 1   16   13   40 o   27.929   9.2004  -3.6801   11.606  -7.2640   11.968   52.856   47.534   16.201   7.5117   39.658   16.798 -23.45739 18.40071 
1 1 1   16   13   41 o   34.201   7.4831   33.287   12.453   39.830   14.220   11.759   25.795   40.425   8.7803   27.978   12.120 12.44737 14.96614 
1 1 1   16   13   42 f   28.328   7.8515   19.726   13.491   24.718   15.309   2.3770   28.540   30.707   10.276   25.949   11.874 4.757690 15.70310 
1 1 1   16   13   43 o   25.527   7.2041   13.140   13.110   23.593   14.634 -29.3643   29.508   29.894   10.047   21.161   10.328 8.733288 14.40827 
1 1 1   16   13   44 o   23.917   7.5236   7.7670   14.079   11.450   16.024  -4.6983   29.481   23.868   9.9057   23.967   11.327 -0.9933090E-01 15.04727 
1 1 1   16   13   45 o   29.172   8.4267   20.084   13.820   13.860   15.709   41.389   29.065   24.527   9.9520   33.817   13.601 -9.290184 16.85346 
1 1 1   16   14    0 o   37.124   4.6797   31.046   9.1739   31.046   9.1739   31.046   9.1739   37.124   6.6181   37.124   6.6181 0.000000 0.000000 
1 1 1   16   14    1 o   86.748   2.3863  153.941   8.4362  146.632   11.000  164.380   13.146   84.277   3.1646   89.218   3.5725 -4.941399 4.772569 
1 1 1   16   14    2 o   44.987   3.6205   45.021   6.2302   56.216   8.1845   29.596   9.6072   52.170   3.8037   37.805   6.1614 14.36430 7.240921 
1 1 1   16   14    3 o  255.461   2.5647  1349.67   26.787  1362.71   35.699  1332.86   40.522  256.900   3.3692  254.021   3.8677 2.879227 5.129419 
1 1 1   16   14    4 o   90.493   2.3749  170.252   8.7391  176.800   11.565  161.536   13.343   92.546   3.0298   88.440   3.6579 4.105675 4.749746 
1 1 1   16   14    5 o   86.369   2.4105  154.641   8.4738  158.002   11.185  150.112   12.983   87.485   3.0997   85.254   3.6923 2.231270 4.820910 
1 1 1   16   14    6 o  175.433   2.2824  634.919   16.324  632.087   21.492  638.781   25.098  174.986   2.9779  175.880   3.4598 -0.8934021 4.564881 
1 1 1   16   14    7 o  286.233   2.7404  1693.83   32.036  1701.87   42.494  1683.26   48.760  287.056   3.5892  285.411   4.1422 1.645386 5.480891 
1 1 1   16   14    8 o  153.055   2.3227  482.957   14.581  491.035   21.883  476.507   19.554  154.195   3.4409  151.916   3.1208 2.278412 4.645355 
1 1 1   16   14    9 f  139.619   2.3495  400.304   13.454  423.199   20.333  382.471   17.945  143.143   3.4440  136.095   3.1969 7.047623 4.699077 
1 1 1   16   14   10 o  190.400   2.5673  747.970   20.135  731.530   27.666  766.485   29.361  188.185   3.5645  192.616   3.6958 -4.431458 5.134686 
1 1 1   16   14   11 o  150.870   2.2174  469.145   13.434  473.780   21.675  466.254   17.118  151.451   3.4699  150.288   2.7617 1.163773 4.434745 
1 1 1   16   14   12 o  201.618   2.4418  836.806   20.121  860.486   30.778  819.131   26.590  204.080   3.6565  199.156   3.2372 4.924576 4.883583 
1 1 1   16   14   13 o  169.044   2.2677  591.230   15.387  585.663   24.737  594.744   19.651  168.364   3.5622  169.725   2.8072 -1.360428 4.535390 
1 1 1   16   14   14 o  167.153   2.6692  578.521   18.324  590.384   24.944  564.615   27.007  169.036   3.5778  165.270   3.9621 3.766312 5.338429 
1 1 1   16   14   15 o  193.402   2.3475  772.099   18.183  775.065   29.501  770.282   23.090  193.663   3.6933  193.142   2.8985 0.5207367 4.694918 
1 1 1   16   14   16 o  336.920   3.3739  2320.34   41.708  2413.39   80.752  2286.49   48.707  341.196   5.7383  332.643   3.5502 8.552429 6.747744 
1 1 1   16   14   17 f  105.064   2.6170  228.368   11.318  245.913   16.058  211.049   15.955  109.086   3.5691  101.042   3.8284 8.043953 5.234038 
1 1 1   16   14   18 o   51.617   5.2325   62.157   9.4830   42.645   16.492   71.795   11.591   44.344   9.3136   58.890   4.7721 -14.54666 10.46500 
1 1 1   16   14   19 o  253.609   3.2663  1312.41   33.558  1236.53   43.043  1430.02   53.588  244.467   4.2689  262.752   4.9448 -18.28513 6.532614 
1 1 1   16   14   20 o  192.043   2.6380  763.325   20.663  757.109   31.598  767.969   27.312  191.321   4.0043  192.764   3.4353 -1.443161 5.275946 
1 1 1   16   14   21 o  163.969   3.0477  559.211   19.545  548.128   33.270  565.052   24.152  162.621   4.9604  165.316   3.5422 -2.695938 6.095334 
1 1 1   16   14   22 o  152.464   2.8308  480.983   17.797  488.781   25.512  473.591   24.839  153.664   4.0253  151.263   3.9813 2.400421 5.661655 
1 1 1   16   14   23 o  213.613   2.8588  944.723   25.166  938.000   34.818  952.078   36.415  212.834   3.9664  214.391   4.1182 -1.557007 5.717682 
1 1 1   16   14   24 o  116.985   3.2343  285.792   15.260  293.273   19.769  274.762   24.004  118.972   4.0288  114.999   5.0609 3.972252 6.468684 
1 1 1   16   14   25 o  161.019   4.0755  547.754   26.655  484.803   39.814  598.891   35.884  152.341   6.3366  169.696   5.1271 -17.35437 8.151016 
1 1 1   16   14   26 o   75.301   4.4025  110.642   13.192  160.183   22.191   83.566   16.405   87.456   6.1520   63.145   6.2991 24.31163 8.804923 
1 1 1   16   14   27 o   58.681   4.2483   71.525   10.213   84.239   15.213   61.092   13.781   63.414   5.8164   53.947   6.1936 9.467033 8.496542 
1 1 1   16   14   28 o  110.505   3.4446  257.164   14.910  261.915   18.505  248.369   25.175  112.205   3.9986  108.806   5.6099 3.398460 6.889126 
1 1 1   16   14   29 o   67.225   3.7115   95.120   10.230   83.854   14.520  106.227   14.417   63.186   5.5715   71.263   4.9050 -8.076973 7.422974 
1 1 1   16   14   30 o   15.383   5.0862 -10.2682   7.9975  -8.9107   10.755 -11.9469   11.961   15.253   7.0891   15.513   7.2954 -0.2591324 10.17244 
1 1 1   16   14   31 o   51.517   7.4139   61.331   15.218   69.397   21.707   53.536   21.340   55.209   9.8962   47.826   11.042 7.383430 14.82771 
1 1 1   16   14   32 o   31.633   7.6618   17.567   10.261   13.630   11.525   32.626   22.541   25.750   8.9100   37.516   12.467 -11.76614 15.32355 
1 1 1   16   14   33 o   58.228   4.3291   71.190   10.174   94.079   15.304   53.063   13.620   66.662   5.5664   49.794   6.6316 16.86777 8.658115 
1 1 1   16   14   34 o  101.792   3.0873  217.735   12.924  219.452   19.050  216.271   17.590  102.092   4.5243  101.493   4.2021 0.5991592 6.174685 
1 1 1   16   14   35 o   46.713   6.8430   53.114   12.062   58.062   14.626   42.595   21.325   51.769   6.8501   41.658   11.848 10.11025 13.68598 
1 1 1   16   14   36 o   46.194   8.6528   37.490   12.161   31.088   12.963   84.444   35.108   36.539   8.7226   55.849   14.947 -19.30984 17.30555 
1 1 1   16   14   37 o   34.656   7.3524   29.350   10.604   30.319   12.203   26.364   21.426   36.004   8.3754   33.307   12.087 2.697144 14.70484 
1 1 1   16   14   38 o   40.939   7.7466   48.463   12.376   52.988   13.302   19.329   33.755   49.083   6.5708   32.795   14.031 16.28796 15.49327 
1 1 1   16   14   39 o   20.934   6.8814  -8.9332   12.024 -12.6036   13.833   2.4139   24.322   16.326   7.7289   25.543   11.388 -9.216219 13.76287 
1 1 1   16   14   40 o   23.507   7.2915   1.8356   11.525  -1.9782   13.147   14.488   23.947   18.633   8.3351   28.380   11.966 -9.746767 14.58296 
1 1 1   16   14   41 o  100.902   4.8549  240.186   18.939  269.658   24.166  193.269   30.490  111.141   5.2719   90.662   8.1539 20.47845 9.709780 
1 1 1   16   14   42 o   31.431   8.6357   10.036   21.508 -51.6485   32.063   60.505   29.002   19.948   9.9243   42.915   14.135 -22.96663 17.27140 
1 1 1   16   14   43 o   57.532   8.2704  105.197   16.231  114.762   18.482   72.956   33.931   70.939   6.3169   44.126   15.287 26.81324 16.54086 
1 1 1   16   14   44 f   34.449   10.269   33.594   15.690   33.594   15.690   0.0000   0.0000   34.449   10.269  ?   ?       ?      ? 
1 1 1   16   15    0 o   72.835   2.7878  110.456   11.764  110.456   11.764  110.456   11.764   72.835   3.9426   72.835   3.9426 0.000000 0.000000 
1 1 1   16   15    1 o   54.393   2.9754   61.401   6.5437   62.525   8.4992   59.764   10.254   55.018   3.7455   53.767   4.6241 1.251541 5.950725 
1 1 1   16   15    2 o  148.759   2.2303  455.538   13.506  448.731   17.666  465.114   20.953  147.438   2.9051  150.079   3.3850 -2.640793 4.460696 
1 1 1   16   15    3 o  280.331   2.6883  1624.69   30.784  1632.80   40.859  1614.03   46.817  281.175   3.5233  279.487   4.0614 1.688782 5.376657 
1 1 1   16   15    4 o  243.776   2.5251  1224.96   25.058  1212.34   32.809  1242.63   38.819  242.302   3.2830  245.250   3.8376 -2.948486 5.050273 
1 1 1   16   15    5 o  267.660   2.6317  1480.16   28.740  1481.08   37.971  1478.93   43.977  267.791   3.4378  267.528   3.9856 0.2628784 5.263443 
1 1 1   16   15    6 o  101.546   2.3229  213.693   9.6101  217.983   12.710  207.966   14.684  102.752   2.9991  100.340   3.5482 2.412056 4.645894 
1 1 1   16   15    7 o  187.343   2.3916  722.643   18.365  744.326   27.728  705.699   24.512  189.826   3.5416  184.861   3.2149 4.964310 4.783142 
1 1 1   16   15    8 o   96.634   2.4782  193.053   9.8420  190.836   14.499  194.946   13.403   96.112   3.6576   97.156   3.3448 -1.043495 4.956336 
1 1 1   16   15    9 o  121.163   2.6454  300.757   13.065  287.634   17.053  319.402   20.328  118.004   3.5039  124.321   3.9644 -6.317581 5.290899 
1 1 1   16   15   10 o   29.694   5.3867   18.810   6.6258   21.803   9.8733   16.359   8.9372   31.758   7.6325   27.629   7.6034 4.128172 10.77341 
1 1 1   16   15   11 o   84.407   2.6649  147.313   9.2548  146.030   13.538  148.438   12.681   84.056   3.9050   84.759   3.6273 -0.7030945 5.329764 
1 1 1   16   15   12 o   80.310   3.0921  131.794   10.130  123.348   13.215  143.827   15.774   77.239   4.1482   83.381   4.5867 -6.141907 6.184289 
1 1 1   16   15   13 o   78.592   2.6879  129.420   8.4082  120.597   13.575  134.911   10.710   76.364   4.3100   80.819   3.2130 -4.455559 5.375842 
1 1 1   16   15   14 o   75.888   2.6511  116.607   8.0250  128.330   13.417  110.077   10.014   78.780   4.1292   72.997   3.3261 5.783180 5.302168 
1 1 1   16   15   15 o  110.948   2.6681  246.092   11.090  274.367   21.082  235.274   13.040  115.161   4.4385  106.736   2.9621 8.425117 5.336100 
1 1 1   16   15   16 o  223.745   2.7159  1034.74   25.061  1022.44   35.177  1047.42   35.714  222.396   3.8350  225.094   3.8468 -2.698303 5.431870 
1 1 1   16   15   17 o  241.602   2.6310  1208.35   26.101  1226.07   35.437  1187.33   38.590  243.571   3.5275  239.634   3.9044 3.936234 5.261939 
1 1 1   16   15   18 o  101.417   3.0294  212.573   12.175  213.712   20.273  211.930   15.227  101.583   4.8388  101.252   3.6463 0.3313217 6.058842 
1 1 1   16   15   19 o  139.312   3.0689  401.584   17.631  393.661   24.771  409.719   25.102  137.918   4.3547  140.706   4.3254 -2.788071 6.137747 
1 1 1   16   15   20 o  327.643   2.8702  2219.72   38.759  2178.93   53.639  2264.28   56.069  324.510   4.0076  330.776   4.1099 -6.265747 5.740363 
1 1 1   16   15   21 o  179.162   2.8904  668.861   21.218  605.638   30.776  726.143   29.294  170.991   4.3638  187.333   3.7914 -16.34180 5.780806 
1 1 1   16   15   22 o  138.646   2.8888  399.044   16.475  368.489   23.429  428.932   23.172  133.357   4.2596  143.934   3.9033 -10.57651 5.777572 
1 1 1   16   15   23 o   74.578   3.9042  113.260   11.557  107.159   14.330  124.613   19.548   71.842   4.8362   77.314   6.1304 -5.472054 7.808335 
1 1 1   16   15   24 o   90.028   3.0827  168.949   11.391  155.389   16.462  181.406   15.779   86.513   4.6136   93.542   4.0899 -7.029602 6.165458 
1 1 1   16   15   25 o   51.235   6.4115   72.815   11.336   25.999   20.316   93.981   13.660   35.290   11.838   67.180   4.9299 -31.89067 12.82310 
1 1 1   16   15   26 o   51.730   6.5904   72.158   12.477   98.660   15.587   24.885   20.818   68.696   5.5012   34.765   11.978 33.93138 13.18089 
1 1 1   16   15   27 f   40.268   6.0869   36.055   9.8146   40.711   13.890   31.411   13.870   43.038   8.1227   37.498   9.0677 5.539574 12.17379 
1 1 1   16   15   28 o   93.844   3.8195  192.457   13.920  158.622   22.752  212.701   17.599   86.664   6.3652  101.024   4.2237 -14.35944 7.639051 
1 1 1   16   15   29 o   58.185   3.9766   71.470   9.4753   61.643   13.362   81.410   13.438   54.069   5.9919   62.300   5.2298 -8.230648 7.953210 
1 1 1   16   15   30 o   46.563   4.6762   46.191   8.9324   52.894   12.929   40.070   12.355   49.865   6.2863   43.261   6.9246 6.604279 9.352354 
1 1 1   16   15   31 o   74.739   4.4355  118.175   12.587  121.093   22.843  116.902   15.084   74.935   7.3910   74.544   4.9060 0.3908157 8.871089 
1 1 1   16   15   32 o   89.653   4.2703  161.088   13.994  150.568   16.153  192.749   28.022   84.680   4.6249   94.625   7.1800 -9.944672 8.540585 
1 1 1   16   15   33 o   15.922   5.1070  -7.6597   7.6399 -16.4177   10.952   0.6413   10.663   13.450   6.5005   18.395   7.8784 -4.945791 10.21398 
1 1 1   16   15   34 o   62.091   3.9673   82.612   9.9713   63.967   13.902  102.367   14.310   54.622   6.1709   69.560   4.9877 -14.93803 7.934542 
1 1 1   16   15   35 o   90.472   7.2663  186.607   18.505  185.678   19.985  192.189   49.005   93.423   5.1866   87.521   13.576 5.901344 14.53268 
1 1 1   16   15   36 o   49.479   9.2321   65.051   13.965   66.121   14.649   54.383   46.246   55.176   6.4373   43.783   17.306 11.39277 18.46424 
1 1 1   16   15   37 o   25.845   7.3875   10.952   10.603   10.853   11.950   11.316   22.984   23.704   8.9482   27.985   11.757 -4.280087 14.77495 
1 1 1   16   15   38 o   40.603   6.5093   48.187   11.885   64.728   14.249   10.360   21.547   54.260   6.3668   26.946   11.355 27.31438 13.01858 
1 1 1   16   15   39 o   49.560   7.4465   69.866   13.800   79.911   16.332   44.795   25.802   59.797   6.6221   39.323   13.340 20.47416 14.89306 
1 1 1   16   15   40 o   67.814   6.5663  120.113   14.630  131.828   17.240   89.964   27.656   77.762   5.3753   57.866   11.982 19.89676 13.13256 
1 1 1   16   15   41 o   21.656   7.0023  -6.0293   11.621 -12.1224   13.253   14.245   24.175   15.746   7.4860   27.566   11.836 -11.82029 14.00462 
1 1 1   16   15   42 o   20.897   6.8782  -2.7882   12.018  -1.4258   13.427  -8.2807   26.958   18.598   8.3634   23.195   10.922 -4.597609 13.75641 
1 1 1   16   15   43 o   27.781   8.2873   11.289   12.856   4.0595   14.199   44.193   30.291   20.527   8.9418   35.034   13.956 -14.50710 16.57460 
1 1 1   16   15   44 o   18.584   8.3761  -0.4955   13.556  -0.4955   13.556   0.0000   0.0000   18.584   8.3761  ?   ?       ?      ? 
1 1 1   16   16    0 o  266.893   2.8158  1471.48   43.813  1471.48   43.813  1471.48   43.813  266.893   3.9822  266.893   3.9822 0.000000 0.000000 
1 1 1   16   16    1 o  200.124   2.3477  824.500   19.101  811.984   24.902  842.390   29.771  198.308   3.0446  201.940   3.5744 -3.632141 4.695313 
1 1 1   16   16    2 o  203.865   2.3617  857.878   19.631  855.258   25.860  861.442   30.157  203.521   3.0808  204.210   3.5805 -0.6896820 4.723482 
1 1 1   16   16    3 o  164.879   2.2506  561.958   15.134  565.397   19.998  557.349   23.151  165.487   2.9300  164.271   3.4170 1.215500 4.501209 
1 1 1   16   16    4 o  266.042   2.6316  1463.08   28.574  1467.92   37.809  1456.63   43.632  266.591   3.4386  265.493   3.9847 1.097931 5.263209 
1 1 1   16   16    5 o  141.228   2.2430  411.277   12.884  408.359   16.847  415.388   19.997  140.641   2.9044  141.815   3.4188 -1.174728 4.485918 
1 1 1   16   16    6 o  247.322   2.5466  1266.17   25.747  1283.66   34.339  1243.72   38.911  249.306   3.3396  245.337   3.8454 3.968170 5.093138 
1 1 1   16   16    7 o  119.491   2.3445  292.578   11.492  316.658   17.388  273.901   15.313  123.817   3.4049  115.164   3.2239 8.652679 4.688993 
1 1 1   16   16    8 o  145.441   2.3208  435.604   13.844  448.712   20.837  425.245   18.523  147.384   3.4278  143.498   3.1296 3.885666 4.641611 
1 1 1   16   16    9 o   74.155   2.8794  113.693   8.8053  115.559   12.431  111.815   12.474   74.767   4.0312   73.542   4.1125 1.224815 5.758749 
1 1 1   16   16   10 o  207.611   2.5979  888.659   22.215  853.525   30.454  928.614   32.476  203.240   3.6331  211.982   3.7145 -8.741959 5.195840 
1 1 1   16   16   11 f   91.795   2.8388  174.296   10.682  175.114   14.352  173.279   15.994   92.049   3.7802   91.540   4.2361 0.5091400 5.677578 
1 1 1   16   16   12 o  303.189   2.8645  1900.74   35.554  1898.71   53.635  1902.33   47.485  302.997   4.2918  303.380   3.7950 -0.3828430 5.729008 
1 1 1   16   16   13 o  158.012   2.2667  511.880   14.308  531.073   23.546  500.643   18.016  160.312   3.5612  155.712   2.8053 4.600235 4.533376 
1 1 1   16   16   14 o  124.109   2.3333  322.189   11.614  300.111   18.391  336.834   14.978  120.500   3.7004  127.718   2.8434 -7.218231 4.666630 
1 1 1   16   16   15 o  169.872   2.6162  596.535   16.880  596.224   30.546  596.672   20.253  169.765   4.3626  169.980   2.8889 -0.2151489 5.232392 
1 1 1   16   16   16 o  119.888   2.6070  297.125   12.891  294.059   18.213  300.201   18.247  119.268   3.7025  120.509   3.6711 -1.241638 5.214029 
1 1 1   16   16   17 o  297.379   3.0532  1829.59   37.443  1809.92   52.386  1850.14   53.536  295.751   4.2946  299.007   4.3411 -3.256836 6.106461 
1 1 1   16   16   18 o   73.888   3.5506  111.538   10.301  118.292   17.723  108.091   12.660   75.503   5.6913   72.273   4.2469 3.230057 7.101199 
1 1 1   16   16   19 o  163.132   2.7233  550.552   17.917  550.512   28.492  550.578   23.042  163.073   4.2362  163.191   3.4234 -0.1180878 5.446623 
1 1 1   16   16   20 o  165.393   2.4746  565.644   16.877  549.609   23.702  582.137   24.037  163.012   3.5253  167.773   3.4737 -4.761734 4.949158 
1 1 1   16   16   21 o  126.009   3.2967  329.611   17.101  305.059   24.098  354.522   24.273  121.253   4.8185  130.765   4.5006 -9.512192 6.593446 
1 1 1   16   16   22 o  111.871   3.0001  259.778   13.795  255.144   20.264  263.782   18.834  110.914   4.4296  112.829   4.0472 -1.914902 6.000139 
1 1 1   16   16   23 o   95.756   3.5368  191.102   13.188  192.156   16.206  189.035   22.694   96.274   4.0812   95.238   5.7776 1.036987 7.073641 
1 1 1   16   16   24 o   67.837   3.5604   95.502   9.9337  100.515   14.732   91.322   13.452   69.449   5.1431   66.226   4.9249 3.223030 7.120788 
1 1 1   16   16   25 o  107.767   3.3389  244.424   14.535  255.913   19.012  228.261   22.549  110.968   4.1540  104.566   5.2285 6.401985 6.677749 
1 1 1   16   16   26 o   61.859   4.0145   79.012   10.162   91.400   15.573   69.826   13.411   66.009   5.7202   57.710   5.6342 8.299133 8.029059 
1 1 1   16   16   27 o  106.725   3.1428  242.285   13.532  268.455   18.041  208.622   20.461  113.598   3.8505   99.853   4.9682 13.74460 6.285668 
1 1 1   16   16   28 o   70.499   4.4384  111.369   11.811  124.615   14.648   86.757   19.967   77.242   4.5980   63.756   7.5932 13.48548 8.876792 
1 1 1   16   16   29 o   80.622   3.2008  136.307   10.627  133.088   15.346  139.273   14.730   79.665   4.6706   81.578   4.3779 -1.912201 6.401593 
1 1 1   16   16   30 o   53.439   4.2373   60.995   9.2787   54.852   13.377   66.690   12.881   50.724   6.3943   56.154   5.5616 -5.430294 8.474543 
1 1 1   16   16   31 o   39.733   7.1117   33.507   10.376   43.545   21.262   30.369   11.887   42.745   11.713   36.721   8.0688 6.023399 14.22339 
1 1 1   16   16   32 o   49.556   8.7838   48.461   13.224   44.064   14.159   78.509   37.014   44.357   8.0352   54.756   15.622 -10.39992 17.56758 
1 1 1   16   16   33 o   42.389   5.6969   39.670   9.4344   42.114   15.570   38.252   11.860   42.715   9.1152   42.064   6.8359 0.6512680 11.39376 
1 1 1   16   16   34 o   72.005   7.5672  140.956   15.307   90.988   34.505  153.198   17.080   58.959   14.330   85.051   4.8689 -26.09244 15.13433 
1 1 1   16   16   35 o   58.941   4.4327   76.012   10.569   60.192   15.040   91.445   14.855   52.496   6.9465   65.386   5.5083 -12.89018 8.865336 
1 1 1   16   16   36 o   56.247   5.7307   69.752   12.280   67.069   14.702   75.945   22.335   55.399   6.4345   57.095   9.4848 -1.696125 11.46142 
1 1 1   16   16   37 o   39.052   8.5902   40.141   15.293   40.958   20.679   39.155   22.720   39.661   11.782   38.443   12.504 1.218151 17.18048 
1 1 1   16   16   38 o   56.375   5.4297   64.533   11.728   51.933   13.805   97.203   22.230   48.092   6.9599   64.659   8.3357 -16.56658 10.85933 
1 1 1   16   16   39 o   41.868   7.7116   45.506   12.089   45.399   13.726   45.876   25.523   43.934   7.8638   39.802   13.268 4.132652 15.42326 
1 1 1   16   16   40 o  101.946   4.8389  237.640   20.140  256.359   27.502  215.990   29.577  107.114   6.2252   96.777   7.4099 10.33666 9.677752 
1 1 1   16   16   41 o   36.150   6.2977   40.396   13.370   60.618   15.393 -21.7002   26.975   51.045   7.3117   21.256   10.256 29.78870 12.59545 
1 1 1   16   16   42 o   39.084   6.8572   51.188   14.883   70.033   17.105  -7.5525   30.198   54.167   7.6562   24.000   11.378 30.16675 13.71439 
1 1 1   16   16   43 o   44.732   8.1255   65.022   15.245   70.064   17.517   49.288   30.947   53.477   7.9422   35.987   14.178 17.49045 16.25097 
1 1 1   16   17    0 o  258.051   2.7748  1375.66   41.744  1375.66   41.744  1375.66   41.744  258.051   3.9242  258.051   3.9242 0.000000 0.000000 
1 1 1   16   17    1 o   85.203   2.4317  150.652   8.4099  154.102   11.029  145.862   12.998   86.387   3.0955   84.019   3.7510 2.367409 4.863368 
1 1 1   16   17    2 o  162.012   2.2699  542.091   14.984  542.200   19.720  541.943   23.050  162.049   2.9505  161.975   3.4503 0.7469177E-01 4.539794 
1 1 1   16   17    3 o   82.076   2.4511  139.364   8.1846  140.430   10.749  137.894   12.626   82.462   3.1604   81.691   3.7474 0.7713852 4.902180 
1 1 1   16   17    4 o   80.658   2.4564  134.575   8.0462  135.442   10.517  133.353   12.495   80.984   3.1488   80.332   3.7711 0.6519089 4.912849 
1 1 1   16   17    5 f  271.706   2.6558  1525.26   29.427  1523.41   38.801  1527.77   45.147  271.554   3.4644  271.858   4.0264 -0.3041077 5.311668 
1 1 1   16   17    6 o  127.982   2.4320  337.668   12.822  317.255   17.707  360.177   18.593  123.921   3.4644  132.042   3.4141 -8.120491 4.863946 
1 1 1   16   17    7 o  109.787   2.4146  249.106   10.892  247.804   16.100  250.204   14.790  109.514   3.5645  110.061   3.2582 -0.5464249 4.829223 
1 1 1   16   17    8 o  112.575   2.5192  261.996   11.689  266.999   16.343  256.754   16.726  113.681   3.4855  111.469   3.6381 2.211502 5.038326 
1 1 1   16   17    9 o   94.092   2.6533  182.960   10.291  191.494   14.645  174.636   14.463   96.262   3.6888   91.921   3.8149 4.341393 5.306598 
1 1 1   16   17   10 f  143.840   2.3559  428.028   13.926  419.855   20.481  435.055   18.991  142.550   3.4836  145.131   3.1727 -2.580963 4.711831 
1 1 1   16   17   11 o   97.466   2.8075  195.680   11.231  189.496   15.057  203.437   16.863   95.746   3.8128   99.186   4.1220 -3.439903 5.614979 
1 1 1   16   17   12 o  140.725   2.3236  413.302   13.334  373.160   19.784  446.713   18.049  134.378   3.5697  147.073   2.9755 -12.69502 4.647201 
1 1 1   16   17   13 o  156.522   2.2792  501.623   14.300  524.791   23.370  487.757   18.080  159.356   3.5557  153.688   2.8522 5.668167 4.558307 
1 1 1   16   17   14 o  231.599   2.7862  1111.26   24.352  1103.83   44.498  1114.43   29.095  230.919   4.6722  232.279   3.0370 -1.360733 5.572483 
1 1 1   16   17   15 f   95.624   2.5100  191.121   9.5333  180.873   15.539  197.306   12.072   93.514   4.0289   97.734   2.9948 -4.220062 5.020033 
1 1 1   16   17   16 f  243.409   2.7816  1225.32   27.925  1231.57   39.614  1219.14   39.371  244.026   3.9359  242.792   3.9317 1.233871 5.563272 
1 1 1   16   17   17 o  115.522   2.5423  275.810   12.109  266.423   16.952  285.591   17.304  113.514   3.6207  117.531   3.5697 -4.016800 5.084550 
1 1 1   16   17   18 o  206.895   2.5773  886.921   21.912  865.596   32.184  905.347   29.917  204.544   3.8149  209.247   3.4665 -4.702896 5.154644 
1 1 1   16   17   19 o  173.155   2.9923  620.787   21.364  630.607   30.641  611.497   29.804  174.483   4.2579  171.828   4.2055 2.654907 5.984573 
1 1 1   16   17   20 o   26.525   5.5808   14.238   7.5600   0.9946   11.536   24.207   10.009   19.683   8.3026   33.368   7.4598 -13.68520 11.16159 
1 1 1   16   17   21 f  159.250   2.4961  524.361   16.386  504.605   22.764  545.605   23.606  156.139   3.5349  162.360   3.5251 -6.221039 4.992179 
1 1 1   16   17   22 o  121.464   2.7265  305.930   13.643  310.567   18.930  300.918   19.681  122.439   3.7485  120.490   3.9604 1.949043 5.453090 
1 1 1   16   17   23 o   49.365   5.5409   52.736   10.676   54.559   13.727   49.946   16.985   50.997   6.5263   47.733   8.9563 3.264450 11.08187 
1 1 1   16   17   24 o  122.126   2.6563  309.712   13.369  304.309   19.184  314.814   18.642  121.072   3.8418  123.180   3.6693 -2.108009 5.312553 
1 1 1   16   17   25 o   47.886   5.0148   50.009   9.2870   45.654   14.906   52.773   11.873   45.618   8.2250   50.155   5.7397 -4.537220 10.02967 
1 1 1   16   17   26 o   58.766   3.8746   72.950   9.2213   56.486   12.856   90.395   13.234   51.785   6.0193   65.746   4.8803 -13.96133 7.749161 
1 1 1   16   17   27 o   83.934   3.3701  145.193   11.555  133.133   15.121  162.120   17.913   79.844   4.5917   88.024   4.9342 -8.179390 6.740175 
1 1 1   16   17   28 o   55.681   4.0520   65.258   9.2862   70.630   13.639   60.615   12.679   57.811   5.7201   53.551   5.7405 4.260197 8.103921 
1 1 1   16   17   29 o   55.223   4.5151   62.898   10.067   47.982   13.088   84.511   15.754   47.372   6.6985   63.074   6.0560 -15.70210 9.030240 
1 1 1   16   17   30 o   72.430   3.6116  110.161   10.721  114.437   16.218  106.842   14.287   73.599   5.3428   71.262   4.8609 2.337433 7.223138 
1 1 1   16   17   31 o   62.850   5.7848   92.945   12.727   73.173   22.966  101.707   15.289   56.343   10.261   69.357   5.3447 -13.01445 11.56951 
1 1 1   16   17   32 o   25.901   6.3558   14.053   8.3806   10.989   12.409   16.622   11.364   24.402   9.1373   27.401   8.8371 -2.998913 12.71160 
1 1 1   16   17   33 o   79.293   3.4231  132.222   11.156  142.158   16.645  124.118   15.032   81.947   4.9249   76.638   4.7556 5.308815 6.846189 
1 1 1   16   17   34 o   77.248   9.3265  242.087   19.850   37.939   57.899  269.280   21.131   41.614   18.092  112.882   4.5387 -71.26811 18.65305 
1 1 1   16   17   35 o   37.592   5.6688   31.618   8.7971   46.762   13.270   19.743   11.750   46.089   6.9808   29.094   8.9337 16.99449 11.33763 
1 1 1   16   17   36 o   48.917   6.6102   60.321   11.404   64.924   13.422   48.371   21.625   54.645   5.9552   43.190   11.803 11.45432 13.22049 
1 1 1   16   17   37 o   21.519   6.9675   0.1328   10.841   4.2682   11.479 -34.0312   32.993   20.056   8.3589   22.983   11.150 -2.926714 13.93505 
1 1 1   16   17   38 o   20.957   6.4859   1.0526   10.921   8.7070   12.478 -24.0112   22.579   22.459   8.9536   19.455   9.3861 3.003540 12.97176 
1 1 1   16   17   39 o   24.534   7.2656   9.7698   11.841   13.454   13.563  -2.0351   24.277   25.010   9.5107   24.057   10.986 0.9530716 14.53119 
1 1 1   16   17   40 o   35.205   9.3439   38.683   19.139   25.936   31.959   45.812   23.899   31.574   13.584   38.836   12.834 -7.262398 18.68772 
1 1 1   16   17   41 o   17.018   5.9683 -22.9315   11.821 -23.0563   13.349 -22.4783   25.446   13.661   6.7243   20.375   9.8624 -6.713581 11.93662 
1 1 1   16   17   42 o   18.693   6.3700 -11.6049   12.219 -10.9853   13.940 -13.6588   25.380   16.171   7.6852   21.214   10.161 -5.043369 12.73991 
1 1 1   16   18    0 o   69.218   2.4527   99.634   9.8456   99.634   9.8456   99.634   9.8456   69.218   3.4686   69.218   3.4686 0.000000 0.000000 
1 1 1   16   18    1 o  185.749   2.3146  713.719   17.539  719.940   23.212  705.440   26.777  186.717   3.0141  184.781   3.5134 1.935287 4.629170 
1 1 1   16   18    2 o   40.107   3.7160   34.268   5.9264   37.822   7.6930   29.081   9.2948   42.764   4.3617   37.450   6.0176 5.314465 7.432096 
1 1 1   16   18    3 o  131.393   2.2455  357.057   12.016  359.705   15.821  353.448   18.470  131.986   2.9063  130.801   3.4237 1.185272 4.490933 
1 1 1   16   18    4 o  320.795   2.9164  2125.21   38.084  2112.35   49.913  2143.13   58.916  319.700   3.7854  321.889   4.4377 -2.189453 5.832882 
1 1 1   16   18    5 o  154.479   2.1980  492.187   13.661  495.854   21.916  489.858   17.469  154.924   3.4299  154.034   2.7497 0.8900452 4.396049 
1 1 1   16   18    6 o  142.709   2.1921  419.603   12.567  425.058   20.270  416.197   16.017  143.437   3.4264  141.981   2.7352 1.456085 4.384240 
1 1 1   16   18    7 o   71.303   2.6274  104.291   7.5293  108.506   12.203  101.701   9.5674   72.441   4.0844   70.165   3.3061 2.276466 5.254729 
1 1 1   16   18    8 o  111.385   2.6743  248.273   12.069  213.903   15.408  302.842   19.414  101.735   3.6720  121.035   3.8891 -19.30041 5.348689 
1 1 1   16   18    9 o   88.610   2.6065  162.415   9.4998  160.346   13.914  164.223   13.002   88.073   3.8303   89.147   3.5363 -1.074097 5.213085 
1 1 1   16   18   10 o  124.840   2.4039  321.902   12.327  323.148   18.296  320.867   16.681  125.050   3.5474  124.629   3.2452 0.4212570 4.807886 
1 1 1   16   18   11 o  132.544   2.6544  362.736   14.431  359.353   19.374  366.951   21.628  131.866   3.5622  133.221   3.9362 -1.355637 5.308784 
1 1 1   16   18   12 o  134.943   2.4130  376.880   13.386  368.303   19.615  384.355   18.313  133.491   3.5627  136.394   3.2553 -2.903000 4.825975 
1 1 1   16   18   13 o  124.161   2.4874  320.298   12.612  267.032   17.739  374.759   17.936  113.645   3.7845  134.678   3.2290 -21.03339 4.974819 
1 1 1   16   18   14 o  145.243   2.5914  436.122   14.280  436.115   25.895  436.125   17.117  145.171   4.3248  145.315   2.8560 -0.1433868 5.182755 
1 1 1   16   18   15 o  105.668   2.5064  234.319   10.655  213.274   16.602  249.060   13.894  101.540   3.9641  109.796   3.0682 -8.255867 5.012756 
1 1 1   16   18   16 o   88.809   2.8694  163.387   10.494  159.761   15.165  166.719   14.537   87.853   4.1853   89.766   3.9265 -1.912575 5.738862 
1 1 1   16   18   17 o  204.120   2.4302  861.534   20.458  867.711   29.105  855.501   28.763  204.841   3.4449  203.398   3.4286 1.443680 4.860324 
1 1 1   16   18   18 o   82.876   2.9042  142.928   9.8787  132.414   14.333  152.441   13.634   79.938   4.3473   85.815   3.8522 -5.876694 5.808462 
1 1 1   16   18   19 o   96.423   3.1708  191.876   12.099  196.187   20.289  189.497   15.073   97.185   5.0617   95.662   3.8203 1.523064 6.341573 
1 1 1   16   18   20 o  105.310   2.6740  229.909   11.593  225.487   16.822  233.908   15.998  104.329   3.9094  106.291   3.6493 -1.961288 5.347965 
1 1 1   16   18   21 o   67.504   3.4611   94.778   9.6333   93.195   13.716   96.318   13.533   66.939   4.9679   68.069   4.8204 -1.129395 6.922153 
1 1 1   16   18   22 o   91.785   3.3872  176.605   12.451  180.735   15.926  170.112   19.969   93.284   4.1394   90.285   5.3626 2.999687 6.774368 
1 1 1   16   18   23 f   68.971   3.4986   98.411   9.8522  104.667   15.225   93.905   12.923   70.799   5.2138   67.143   4.6664 3.655533 6.997122 
1 1 1   16   18   24 o   73.367   3.3204  113.046   9.9792  101.913   14.454  123.185   13.794   69.832   5.0185   76.901   4.3491 -7.069481 6.640785 
1 1 1   16   18   25 o  102.202   3.2225  220.623   13.199  206.391   20.946  229.997   16.998   99.274   5.1155  105.130   3.9202 -5.855309 6.444902 
1 1 1   16   18   26 o   80.870   3.5184  134.137   11.575  121.265   14.942  153.453   18.303   76.167   4.7564   85.573   5.1859 -9.406204 7.036803 
1 1 1   16   18   27 o  120.589   4.1474  312.048   19.982  288.097   31.786  327.699   25.694  116.286   6.6274  124.892   4.9880 -8.605919 8.294709 
1 1 1   16   18   28 o   73.033   3.7325  111.697   11.160  106.231   14.770  118.968   17.037   71.037   5.0413   75.028   5.5056 -3.990944 7.464993 
1 1 1   16   18   29 o   35.172   5.7905   28.088   8.2448   25.698   12.045   30.195   11.309   33.619   8.6399   36.726   7.7118 -3.107140 11.58100 
1 1 1   16   18   30 o  120.745   3.5027  312.074   16.984  333.186   22.139  281.880   26.477  126.119   4.2562  115.371   5.5641 10.74844 7.005332 
1 1 1   16   18   31 o   43.898   7.6479   46.548   13.773   41.076   20.724   50.876   18.432   41.120   11.675   46.676   9.8821 -5.555977 15.29578 
1 1 1   16   18   32 o  100.690   3.6217  211.528   14.428  203.192   17.876  227.107   24.437   98.245   4.4116  103.136   5.7448 -4.891388 7.243313 
1 1 1   16   18   33 o   77.992   3.6120  129.738   11.472  126.678   17.542  132.025   15.165   76.986   5.5247   78.998   4.6544 -2.011856 7.223944 
1 1 1   16   18   34 o   33.773   6.1053   26.542   8.8492   36.807   12.797   17.136   12.250   39.990   8.0374   27.555   9.1923 12.43518 12.21057 
1 1 1   16   18   35 o   40.769   5.4812   37.877   8.9131   56.858   13.243   22.160   12.051   51.010   6.2948   30.528   8.9749 20.48164 10.96234 
1 1 1   16   18   36 o   24.663   5.7668   9.2932   8.2238   26.081   12.147  -4.9135   11.174   32.926   8.7827   16.401   7.4759 16.52523 11.53362 
1 1 1   16   18   37 o   28.074   8.1301   14.971   11.792   14.857   12.690   15.693   31.915   25.682   9.3046   30.466   13.335 -4.783867 16.26020 
1 1 1   16   18   38 o   28.800   7.5583   19.793   11.316   21.203   13.031   15.466   22.821   29.313   9.4643   28.286   11.787 1.027727 15.11655 
1 1 1   16   18   39 f   77.251   5.0523  134.192   14.369  130.359   16.861  144.363   27.464   77.083   5.3033   77.418   8.6011 -0.3347626 10.10469 
1 1 1   16   18   40 o   31.262   8.0368   15.317   19.512 -59.2510   32.869   55.894   24.246   19.556   9.7790   42.968   12.757 -23.41157 16.07351 
1 1 1   16   18   41 o   54.362   7.9397   87.149   15.040   91.387   17.313   74.115   30.363   62.775   6.6870   45.948   14.403 16.82750 15.87935 
1 1 1   16   18   42 o   37.816   9.0031   43.519   15.027   38.574   17.206   59.419   30.852   36.427   10.728   39.206   14.461 -2.779678 18.00621 
1 1 1   16   19    0 o   21.840   5.9079   13.413   7.1024   13.413   7.1024   13.413   7.1024   21.840   8.3551   21.840   8.3551 0.000000 0.000000 
1 1 1   16   19    1 o   54.201   2.9589   59.954   6.5007   56.707   8.3533   64.941   10.352   52.376   3.8669   56.027   4.4797 -3.650623 5.917800 
1 1 1   16   19    2 o  281.585   2.7059  1638.23   31.060  1634.06   40.900  1643.93   47.739  281.211   3.5263  281.960   4.1051 -0.7482300 5.411714 
1 1 1   16   19    3 o  168.977   2.4581  587.875   17.101  552.626   23.362  628.560   25.099  163.542   3.4635  174.413   3.4891 -10.87173 4.916248 
1 1 1   16   19    4 o  260.172   2.6401  1401.33   28.213  1372.44   41.600  1425.95   38.392  257.655   3.9146  262.689   3.5435 -5.033600 5.280216 
1 1 1   16   19    5 o   79.593   2.5047  131.909   7.9979  126.471   12.761  135.427   10.264   78.212   3.9560   80.975   3.0732 -2.762749 5.009423 
1 1 1   16   19    6 o  263.965   2.5272  1445.51   26.938  1411.74   42.419  1468.33   34.872  261.312   3.9358  266.617   3.1712 -5.304352 5.054379 
1 1 1   16   19    7 o  229.904   2.5039  1091.45   23.528  1098.26   35.810  1086.28   31.210  230.503   3.7667  229.305   3.3000 1.198486 5.007838 
1 1 1   16   19    8 o  143.921   2.3216  429.507   13.699  411.495   20.264  444.667   18.591  141.115   3.4817  146.726   3.0721 -5.610611 4.643224 
1 1 1   16   19    9 o  183.237   2.2778  693.259   16.772  695.364   26.966  691.932   21.418  183.427   3.5645  183.047   2.8369 0.3797913 4.555630 
1 1 1   16   19   10 o  180.399   2.6387  673.382   19.572  680.556   26.726  665.086   28.742  181.455   3.5711  179.343   3.8857 2.111664 5.277466 
1 1 1   16   19   11 o   68.220   3.3120   95.234   9.2468   87.780   12.187  105.346   14.195   65.120   4.5376   71.321   4.8257 -6.201225 6.623972 
1 1 1   16   19   12 o  172.564   2.4349  616.881   17.288  586.664   24.920  644.916   24.003  168.464   3.5865  176.663   3.2942 -8.198883 4.869780 
1 1 1   16   19   13 o   66.111   3.5808   94.306   9.1470   78.963   15.223  102.976   11.443   61.664   5.9855   70.558   3.9322 -8.893528 7.161582 
1 1 1   16   19   14 f  256.265   2.5604  1354.17   26.188  1373.42   42.965  1342.79   33.033  257.622   4.0436  254.908   3.1419 2.714523 5.120795 
1 1 1   16   19   15 o  139.104   2.3599  400.634   13.292  397.026   20.839  403.108   17.258  138.541   3.6470  139.667   2.9959 -1.126556 4.719731 
1 1 1   16   19   16 o  127.507   2.4416  336.237   12.836  325.612   18.059  347.089   18.250  125.466   3.4897  129.546   3.4156 -4.079948 4.883101 
1 1 1   16   19   17 o  143.624   2.4181  426.735   14.322  427.720   20.441  425.785   20.072  143.783   3.4470  143.465   3.3922 0.3182068 4.836178 
1 1 1   16   19   18 o   87.222   2.8229  157.965   10.120  152.824   14.799  162.480   13.870   85.866   4.1788   88.577   3.7965 -2.710503 5.645815 
1 1 1   16   19   19 o  101.681   3.1508  217.324   12.657  204.417   20.841  224.865   15.931   99.162   5.0959  104.200   3.7069 -5.038231 6.301527 
1 1 1   16   19   20 f   76.991   3.9760  134.065   11.384   96.132   19.236  154.511   14.123   67.677   6.8915   86.305   3.9675 -18.62843 7.951958 
1 1 1   16   19   21 o  122.762   2.6998  312.192   13.652  302.971   18.728  322.645   19.941  120.844   3.7576  124.681   3.8777 -3.837639 5.399667 
1 1 1   16   19   22 o  145.598   2.9585  440.278   17.557  437.212   23.092  444.479   27.030  145.089   3.8589  146.108   4.4855 -1.019257 5.916926 
1 1 1   16   19   23 o  103.794   3.0548  221.175   12.938  203.454   16.871  246.477   20.159   98.864   4.1374  108.725   4.4955 -9.860916 6.109651 
1 1 1   16   19   24 o   43.354   5.6363   44.436   9.0606   31.136   15.317   51.596   11.238   37.133   9.8422   49.576   5.4960 -12.44285 11.27269 
1 1 1   16   19   25 o   96.950   2.9592  195.380   11.812  204.515   17.349  187.488   16.126   99.041   4.2472   94.859   4.1219 4.182213 5.918498 
1 1 1   16   19   26 o   58.117   3.8078   71.073   9.0271   85.923   13.145   57.820   12.418   63.943   4.9843   52.291   5.7580 11.65223 7.615613 
1 1 1   16   19   27 o   47.362   4.4966   47.602   8.7432   49.723   13.112   45.904   11.732   48.252   6.5886   46.471   6.1210 1.780922 8.993170 
1 1 1   16   19   28 o   48.068   6.3856   49.722   11.669   61.391   20.340   43.997   14.247   51.756   9.8892   44.380   8.0813 7.375889 12.77122 
1 1 1   16   19   29 o   31.148   5.9741   22.098   7.8398   20.375   12.091   23.348   10.298   30.101   9.0245   32.195   7.8306 -2.094336 11.94815 
1 1 1   16   19   30 f   47.956   4.5369   49.402   8.9320   55.767   12.842   43.438   12.432   51.041   6.1002   44.872   6.7172 6.168243 9.073766 
1 1 1   16   19   31 o   23.898   6.8074   4.3623   9.8604  -1.4161   11.857   17.323   17.757   18.462   8.1030   29.335   10.941 -10.87280 13.61475 
1 1 1   16   19   32 o   97.613   3.9787  217.056   14.537  167.376   24.777  243.136   17.952   87.683   6.8513  107.542   4.0473 -19.85899 7.957413 
1 1 1   16   19   33 o   83.996   4.3678  156.120   14.600  169.432   18.916  136.507   22.961   89.131   5.1455   78.862   7.0593 10.26931 8.735524 
1 1 1   16   19   34 o   24.234   6.2446   11.657   8.2001   16.002   11.999   7.8486   11.233   26.661   9.0966   21.807   8.5577 4.853460 12.48927 
1 1 1   16   19   35 o   34.224   6.0947   28.071   8.5855   26.653   12.787   29.236   11.585   33.217   9.0758   35.230   8.1371 -2.012089 12.18942 
1 1 1   16   19   36 o   24.428   5.9484   12.049   8.2518   0.1491   12.257   21.913   11.159   18.791   8.2435   30.065   8.5780 -11.27332 11.89690 
1 1 1   16   19   37 f   32.091   7.4663   26.780   10.900   28.672   12.335   20.042   23.281   34.241   8.7131   29.942   12.127 4.299351 14.93261 
1 1 1   16   19   38 o   22.882   7.1455  -0.3348   10.794  -5.3062   12.124   18.659   23.698   16.737   7.6883   29.027   12.047 -12.29006 14.29108 
1 1 1   16   19   39 f   22.249   6.6987   6.3933   10.884   12.392   12.303 -15.2066   23.346   23.778   9.0542   20.720   9.8749 3.057217 13.39749 
1 1 1   16   19   40 o   24.232   7.9650  -3.3366   19.846 -21.4897   30.135   10.567   26.373   22.073   10.696   26.391   11.805 -4.318655 15.93007 
1 1 1   16   19   41 o   22.553   7.2174   3.4034   11.975   1.2141   13.496   11.511   25.971   19.134   8.5099   25.972   11.659 -6.837925 14.43473 
1 1 1   16   20    0 o   97.886   2.1562  198.324   12.284  198.324   12.284  198.324   12.284   97.886   3.0494   97.886   3.0494 0.000000 0.000000 
1 1 1   16   20    1 o  202.849   2.3699  851.895   19.644  863.520   26.166  836.880   29.737  204.466   3.1028  201.233   3.5829 3.232361 4.739707 
1 1 1   16   20    2 o   37.401   4.1753   30.636   6.0001   34.887   7.8151   24.532   9.3645   41.057   4.6151   33.745   6.9595 7.312462 8.350632 
1 1 1   16   20    3 o  111.173   2.3945  254.265   10.937  267.432   16.347  243.595   14.716  113.761   3.4840  108.585   3.2858 5.175880 4.789039 
1 1 1   16   20    4 o   80.842   2.4378  132.020   7.9179  148.126   13.027  122.583   9.9712   84.651   3.7311   77.034   3.1384 7.617058 4.875507 
1 1 1   16   20    5 o  213.927   2.3517  940.068   20.073  967.185   33.074  924.256   25.256  216.305   3.7073  211.549   2.8946 4.756180 4.703487 
1 1 1   16   20    6 o  112.423   2.2486  260.283   10.158  264.749   16.388  257.496   12.945  113.181   3.5107  111.664   2.8107 1.517075 4.497238 
1 1 1   16   20    7 o  159.642   2.3160  526.765   15.124  525.237   22.885  527.951   20.152  159.417   3.4806  159.868   3.0562 -0.4514008 4.631961 
1 1 1   16   20    8 o  163.477   2.3050  556.042   15.406  517.134   22.863  588.399   20.849  158.177   3.5045  168.776   2.9951 -10.59865 4.610036 
1 1 1   16   20    9 o   68.591   2.9265  102.831   7.8096   75.578   12.191  121.799   10.171   60.404   4.8932   76.779   3.2117 -16.37418 5.853099 
1 1 1   16   20   10 o  119.858   2.4466  296.258   12.045  304.116   17.962  289.838   16.236  121.288   3.5907  118.427   3.3241 2.860550 4.893110 
1 1 1   16   20   11 o  132.117   2.5131  360.663   13.683  341.246   19.120  381.048   19.591  128.469   3.6084  135.765   3.4987 -7.296234 5.026100 
1 1 1   16   20   12 o  130.150   2.4603  351.230   13.164  334.254   19.101  366.588   18.168  127.129   3.6428  133.170   3.3078 -6.040627 4.920545 
1 1 1   16   20   13 o  123.445   3.0252  318.428   15.256  275.609   21.979  358.244   21.194  115.320   4.6210  131.569   3.9056 -16.24902 6.050429 
1 1 1   16   20   14 o  253.489   2.5509  1329.88   25.975  1327.19   41.744  1331.59   33.182  253.186   3.9975  253.791   3.1700 -0.6050568 5.101837 
1 1 1   16   20   15 o  130.405   2.3695  348.713   12.467  366.088   20.022  337.708   15.934  132.998   3.6500  127.811   3.0226 5.187126 4.739010 
1 1 1   16   20   16 f  252.989   2.7099  1326.69   28.164  1311.70   41.604  1339.36   38.264  251.618   4.0089  254.359   3.6474 -2.741150 5.419816 
1 1 1   16   20   17 o   79.478   2.9585  131.501   9.6539  123.129   14.040  139.010   13.296   77.044   4.4183   81.912   3.9356 -4.867416 5.916937 
1 1 1   16   20   18 o   26.275   5.9092   14.467   7.3569   9.7966   11.367   17.835   9.6510   23.894   8.7832   28.656   7.9075 -4.761337 11.81835 
1 1 1   16   20   19 o  197.222   3.1905  810.161   25.673  799.335   39.146  818.330   34.007  195.940   4.8440  198.504   4.1536 -2.564362 6.380983 
1 1 1   16   20   20 o   69.568   5.3325  108.688   14.238   80.291   22.829  126.765   18.215   61.291   9.0308   77.845   5.6732 -16.55438 10.66495 
1 1 1   16   20   21 o  121.817   2.5931  308.314   13.015  302.253   18.721  313.984   18.107  120.635   3.7625  122.998   3.5693 -2.362366 5.186215 
1 1 1   16   20   22 o   31.879   6.6226   21.274   9.0795   17.229   11.413   28.249   14.986   28.281   8.8244   35.476   9.8775 -7.195507 13.24517 
1 1 1   16   20   23 o  193.096   3.3727  779.838   26.815  789.165   37.002  769.521   38.916  194.395   4.6150  191.797   4.9195 2.597992 6.745340 
1 1 1   16   20   24 o   63.248   4.7434   83.673   12.374   0.0000   0.0000   83.673   12.374  ?   ?    63.248   4.7434      ?      ? 
1 1 1   16   20   25 o  130.286   2.7730  354.665   14.882  336.879   21.147  372.120   20.948  127.000   4.0372  133.573   3.8024 -6.572990 5.545920 
1 1 1   16   20   26 o   53.458   4.0670   61.546   8.7801   48.544   12.613   73.770   12.230   47.716   6.4091   59.201   5.0087 -11.48447 8.134051 
1 1 1   16   20   27 o   71.953   3.3030  108.371   9.7836  115.428   14.381  102.292   13.348   74.116   4.7046   69.790   4.6374 4.326202 6.605934 
1 1 1   16   20   28 o   38.372   5.6597   32.574   8.8447   24.875   12.191   41.130   12.851   33.043   8.7916   43.702   7.1298 -10.65946 11.31931 
1 1 1   16   20   29 o   34.413   5.6918   27.438   8.0858   19.103   11.661   35.157   11.222   29.064   8.8956   39.762   7.1033 -10.69866 11.38368 
1 1 1   16   20   30 o   60.510   4.9127   81.919   11.391   87.454   14.086   71.456   19.367   64.169   5.3223   56.852   8.2592 7.316154 9.825500 
1 1 1   16   20   31 o   87.175   3.1378  160.094   11.271  166.708   16.381  154.147   15.533   88.867   4.4692   85.482   4.4056 3.385574 6.275605 
1 1 1   16   20   32 o   41.722   6.7003   50.052   10.945   18.522   22.550   59.770   12.519   30.710   12.102   52.735   5.7556 -22.02548 13.40055 
1 1 1   16   20   33 o   62.129   4.0670   84.307   10.267   69.123   14.635   99.023   14.408   56.272   6.3057   67.986   5.1382 -11.71444 8.134094 
1 1 1   16   20   34 o   23.723   5.6645   9.0540   8.1651  -7.5741   12.113   22.900   11.054   16.382   7.5821   31.064   8.4177 -14.68202 11.32899 
1 1 1   16   20   35 o   50.757   4.5551   56.331   9.4637   65.623   14.446   49.346   12.526   54.368   6.4423   47.146   6.4415 7.221966 9.110198 
1 1 1   16   20   36 o   48.726   4.7875   53.100   9.6004   55.644   14.153   50.931   13.066   49.727   6.9006   47.724   6.6381 2.003300 9.575079 
1 1 1   16   20   37 f   41.212   7.6586   38.344   11.814   30.249   13.561   63.831   24.062   34.605   9.3014   47.820   12.170 -13.21527 15.31718 
1 1 1   16   20   38 o   22.317   7.3360   2.0273   11.916   6.4900   12.308 -64.6601   47.579   20.976   8.6916   23.658   11.820 -2.681915 14.67192 
1 1 1   16   20   39 o   28.981   7.9086   20.489   12.396   16.947   14.685   29.268   23.119   26.291   9.9205   31.671   12.319 -5.380386 15.81717 
1 1 1   16   20   40 o   33.757   8.5359   30.775   13.525   23.671   15.666   51.564   26.801   29.166   10.365   38.349   13.565 -9.183197 17.07170 
1 1 1   16   21    0 f  169.779   2.1025  595.466   20.807  595.466   20.807  595.466   20.807  169.779   2.9734  169.779   2.9734 0.000000 0.000000 
1 1 1   16   21    1 o   55.200   3.0960   64.272   6.8650   69.540   8.9862   56.888   10.639   57.995   3.7568   52.405   4.9221 5.589233 6.192042 
1 1 1   16   21    2 o   37.648   4.4741   29.784   6.7879   32.778   9.8872   27.115   9.3356   39.735   6.0330   35.560   6.6085 4.175049 8.948146 
1 1 1   16   21    3 o  189.820   2.4068  743.104   18.730  758.294   28.201  731.116   25.053  191.532   3.5700  188.108   3.2291 3.423431 4.813697 
1 1 1   16   21    4 o  150.360   2.2636  468.433   13.882  457.918   21.145  476.399   18.404  148.850   3.4442  151.870   2.9382 -3.019440 4.527242 
1 1 1   16   21    5 o  234.231   2.4206  1131.36   22.692  1144.38   36.948  1123.48   28.753  235.249   3.8080  233.213   2.9893 2.036362 4.841116 
1 1 1   16   21    6 o  109.671   2.4585  250.028   10.998  206.027   15.456  295.165   15.654   99.819   3.7541  119.522   3.1755 -19.70330 4.917006 
1 1 1   16   21    7 o  123.585   2.3476  318.886   11.837  285.742   17.466  347.038   16.098  117.562   3.6022  129.609   3.0113 -12.04684 4.695105 
1 1 1   16   21    8 o  177.411   2.2634  650.607   16.129  649.735   25.932  651.157   20.599  177.271   3.5468  177.551   2.8129 -0.2789307 4.526821 
1 1 1   16   21    9 o   49.256   3.3609   50.405   6.5347   49.831   10.929   50.725   8.1525   49.001   5.4078   49.510   3.9924 -0.5088730 6.721876 
1 1 1   16   21   10 o  239.986   2.7408  1188.98   27.087  1143.39   37.072  1241.20   39.673  235.074   3.8237  244.899   3.9277 -9.825287 5.481575 
1 1 1   16   21   11 o  118.776   2.3173  291.015   11.069  294.688   17.798  288.699   14.136  119.353   3.6154  118.200   2.8996 1.152931 4.634538 
1 1 1   16   21   12 o  113.304   2.8370  264.028   12.635  271.759   21.543  259.974   15.600  114.492   4.5620  112.116   3.3737 2.375679 5.673945 
1 1 1   16   21   13 o   33.283   5.5354   25.773   7.3908   16.199   13.064   30.281   8.9632   28.417   9.4926   38.149   5.6966 -9.732363 11.07071 
1 1 1   16   21   14 o  114.855   2.5688  272.904   12.140  275.641   17.826  270.536   16.580  115.377   3.7460  114.332   3.5160 1.045647 5.137618 
1 1 1   16   21   15 o   66.197   3.3970   95.223   8.8474   68.999   13.314  115.958   11.839   57.572   5.6072   74.821   3.8365 -17.24891 6.794036 
1 1 1   16   21   16 o  145.552   2.6025  438.580   15.609  412.955   21.794  465.568   22.366  141.179   3.7429  149.926   3.6170 -8.747040 5.205025 
1 1 1   16   21   17 o  150.900   3.0144  473.783   18.726  446.389   26.705  500.286   26.267  146.562   4.4178  155.239   4.1024 -8.677704 6.028815 
1 1 1   16   21   18 f   77.919   3.0002  127.133   9.5569  117.090   14.128  135.605   12.976   75.013   4.5665   80.825   3.8926 -5.812317 6.000419 
1 1 1   16   21   19 o   25.768   6.4776   12.639   8.0935   9.9528   15.722   13.608   9.4405   26.114   10.159   25.422   8.0395 0.6921787 12.95511 
1 1 1   16   21   20 o   61.624   4.6018   80.926   10.609   78.059   19.466   82.137   12.653   60.541   7.7958   62.708   4.8920 -2.166653 9.203658 
1 1 1   16   21   21 o   40.150   6.5555   38.004   11.271   19.194   17.272   51.954   14.874   30.877   10.893   49.423   7.2967 -18.54630 13.11098 
1 1 1   16   21   22 o   28.677   5.9045   18.043   7.3381   17.682   11.481   18.293   9.5415   28.570   8.8404   28.785   7.8294 -0.2158794 11.80892 
1 1 1   16   21   23 o   30.588   5.8579   20.886   7.5475   20.695   11.288   21.040   10.150   30.465   8.6045   30.711   7.9511 -0.2460022 11.71570 
1 1 1   16   21   24 o   64.293   3.5174   88.414   9.1597   73.317   13.401  101.652   12.549   58.909   5.5155   69.676   4.3666 -10.76717 7.034777 
1 1 1   16   21   25 o   62.441   3.8677   83.613   9.7704   74.701   14.833   90.444   12.986   59.283   6.0663   65.598   4.7997 -6.314434 7.735409 
1 1 1   16   21   26 o  112.107   3.2854  263.599   14.918  262.017   19.335  265.926   23.450  111.882   4.1900  112.332   5.0614 -0.4503479 6.570735 
1 1 1   16   21   27 o   58.774   3.6675   72.241   8.8446   80.235   13.355   65.997   11.804   61.624   5.2545   55.924   5.1177 5.700146 7.334915 
1 1 1   16   21   28 o   40.398   5.0329   35.434   8.1691   40.978   12.360   31.133   10.886   43.526   6.8848   37.270   7.3430 6.255993 10.06584 
1 1 1   16   21   29 o   57.285   4.4485   71.088   10.331   74.127   13.619   66.970   15.854   58.979   5.5987   55.590   6.9147 3.388798 8.897064 
1 1 1   16   21   30 o   59.881   5.6046   90.129   11.475  109.157   14.226   54.701   19.412   71.779   4.8053   47.984   10.127 23.79513 11.20913 
1 1 1   16   21   31 o   49.883   4.3683   53.793   8.9652   54.043   13.153   53.576   12.252   49.911   6.3894   49.855   5.9585 0.5566788E-01 8.736648 
1 1 1   16   21   32 o   46.262   6.9753   73.162   12.350   5.8907   31.052   85.804   13.461   29.245   12.962   63.280   5.1575 -34.03514 13.95056 
1 1 1   16   21   33 o   20.956   5.7187   5.3579   7.8947  -6.3189   11.960   14.375   10.510   16.627   7.6370   25.286   8.5140 -8.658787 11.43731 
1 1 1   16   21   34 f   30.725   6.2674   23.207   8.5145   18.629   12.670   26.977   11.498   27.946   9.3486   33.504   8.3503 -5.558229 12.53488 
1 1 1   16   21   35 o   17.865   5.4836  -4.2380   7.8873   8.8944   12.358 -13.2648   10.245   22.498   8.9290   13.232   6.3681 9.266471 10.96720 
1 1 1   16   21   36 o   19.810   5.9408   3.6412   8.4019   4.4355   12.408   2.9686   11.418   20.400   8.6081   19.219   8.1899 1.180914 11.88160 
1 1 1   16   21   37 o   31.886   7.3203   27.928   10.919   30.425   12.719   20.935   21.288   34.705   8.8566   29.067   11.658 5.638029 14.64067 
1 1 1   16   21   38 o   26.510   7.8656   15.524   12.514   19.540   12.918 -45.6174   50.406   27.666   9.4387   25.353   12.585 2.312155 15.73121 
1 1 1   16   21   39 o   53.906   7.5038   72.164   14.718   61.189   17.197  102.217   28.458   48.942   8.8448   58.870   12.124 -9.927616 15.00755 
1 1 1   16   21   40 o   39.358   7.4481   50.903   13.770   59.109   15.868   25.885   27.708   49.178   7.8232   29.537   12.676 19.64115 14.89615 
1 1 1   16   22    0 o   41.441   3.5790   37.059   8.3061   37.059   8.3061   37.059   8.3061   41.441   5.0614   41.441   5.0614 0.000000 0.000000 
1 1 1   16   22    1 o  101.373   2.5052  212.230   10.461  217.137   15.251  207.871   14.376  102.474   3.6085  100.273   3.4761 2.200623 5.010420 
1 1 1   16   22    2 o  225.232   2.6457  1049.16   24.576  1057.09   34.943  1041.40   34.571  226.073   3.7476  224.391   3.7355 1.682831 5.291323 
1 1 1   16   22    3 o  187.010   2.5239  722.074   19.451  696.289   26.844  750.578   28.223  183.504   3.5468  190.517   3.5918 -7.013062 5.047822 
1 1 1   16   22    4 o  277.947   2.5991  1601.55   29.061  1580.91   46.391  1614.88   37.283  276.378   4.0698  279.516   3.2340 -3.138214 5.198216 
1 1 1   16   22    5 o   61.277   2.9573   79.495   7.0903   71.880   11.789   83.812   8.8751   58.884   4.8540   63.669   3.3797 -4.785538 5.914694 
1 1 1   16   22    6 o  107.861   2.3744  239.117   10.448  249.933   16.151  231.333   13.702  109.929   3.5622  105.793   3.1402 4.135201 4.748724 
1 1 1   16   22    7 o  115.832   2.2793  276.931   10.606  279.304   17.088  275.445   13.527  116.203   3.5654  115.461   2.8405 0.7420273 4.558572 
1 1 1   16   22    8 o   38.111   4.0185   28.535   6.1022   36.897   10.412   24.160   7.5311   42.113   5.9946   34.108   5.3534 8.004826 8.037073 
1 1 1   16   22    9 o   65.672   2.8713   88.370   7.5016   92.867   12.506   85.842   9.3757   66.929   4.5303   64.415   3.5290 2.514473 5.742598 
1 1 1   16   22   10 o  142.497   2.3949  418.070   13.986  436.972   21.186  403.469   18.620  145.318   3.5348  139.675   3.2322 5.642960 4.789709 
1 1 1   16   22   11 o  111.006   2.5359  254.566   11.555  259.883   17.280  250.266   15.540  112.035   3.7396  109.978   3.4260 2.057022 5.071715 
1 1 1   16   22   12 o  218.588   2.8438  999.253   24.173  961.875   41.430  1018.55   29.765  215.280   4.6660  221.895   3.2523 -6.614685 5.687593 
1 1 1   16   22   13 o   77.443   3.2351  128.538   9.7489  111.237   16.165  138.428   12.222   73.121   5.3600   81.765   3.6241 -8.643829 6.470224 
1 1 1   16   22   14 o  133.911   2.5511  371.583   14.081  368.280   20.229  374.688   19.612  133.322   3.6789  134.501   3.5354 -1.179077 5.102259 
1 1 1   16   22   15 o   46.628   4.5597   45.267   8.7252   39.460   11.853   52.136   12.891   43.365   6.6271   49.892   6.2646 -6.526596 9.119380 
1 1 1   16   22   16 o   17.205   5.0076  -1.0217   6.5358 -13.1554   10.209   7.4056   8.5079   13.672   6.5197   20.738   7.6024 -7.066663 10.01514 
1 1 1   16   22   17 o  110.211   3.0622  244.301   13.034  276.554   23.505  229.980   15.662  115.142   4.9495  105.281   3.6069 9.860245 6.124321 
1 1 1   16   22   18 o   78.592   3.4181  129.940   10.825  134.016   14.025  123.936   17.023   80.238   4.2381   76.946   5.3640 3.292068 6.836222 
1 1 1   16   22   19 o   52.425   4.0506   59.274   8.4948   44.561   12.331   72.566   11.720   45.926   6.5097   58.925   4.8223 -12.99927 8.101243 
1 1 1   16   22   20 o   30.604   6.5192   16.362   8.2166   32.152   16.280   10.965   9.5177   37.683   10.217   23.525   8.0995 14.15809 13.03834 
1 1 1   16   22   21 o   54.522   4.4553   63.454   9.7754   66.071   12.683   59.624   15.343   56.081   5.4831   52.964   7.0239 3.117283 8.910679 
1 1 1   16   22   22 o   96.186   2.7919  193.025   11.061  193.384   16.064  192.702   15.253   96.242   4.0469   96.129   3.8472 0.1131439 5.583791 
1 1 1   16   22   23 o   62.184   3.8068   80.838   9.5198   85.142   15.427   78.190   12.098   63.363   5.9032   61.005   4.8082 2.358192 7.613530 
1 1 1   16   22   24 o   32.081   5.7737   23.480   7.6924   20.094   11.435   26.279   10.397   29.897   8.7291   34.265   7.5594 -4.368256 11.54738 
1 1 1   16   22   25 o   92.007   3.6239  180.308   13.555  192.097   18.110  165.292   20.440   95.661   4.5901   88.353   5.6090 7.307869 7.247736 
1 1 1   16   22   26 o   40.084   6.1110   40.349   10.159   55.129   13.086   17.931   16.117   50.794   6.2464   29.375   10.505 21.41901 12.22204 
1 1 1   16   22   27 o   25.039   6.0301   13.276   7.4732   11.741   11.109   14.545   10.100   24.293   8.7182   25.785   8.3330 -1.491745 12.06010 
1 1 1   16   22   28 o   78.374   3.2249  130.456   10.344  116.093   14.953  143.633   14.323   74.076   4.8943   82.671   4.2007 -8.594719 6.449784 
1 1 1   16   22   29 o   72.055   3.7599  109.941   11.040  106.080   14.429  115.392   17.144   70.697   4.9485   73.414   5.6621 -2.716324 7.519770 
1 1 1   16   22   30 o   73.051   3.4716  113.546   10.453  109.740   14.860  117.273   14.706   71.790   5.0188   74.313   4.7980 -2.523781 6.943250 
1 1 1   16   22   31 f   31.556   6.0944   23.392   8.1092   25.228   12.270   21.968   10.805   32.546   8.8895   30.566   8.3394 1.980133 12.18883 
1 1 1   16   22   32 o   38.150   6.6058   40.640   10.593   17.109   20.934   48.739   12.282   29.148   11.605   47.153   6.3152 -18.00509 13.21167 
1 1 1   16   22   33 o   46.003   5.0645   49.359   9.0672   39.261   13.454   57.762   12.273   40.621   8.3103   51.384   5.7911 -10.76317 10.12905 
1 1 1   16   22   34 o   33.502   6.0213   27.164   8.2765   27.866   12.661   26.640   10.937   33.645   8.9629   33.358   8.0430 0.2864609 12.04261 
1 1 1   16   22   35 o   40.184   5.5836   38.638   8.9819   32.932   13.288   43.439   12.188   36.471   8.9101   43.896   6.7317 -7.425106 11.16715 
1 1 1   16   22   36 o   20.608   6.0379   5.7064   8.5844   0.4971   13.133   9.5927   11.343   19.142   8.4597   22.074   8.6172 -2.931276 12.07572 
1 1 1   16   22   37 o   22.668   5.9988   5.3538   10.534   22.831   12.318 -42.2011   20.319   29.783   9.1473   15.552   7.7635 14.23059 11.99767 
1 1 1   16   22   38 o   19.430   6.4671  -6.0139   11.487  -6.4678   13.234  -4.6273   23.132   16.831   7.8361   22.028   10.290 -5.196320 12.93426 
1 1 1   16   22   39 o   25.517   7.7588   10.250   12.437   4.9554   14.095   28.865   26.428   20.653   8.9530   30.380   12.674 -9.727112 15.51757 
1 1 1   16   23    0 o   88.241   2.7482  161.809   14.082  161.809   14.082  161.809   14.082   88.241   3.8865   88.241   3.8865 0.000000 0.000000 
1 1 1   16   23    1 f  197.817   2.5565  809.363   20.854  823.695   29.831  795.664   29.166  199.527   3.6249  196.106   3.6059 3.421112 5.112967 
1 1 1   16   23    2 o   90.811   2.5915  170.663   9.6915  170.264   14.093  171.020   13.349   90.702   3.7672   90.921   3.5597 -0.2184067 5.183022 
1 1 1   16   23    3 o   73.754   2.7521  115.656   8.0421  100.345   12.829  125.568   10.322   69.578   4.4703   77.929   3.2115 -8.350861 5.504297 
1 1 1   16   23    4 o   29.610   4.9178   17.873   5.7935   24.807   9.5991   13.900   7.2661   33.844   7.1032   25.375   6.8034 8.468996 9.835689 
1 1 1   16   23    5 o  166.368   2.3462  569.335   15.908  592.288   24.670  552.999   20.812  169.189   3.5354  163.546   3.0854 5.642654 4.692428 
1 1 1   16   23    6 o   76.535   2.9439  121.352   9.2913  120.173   12.993  122.587   13.292   76.157   4.1365   76.913   4.1901 -0.7562408 5.887864 
1 1 1   16   23    7 o   83.310   2.7487  144.042   9.4108  139.864   13.792  147.681   12.874   82.161   4.0699   84.460   3.6956 -2.299561 5.497428 
1 1 1   16   23    8 o   91.693   2.7670  173.278   9.5814  176.355   17.588  171.980   11.426   92.188   4.6257   91.198   3.0376 0.9898529 5.533907 
1 1 1   16   23    9 o   87.122   2.7308  159.122   9.6923  139.283   14.244  176.228   13.226   81.968   4.2133   92.277   3.4752 -10.30938 5.461589 
1 1 1   16   23   10 o  152.716   2.4288  483.391   15.253  472.999   22.311  492.509   20.899  151.149   3.5789  154.283   3.2843 -3.133591 4.857535 
1 1 1   16   23   11 f   75.053   3.0902  114.651   8.4642  121.779   16.604  112.148   9.8386   76.491   5.2629   73.615   3.2404 2.876389 6.180451 
1 1 1   16   23   12 o  201.305   2.7150  841.185   20.509  838.332   37.857  842.370   24.399  200.830   4.5704  201.780   2.9318 -0.9495239 5.429933 
1 1 1   16   23   13 o   31.227   5.8293   20.903   6.4052   20.481   15.015   20.997   7.0819   31.228   10.165   31.227   5.7090 0.1489639E-02 11.65868 
1 1 1   16   23   14 o   74.999   3.5409  117.354   10.754  117.688   13.960  116.868   16.867   75.209   4.5003   74.789   5.4681 0.4199905 7.081862 
1 1 1   16   23   15 o   83.266   3.2806  143.953   11.149  141.101   14.679  147.841   17.140   82.351   4.3217   84.181   4.9368 -1.830368 6.561134 
1 1 1   16   23   16 o   74.458   3.3538  115.220   10.166  112.878   13.288  118.526   15.788   73.614   4.3764   75.303   5.0832 -1.688194 6.707614 
1 1 1   16   23   17 o   65.290   3.2190   88.614   8.6325   92.548   12.910   85.434   11.610   66.569   4.7020   64.010   4.3975 2.559486 6.437923 
1 1 1   16   23   18 o   81.582   2.8425  138.535   9.5473  139.240   13.941  137.912   13.102   81.755   4.1344   81.409   3.9021 0.3460617 5.685033 
1 1 1   16   23   19 o   95.950   2.7915  191.110   11.032  179.266   15.165  204.420   16.076   92.798   3.9623   99.102   3.9332 -6.303741 5.582951 
1 1 1   16   23   20 o   28.408   6.0645   9.0700   7.9380   36.228   15.784  -0.1245   9.1840   39.857   9.6946   16.959   7.2888 22.89795 12.12900 
1 1 1   16   23   21 o   50.308   5.4901   60.680   9.4931   44.233   17.399   67.651   11.328   43.873   9.8557   56.743   4.8403 -12.87038 10.98017 
1 1 1   16   23   22 o   57.108   3.7447   70.717   8.5560   54.292   12.558   84.947   11.689   50.556   6.0225   63.660   4.4518 -13.10464 7.489316 
1 1 1   16   23   23 o   84.267   3.0610  149.092   10.571  145.890   15.767  151.706   14.247   83.363   4.5859   85.172   4.0557 -1.809555 6.122024 
1 1 1   16   23   24 o  116.877   2.8448  286.039   13.690  268.928   19.462  302.795   19.260  113.356   4.1628  120.399   3.8785 -7.042580 5.689625 
1 1 1   16   23   25 o   85.007   3.0269  152.178   10.573  144.718   15.383  158.857   14.555   82.949   4.4966   87.066   4.0533 -4.117165 6.053745 
1 1 1   16   23   26 o   89.144   3.2504  170.031   11.666  153.702   18.059  181.724   15.282   85.175   5.1406   93.113   3.9792 -7.937431 6.500771 
1 1 1   16   23   27 o   74.013   3.3266  116.693   10.065  105.360   14.735  126.608   13.782   70.472   5.0696   77.553   4.3086 -7.081360 6.653174 
1 1 1   16   23   28 o   75.172   4.7431  139.152   12.535   82.863   21.338  168.815   15.490   60.806   8.5084   89.538   4.1945 -28.73211 9.486151 
1 1 1   16   23   29 f   38.175   6.4085   36.423   9.9955   42.369   12.297   24.841   17.161   44.003   6.7754   32.347   10.880 11.65633 12.81692 
1 1 1   16   23   30 o   27.747   6.4962   17.503   8.7554   13.700   12.178   21.571   12.596   25.351   9.1250   30.142   9.2486 -4.790735 12.99241 
1 1 1   16   23   31 o   31.897   6.1829   24.713   8.3952   21.156   13.163   27.151   10.900   29.755   9.5019   34.039   7.9138 -4.283924 12.36589 
1 1 1   16   23   32 o   51.732   4.4724   59.440   9.4784   57.023   14.037   61.467   12.851   50.525   6.7358   52.940   5.8855 -2.414871 8.944863 
1 1 1   16   23   33 o   29.357   7.3507   17.540   9.5488   30.625   20.649   13.981   10.769   33.923   11.916   24.792   8.6111 9.130318 14.70146 
1 1 1   16   23   34 o   45.985   4.6906   47.549   8.8372   47.582   13.251   47.522   11.860   45.772   7.0192   46.199   6.2241 -0.4273376 9.381279 
1 1 1   16   23   35 o   29.767   6.4004   22.479   8.5539   22.105   12.440   22.814   11.781   29.478   9.2154   30.057   8.8846 -0.5789413 12.80073 
1 1 1   16   23   36 o   19.515   6.2912  -2.2818   10.866   1.7519   13.004 -11.6115   19.777   19.409   8.5032   19.621   9.2744 -0.2122841 12.58246 
1 1 1   16   23   37 o   22.912   6.9759   6.4195   10.595   3.0252   12.316   16.081   20.779   19.268   8.3606   26.557   11.169 -7.289658 13.95186 
1 1 1   16   23   38 o   30.243   7.9263   26.551   12.681   26.114   15.200   27.552   23.003   30.386   10.239   30.100   12.102 0.2861366 15.85252 
1 1 1   16   24    0 o  123.251   2.3402  314.449   16.796  314.449   16.796  314.449   16.796  123.251   3.3095  123.251   3.3095 0.000000 0.000000 
1 1 1   16   24    1 o  174.587   2.5042  630.839   18.031  624.944   25.349  636.875   25.653  173.762   3.5371  175.412   3.5458 -1.649323 5.008393 
1 1 1   16   24    2 o   61.967   3.0885   79.353   7.8797   85.488   11.535   73.985   10.789   64.206   4.3559   59.728   4.3798 4.477280 6.177072 
1 1 1   16   24    3 o  100.216   2.6534  203.346   9.9899  219.207   18.757  197.065   11.803  102.802   4.4237   97.630   2.9313 5.172050 5.306745 
1 1 1   16   24    4 o   38.142   4.7446   27.743   6.4822   38.277   13.179   24.381   7.4450   42.041   7.8902   34.242   5.2716 7.799210 9.489174 
1 1 1   16   24    5 o   89.395   2.5475  168.554   9.1882  147.067   13.976  184.910   12.194   84.240   4.0226   94.551   3.1268 -10.31087 5.094926 
1 1 1   16   24    6 o  139.624   2.3291  406.464   13.231  382.896   20.111  424.453   17.570  135.984   3.5857  143.264   2.9735 -7.280182 4.658184 
1 1 1   16   24    7 o  125.248   2.2669  319.408   11.346  345.240   18.816  304.647   14.224  129.117   3.5332  121.379   2.8412 7.738663 4.533852 
1 1 1   16   24    8 o  101.126   2.3774  208.973   9.5679  222.227   15.977  201.561   11.947  103.543   3.7412   98.708   2.9345 4.835060 4.754790 
1 1 1   16   24    9 o  120.054   2.8574  305.848   13.728  266.875   21.380  333.191   17.908  113.292   4.5755  126.817   3.4238 -13.52478 5.714720 
1 1 1   16   24   10 o  152.511   2.4153  482.041   15.131  481.769   22.428  482.269   20.499  152.438   3.5672  152.585   3.2573 -0.1465607 4.830584 
1 1 1   16   24   11 o   94.752   2.8490  187.429   9.9879  184.251   18.804  188.678   11.788   94.040   4.8481   95.464   2.9939 -1.424835 5.698061 
1 1 1   16   24   12 o   52.437   3.3857   58.823   6.7900   53.086   11.787   61.673   8.3068   50.360   5.6747   54.513   3.6946 -4.153194 6.771419 
1 1 1   16   24   13 o  138.535   2.3853  403.100   13.384  367.077   20.424  430.214   17.719  132.955   3.7246  144.115   2.9811 -11.15977 4.770662 
1 1 1   16   24   14 o   91.326   2.8267  174.446   10.585  156.195   15.187  191.682   14.760   86.605   4.2518   96.048   3.7258 -9.443665 5.653307 
1 1 1   16   24   15 o   27.361   6.0177   16.065   7.8162   21.259   10.517   9.6559   11.682   30.955   8.1321   23.768   8.8723 7.186859 12.03536 
1 1 1   16   24   16 o   69.486   3.5379  101.584   9.9721  104.209   13.078   97.938   15.414   70.664   4.4871   68.308   5.4711 2.355560 7.075794 
1 1 1   16   24   17 o   44.301   4.7095   41.722   8.5013   42.747   11.275   40.371   12.942   45.032   6.0707   43.570   7.2018 1.461842 9.419079 
1 1 1   16   24   18 o  114.145   3.1771  274.479   14.143  278.838   17.459  266.159   24.121  115.741   3.6573  112.550   5.1962 3.191483 6.354239 
1 1 1   16   24   19 o   33.096   5.4187   24.814   7.2135   22.127   11.041   26.815   9.5283   31.335   8.3801   34.856   6.8720 -3.521168 10.83749 
1 1 1   16   24   20 o  119.280   4.0866  315.176   18.894  253.609   30.678  352.804   23.983  108.828   6.8346  129.732   4.4822 -20.90343 8.173284 
1 1 1   16   24   21 o   94.777   3.3798  195.491   12.321  168.800   20.843  209.828   15.276   89.264   5.6614  100.290   3.6932 -11.02639 6.759506 
1 1 1   16   24   22 o   63.428   3.8337   87.200   9.5443   77.219   15.611   93.157   12.061   60.187   6.2887   66.668   4.3863 -6.480026 7.667332 
1 1 1   16   24   23 o   91.987   2.8992  177.988   10.946  163.261   15.793  191.604   15.185   88.225   4.3401   95.750   3.8452 -7.525139 5.798461 
1 1 1   16   24   24 o   60.135   3.5864   76.499   8.8287   76.992   13.333   76.113   11.782   60.214   5.3688   60.056   4.7564 0.1579285 7.172704 
1 1 1   16   24   25 o   30.048   5.8653   20.741   7.4916   19.030   11.484   22.008   9.8846   28.975   8.8195   31.121   7.7345 -2.145916 11.73057 
1 1 1   16   24   26 o   21.415   5.8140   6.6750   7.2883   12.112   11.195   2.6758   9.6016   24.435   8.7539   18.394   7.6538 6.040308 11.62802 
1 1 1   16   24   27 o   78.706   3.2209  129.506   10.393  145.303   15.780  117.404   13.812   82.871   4.6167   74.542   4.4924 8.329155 6.441769 
1 1 1   16   24   28 o   28.553   6.0677   19.046   7.8890   14.346   11.639   23.040   10.730   25.690   8.9504   31.417   8.1949 -5.727016 12.13532 
1 1 1   16   24   29 o   42.351   6.1688   42.161   10.143   42.928   12.607   40.753   17.077   44.052   6.9388   40.650   10.202 3.401958 12.33767 
1 1 1   16   24   30 o   49.387   4.8385   53.782   9.8259   49.402   13.309   59.029   14.568   47.192   6.8377   51.581   6.8476 -4.388523 9.677025 
1 1 1   16   24   31 o   19.569   5.5441   3.7877   7.5716  -7.6546   11.897   11.577   9.8162   16.051   7.4586   23.086   8.2048 -7.035021 11.08820 
1 1 1   16   24   32 o   39.628   5.4396   36.609   8.5922   36.012   13.246   37.043   11.290   38.600   8.5456   40.656   6.7327 -2.055557 10.87921 
1 1 1   16   24   33 o   31.550   6.8064   27.069   9.7362   14.255   20.544   30.781   11.057   27.134   11.235   35.967   7.6867 -8.832905 13.61282 
1 1 1   16   24   34 o   24.073   5.9260   12.828   7.9981   2.6219   12.154   20.625   10.622   19.334   8.3474   28.812   8.4137 -9.477409 11.85196 
1 1 1   16   24   35 o   25.070   6.3693   14.625   8.5003   19.338   12.422   10.474   11.657   27.615   9.2564   22.526   8.7517 5.089710 12.73863 
1 1 1   16   24   36 o   32.082   7.2080   29.736   10.869   32.825   12.834   21.898   20.443   35.644   8.7859   28.519   11.429 7.124588 14.41604 
1 1 1   16   24   37 o   24.334   7.1722   12.699   11.902   15.687   14.487   6.4928   20.877   25.159   9.7614   23.509   10.511 1.649725 14.34430 
1 1 1   16   25    0 o   30.934   6.1144   24.036   9.5463   24.036   9.5463   24.036   9.5463   30.934   8.6471   30.934   8.6471 0.000000 0.000000 
1 1 1   16   25    1 o   80.136   2.8183  133.258   9.3140  132.323   13.234  134.175   13.111   79.854   4.0182   80.419   3.9528 -0.5648193 5.636546 
1 1 1   16   25    2 o   77.063   3.1996  123.699   9.9526  124.676   12.849  122.235   15.735   77.509   4.0195   76.617   4.9794 0.8913193 6.399279 
1 1 1   16   25    3 o  162.178   2.4840  542.426   16.572  495.687   22.598  596.811   24.376  154.650   3.5429  169.707   3.4826 -15.05746 4.967954 
1 1 1   16   25    4 o   81.096   2.8339  135.334   8.9870  140.229   15.512  132.861   11.026   82.109   4.5806   80.083   3.3382 2.025780 5.667898 
1 1 1   16   25    5 o   15.162   4.7193  -2.7545   5.8950  -8.1164   9.0849   1.1447   7.7474   13.950   6.4939   16.374   6.8494 -2.424507 9.438501 
1 1 1   16   25    6 o   99.451   2.4293  207.766   9.7267  190.982   15.168  219.487   12.676   95.932   3.8335  102.969   2.9848 -7.037437 4.858505 
1 1 1   16   25    7 o  101.231   2.4300  216.187   9.8862  193.423   15.355  232.306   12.921   96.530   3.8567  105.932   2.9573 -9.401093 4.860007 
1 1 1   16   25    8 o  141.780   2.2563  415.577   12.835  420.346   20.762  412.627   16.328  142.362   3.5360  141.198   2.8038 1.163620 4.512685 
1 1 1   16   25    9 o   42.110   4.0566   37.632   6.7370   35.419   11.126   38.913   8.4654   41.016   6.5767   43.204   4.7507 -2.187607 8.113126 
1 1 1   16   25   10 o   79.530   3.0698  137.449   8.8270  119.432   16.653  144.489   10.410   75.551   5.3443   83.510   3.0223 -7.958511 6.139664 
1 1 1   16   25   11 o   30.645   5.2874   22.964   6.1387   12.618   13.022   25.920   6.9607   26.058   9.4277   35.233   4.7900 -9.175764 10.57478 
1 1 1   16   25   12 o   72.981   2.8310  114.527   7.9947   99.458   13.416  122.825   9.9552   69.005   4.7140   76.956   3.1365 -7.951088 5.662048 
1 1 1   16   25   13 o   97.148   2.5206  199.362   9.7599  182.417   15.608  210.243   12.507   93.597   4.0431  100.699   3.0113 -7.101822 5.041267 
1 1 1   16   25   14 f  129.279   2.3370  350.087   12.068  333.508   19.430  360.499   15.398  126.654   3.7195  131.904   2.8304 -5.250557 4.673985 
1 1 1   16   25   15 o   90.077   2.6586  168.467   9.8522  173.311   14.541  164.357   13.396   91.250   3.8636   88.905   3.6532 2.344917 5.317274 
1 1 1   16   25   16 o   71.899   3.4028  108.579   9.9474  109.552   13.055  107.232   15.360   72.387   4.3727   71.411   5.2150 0.9760132 6.805669 
1 1 1   16   25   17 o  143.979   3.6467  430.594   18.233  425.480   20.747  447.939   38.211  142.931   3.5194  145.027   6.3882 -2.096191 7.293497 
1 1 1   16   25   18 o   39.673   5.4395   33.155   8.6219   24.225   11.120   46.617   13.653   32.757   8.2385   46.590   7.1050 -13.83325 10.87903 
1 1 1   16   25   19 o   88.617   2.8820  165.842   10.422  143.069   15.058  186.786   14.441   82.611   4.4194   94.623   3.7002 -12.01250 5.763907 
1 1 1   16   25   20 o  138.560   3.1822  402.785   18.179  388.483   25.608  417.313   25.811  136.047   4.5638  141.073   4.4360 -5.025955 6.364403 
1 1 1   16   25   21 o  107.803   3.5731  247.531   15.695  208.772   22.541  284.005   21.866   99.307   5.5033  116.299   4.5586 -16.99210 7.146128 
1 1 1   16   25   22 o   37.260   5.6392   36.123   8.3734   15.889   14.433   46.389   10.280   27.752   9.9396   46.767   5.3296 -19.01544 11.27834 
1 1 1   16   25   23 o  121.465   3.4692  312.303   17.247  315.889   23.103  307.788   25.923  122.447   4.5747  120.484   5.2166 1.963142 6.938333 
1 1 1   16   25   24 o   80.957   3.0535  137.621   10.168  142.083   15.036  133.861   13.801   82.117   4.4396   79.797   4.1934 2.319679 6.106968 
1 1 1   16   25   25 o   66.043   3.4773   93.028   9.3749   88.631   14.098   96.514   12.553   64.486   5.3005   67.599   4.5022 -3.112633 6.954537 
1 1 1   16   25   26 o   47.369   4.3215   47.679   8.3713   56.805   12.755   40.774   11.095   51.316   6.0264   43.422   6.1954 7.894070 8.642920 
1 1 1   16   25   27 o   63.575   4.0507   90.385   10.200   69.517   15.385  106.748   13.624   56.305   6.6252   70.844   4.6627 -14.53964 8.101484 
1 1 1   16   25   28 o   34.250   5.6678   27.961   8.3207   16.761   12.168   37.799   11.404   27.086   9.1609   41.415   6.6763 -14.32826 11.33551 
1 1 1   16   25   29 o   42.664   4.8974   40.343   8.5867   43.035   12.821   38.153   11.563   43.874   7.0855   41.454   6.7627 2.419754 9.794809 
1 1 1   16   25   30 o   21.171   5.9663   7.1214   8.0619   0.1774   13.320   11.136   10.127   19.465   8.5649   22.876   8.3084 -3.411030 11.93257 
1 1 1   16   25   31 o   17.607   5.5444  -2.0775   8.1913  -5.3625   11.434   1.3858   11.740   16.330   7.4883   18.884   8.1785 -2.553572 11.08881 
1 1 1   16   25   32 o   26.167   6.1625   16.547   8.0760   10.613   12.561   20.728   10.544   23.219   9.0669   29.115   8.3485 -5.896219 12.32502 
1 1 1   16   25   33 o   37.523   6.4323   41.425   10.293   18.631   19.948   49.697   12.017   28.047   11.272   46.999   6.1993 -18.95258 12.86458 
1 1 1   16   25   34 o   28.893   6.3346   20.684   8.5267   28.182   12.695   14.520   11.510   33.092   9.0434   24.695   8.8728 8.396086 12.66928 
1 1 1   16   25   35 o   27.655   6.9880   20.864   10.826   26.624   12.960   7.5680   19.690   31.605   9.3118   23.704   10.422 7.900959 13.97608 
1 1 1   16   25   36 o   29.483   7.5673   23.360   11.139   20.370   13.296   30.399   20.402   27.536   9.5677   31.431   11.727 -3.895502 15.13454 
1 1 1   16   26    0 f  101.188   3.0418  213.224   17.880  213.224   17.880  213.224   17.880  101.188   4.3018  101.188   4.3018 0.000000 0.000000 
1 1 1   16   26    1 o   86.707   3.1555  155.924   11.110  159.934   17.396  153.161   14.439   87.577   4.8160   85.837   4.0784 1.740341 6.310906 
1 1 1   16   26    2 o   73.355   2.9587  111.391   8.9252  100.466   12.201  123.966   13.090   69.493   4.2569   77.217   4.1102 -7.723640 5.917325 
1 1 1   16   26    3 o  160.699   2.4830  535.740   16.456  532.439   23.096  539.143   23.452  160.201   3.4954  161.197   3.5274 -0.9965668 4.965948 
1 1 1   16   26    4 o   33.554   4.5501   24.904   5.8515   21.628   9.7766   26.733   7.3043   31.322   7.6368   35.785   4.9489 -4.462700 9.100117 
1 1 1   16   26    5 o  120.555   2.4102  303.302   11.905  267.821   17.035  337.171   16.643  113.573   3.6366  127.537   3.1640 -13.96407 4.820353 
1 1 1   16   26    6 f  155.127   2.3094  500.021   14.541  493.766   22.595  504.443   18.998  154.217   3.5524  156.038   2.9520 -1.820328 4.618888 
1 1 1   16   26    7 o  104.759   2.3980  230.737   10.097  213.393   15.851  242.580   13.098  101.320   3.7931  108.199   2.9351 -6.879120 4.796087 
1 1 1   16   26    8 o   88.318   2.5439  164.425   8.9845  151.627   14.283  172.804   11.558   85.344   4.0577   91.292   3.0695 -5.948639 5.087884 
1 1 1   16   26    9 o   90.466   2.6190  170.031   9.6901  170.984   14.701  169.300   12.886   90.643   3.9323   90.288   3.4603 0.3551636 5.237952 
1 1 1   16   26   10 o   36.153   5.3646   32.835   7.0274   18.748   13.556   38.012   8.2178   29.649   9.6591   42.657   4.6709 -13.00828 10.72922 
1 1 1   16   26   11 o  105.621   2.3549  228.689   9.8503  241.760   16.616  221.606   12.231  107.830   3.7362  103.412   2.8677 4.418297 4.709869 
1 1 1   16   26   12 o   82.779   2.6425  145.208   8.5260  133.994   14.366  151.306   10.593   80.140   4.3463   85.418   3.0069 -5.277519 5.285063 
1 1 1   16   26   13 o   59.756   3.3871   82.862   7.3977   53.945   12.398   98.850   9.2186   50.528   5.9491   68.983   3.2401 -18.45483 6.774197 
1 1 1   16   26   14 f  135.131   2.5100  381.338   13.929  366.655   20.437  394.076   19.034  132.624   3.7361  137.637   3.3529 -5.013382 5.020038 
1 1 1   16   26   15 o   35.311   5.0350   29.936   6.9893   16.922   11.027   38.675   9.0364   27.767   8.6756   42.855   5.1125 -15.08752 10.06991 
1 1 1   16   26   16 o   71.077   3.0340  105.477   8.8400  108.382   13.330  103.196   11.811   71.897   4.4953   70.258   4.0758 1.638206 6.067947 
1 1 1   16   26   17 o   78.832   3.0521  130.072   9.9114  121.334   13.809  139.357   14.234   76.080   4.4008   81.585   4.2302 -5.505379 6.104190 
1 1 1   16   26   18 o   52.527   4.3686   57.544   9.3568   47.685   12.325   70.955   14.375   47.287   6.3195   57.767   6.0335 -10.47998 8.737177 
1 1 1   16   26   19 o   70.591   3.5809  103.267   10.325   92.363   13.507  118.596   16.015   66.220   4.9455   74.961   5.1799 -8.740990 7.161710 
1 1 1   16   26   20 o   53.817   3.7694   61.701   8.2711   59.217   12.528   63.620   11.012   52.728   5.7605   54.905   4.8630 -2.176414 7.538700 
1 1 1   16   26   21 o   47.479   6.9449   48.402   9.6137   57.380   25.843   46.960   10.357   47.926   12.822   47.031   5.3393 0.8956909 13.88973 
1 1 1   16   26   22 o  104.489   3.2854  233.407   13.296  221.066   22.812  239.756   16.363  101.940   5.4257  107.039   3.7063 -5.099159 6.570812 
1 1 1   16   26   23 o   61.052   3.6940   80.969   9.0904   67.621   13.565   91.851   12.247   56.145   5.8578   65.959   4.5020 -9.814125 7.387913 
1 1 1   16   26   24 o   24.326   5.9223   11.522   7.2220   17.713   11.405   7.3783   9.3313   27.926   8.8370   20.726   7.8869 7.200480 11.84464 
1 1 1   16   26   25 o   44.721   4.4656   44.075   8.0721   39.759   12.298   47.342   10.699   42.500   7.0161   46.942   5.5262 -4.442528 8.931149 
1 1 1   16   26   26 o   54.970   5.1520   71.872   10.506   86.775   13.707   50.644   16.359   63.586   5.2266   46.354   8.8802 17.23220 10.30409 
1 1 1   16   26   27 o   18.688   5.5497   1.6436   7.6387  -6.4848   11.822   7.4697   10.009   16.468   7.5745   20.908   8.1131 -4.439917 11.09938 
1 1 1   16   26   28 o   33.097   6.3210   23.528   9.9818   7.1766   13.050   46.581   15.495   22.153   9.0395   44.042   8.8378 -21.88828 12.64193 
1 1 1   16   26   29 o   25.566   6.0726   15.241   7.9053   8.7638   12.209   19.916   10.373   22.368   8.8758   28.765   8.2900 -6.397333 12.14510 
1 1 1   16   26   30 o   62.689   3.9320   88.335   9.8287   71.760   14.899  101.106   13.078   56.780   6.3621   68.598   4.6224 -11.81800 7.864015 
1 1 1   16   26   31 o   51.800   4.4627   59.592   9.4845   68.468   14.152   52.354   12.779   55.342   6.2002   48.258   6.4204 7.083805 8.925450 
1 1 1   16   26   32 o   16.083   5.1356  -4.4129   7.6292 -13.5744   11.640   2.4867   10.101   14.175   6.8133   17.992   7.6860 -3.817318 10.27111 
1 1 1   16   26   33 o   18.848   5.6677   0.5857   7.8883   10.819   12.458  -6.2629   10.192   22.888   9.0026   14.807   6.8879 8.081812 11.33535 
1 1 1   16   26   34 o   28.198   7.3310   19.817   10.084   26.427   20.425   17.687   11.597   30.136   11.619   26.260   8.9429 3.876949 14.66200 
1 1 1   16   26   35 o   27.894   7.2980   18.099   10.546   11.408   12.656   33.298   19.074   22.799   9.0399   32.990   11.460 -10.19144 14.59604 
1 1 1   16   27    0 o  158.904   2.4729  523.354   22.895  523.354   22.895  523.354   22.895  158.904   3.4972  158.904   3.4972 0.000000 0.000000 
1 1 1   16   27    1 o  153.371   2.4719  487.950   15.625  465.608   21.671  512.144   22.551  149.715   3.5095  157.027   3.4819 -7.312576 4.943716 
1 1 1   16   27    2 o   66.996   2.9184   93.118   8.0460   99.349   11.872   87.825   10.942   69.053   4.1684   64.938   4.0855 4.115242 5.836705 
1 1 1   16   27    3 o   33.867   4.7635   25.998   6.4366   16.354   9.4952   34.198   8.7551   27.341   7.9463   40.392   5.2554 -13.05038 9.526899 
1 1 1   16   27    4 o  198.093   2.8138  820.085   22.773  842.613   30.446  791.474   34.311  201.333   3.6665  194.852   4.2693 6.480301 5.627604 
1 1 1   16   27    5 o  104.796   2.2606  229.746   9.5869  217.323   14.855  238.613   12.550  102.280   3.5215  107.311   2.8356 -5.031013 4.521204 
1 1 1   16   27    6 o  107.007   2.6376  222.418   10.336  272.702   20.786  205.899   11.914  114.340   4.4077   99.675   2.8980 14.66542 5.275102 
1 1 1   16   27    7 o   83.840   2.9512  143.841   9.2599  152.741   17.426  140.339   10.931   85.440   4.9449   82.239   3.2227 3.200874 5.902363 
1 1 1   16   27    8 o   76.542   2.6533  121.558   8.1465  123.245   13.188  120.517   10.359   76.895   4.1584   76.189   3.2966 0.7050934 5.306561 
1 1 1   16   27    9 o   92.926   2.6142  181.443   9.8797  167.581   14.934  192.232   13.175   89.658   4.0385   96.194   3.3207 -6.536575 5.228429 
1 1 1   16   27   10 o   44.467   4.4917   42.907   6.5330   41.880   13.926   43.197   7.3975   43.426   8.0726   45.508   3.9412 -2.082359 8.983337 
1 1 1   16   27   11 o   49.894   3.6707   57.909   6.5942   39.730   11.550   66.699   8.0318   43.181   6.4854   56.607   3.4401 -13.42582 7.341351 
1 1 1   16   27   12 o   54.381   3.2536   61.949   6.7598   62.247   12.097   61.813   8.1513   54.303   5.4012   54.459   3.6290 -0.1562233 6.507101 
1 1 1   16   27   13 o   52.665   3.2652   55.176   6.6437   66.925   12.117   50.126   7.9443   56.340   5.2143   48.991   3.9317 7.349010 6.530498 
1 1 1   16   27   14 o   60.253   3.3216   73.689   8.1093   91.696   13.014   62.259   10.368   66.048   4.7774   54.458   4.6162 11.59041 6.643247 
1 1 1   16   27   15 o   70.699   3.0926  105.186   8.9646  100.178   13.223  109.445   12.195   69.064   4.6421   72.335   4.0877 -3.270920 6.185285 
1 1 1   16   27   16 o   75.270   3.0572  119.535   9.4186  105.675   13.564  132.438   13.088   70.939   4.6361   79.602   3.9865 -8.662949 6.114348 
1 1 1   16   27   17 o  106.634   3.3994  242.090   13.829  246.894   16.758  231.831   24.488  108.740   3.7364  104.528   5.6801 4.211853 6.798841 
1 1 1   16   27   18 o   83.926   3.3183  149.969   11.239  156.746   14.676  140.356   17.478   86.452   4.1160   81.400   5.2061 5.051193 6.636624 
1 1 1   16   27   19 o   62.987   7.1025  101.521   12.296  106.618   13.465   75.928   30.172   71.132   4.5897   54.842   13.443 16.28970 14.20498 
1 1 1   16   27   20 o   85.273   3.4007  152.619   11.758  148.162   15.196  159.268   18.560   83.903   4.3913   86.643   5.1937 -2.739990 6.801326 
1 1 1   16   27   21 o   78.720   3.3588  129.341   10.553  138.270   17.496  124.235   13.230   80.598   5.2632   76.843   4.1742 3.754387 6.717584 
1 1 1   16   27   22 o   87.136   3.4879  160.099   11.901  164.621   20.402  157.767   14.653   87.679   5.6416   86.592   4.1028 1.087563 6.975704 
1 1 1   16   27   23 o   16.638   5.1483  -1.3287   6.8635  -6.9182   10.799   2.4594   8.8901   15.614   7.2027   17.661   7.3581 -2.047338 10.29662 
1 1 1   16   27   24 o   61.550   3.5829   79.920   9.0004   98.068   13.554   65.607   12.037   67.808   4.8465   55.292   5.2783 12.51657 7.165881 
1 1 1   16   27   25 o  102.011   3.2505  220.001   13.441  213.205   17.359  230.176   21.240  100.327   4.1952  103.695   4.9663 -3.368080 6.501074 
1 1 1   16   27   26 o   92.596   3.0423  182.261   11.617  179.208   16.453  185.296   16.405   91.795   4.3458   93.398   4.2586 -1.602547 6.084536 
1 1 1   16   27   27 o   49.637   4.6260   57.953   8.6417   40.084   12.907   72.470   11.634   41.265   7.8710   58.008   4.8627 -16.74237 9.251926 
1 1 1   16   27   28 o   79.772   3.9668  138.773   13.032  132.808   17.849  145.584   19.073   77.990   5.5489   81.555   5.6703 -3.564964 7.933643 
1 1 1   16   27   29 o   80.021   4.3998  137.246   14.521   0.0000   0.0000  137.246   14.521  ?   ?    80.021   4.3998      ?      ? 
1 1 1   16   27   30 o   32.033   6.2141   25.168   8.5849   33.325   12.907   18.697   11.497   36.588   8.6835   27.477   8.8915 9.110485 12.42825 
1 1 1   16   27   31 o   60.560   3.9001   81.181   9.6673   81.004   14.555   81.321   12.931   60.236   5.8587   60.884   5.1496 -0.6480675 7.800233 
1 1 1   16   27   32 o   42.508   5.8138   43.893   9.9321   33.743   13.416   56.204   14.775   36.147   9.0259   48.869   7.3303 -12.72186 11.62761 
1 1 1   16   27   33 o   33.921   6.3167   30.120   8.9160   31.316   13.425   29.177   11.926   34.244   9.2757   33.599   8.5769 0.6449547 12.63335 
1 1 1   16   27   34 o   40.324   6.3825   51.024   11.093   20.557   20.000   64.563   13.332   27.594   11.217   53.054   6.0928 -25.45958 12.76506 
1 1 1   16   28    0 o   47.560   3.6756   48.700   9.8868   48.700   9.8868   48.700   9.8868   47.560   5.1980   47.560   5.1980 0.000000 0.000000 
1 1 1   16   28    1 o   57.557   3.1298   68.962   7.4071   77.043   10.824   61.843   10.158   60.734   4.3209   54.380   4.5292 6.353985 6.259686 
1 1 1   16   28    2 o  149.043   2.3898  460.639   14.624  473.124   21.864  450.532   19.672  150.818   3.5149  147.269   3.2387 3.549698 4.779500 
1 1 1   16   28    3 o   56.674   3.3137   67.273   7.7430   67.095   10.800   67.461   11.106   56.608   4.6259   56.740   4.7459 -0.1319199 6.627443 
1 1 1   16   28    4 o  123.436   3.0837  323.470   14.843  334.462   18.414  303.081   25.079  126.772   3.5218  120.099   5.0630 6.673973 6.167356 
1 1 1   16   28    5 o   63.534   3.0228   84.544   7.9027   81.961   11.462   86.884   10.911   62.573   4.4412   64.495   4.1018 -1.922249 6.045530 
1 1 1   16   28    6 o   24.467   5.4299   12.833   6.0573   13.302   9.2599   12.482   8.0084   24.920   7.9709   24.013   7.3755 0.9065781 10.85977 
1 1 1   16   28    7 o   64.605   2.7223   84.234   6.9340   96.780   12.006   77.955   8.4939   68.006   4.2803   61.204   3.3648 6.801449 5.444556 
1 1 1   16   28    8 o   61.334   3.0329   78.509   7.4808   79.770   12.030   77.713   9.5522   61.637   4.7322   61.032   3.7947 0.6051483 6.065801 
1 1 1   16   28    9 o   74.617   3.3091  120.093   9.2879  108.706   16.600  125.282   11.206   71.681   5.6150   77.553   3.5034 -5.871735 6.618298 
1 1 1   16   28   10 o   87.807   2.5275  160.680   8.6909  160.748   14.823  160.644   10.728   87.675   4.0992   87.939   2.9579 -0.2639771 5.054958 
1 1 1   16   28   11 o   95.799   2.4110  188.456   9.1031  200.153   15.535  182.340   11.234   97.903   3.8474   93.695   2.9070 4.207451 4.822099 
1 1 1   16   28   12 o   35.487   4.4688   26.566   5.7342   29.069   10.977   25.626   6.7246   36.047   7.6216   34.927   4.6682 1.120708 8.937562 
1 1 1   16   28   13 o   50.934   3.3630   54.085   6.4306   55.613   11.931   53.459   7.6345   51.240   5.6454   50.628   3.6562 0.6125221 6.725914 
1 1 1   16   28   14 f   32.204   5.6612   23.995   7.0506   20.772   13.193   25.283   8.3416   30.437   9.4863   33.971   6.1812 -3.534378 11.32241 
1 1 1   16   28   15 o   68.552   3.4850   99.020   9.4958   99.766   15.685   98.589   11.931   68.547   5.5479   68.558   4.2193 -0.1107025E-01 6.970077 
1 1 1   16   28   16 o   36.194   4.9720   28.272   7.0243   34.422   11.360   24.465   8.9378   39.259   7.2838   33.130   6.7697 6.129276 9.943945 
1 1 1   16   28   17 o   75.220   3.0018  119.192   9.2644  115.137   13.676  122.632   12.594   73.954   4.4836   76.485   3.9924 -2.530891 6.003509 
1 1 1   16   28   18 f   58.655   3.5444   73.677   8.4209   67.954   12.881   77.949   11.129   56.474   5.5299   60.835   4.4353 -4.360382 7.088850 
1 1 1   16   28   19 o   79.735   3.4369  136.245   11.079  143.797   14.572  125.898   17.057   82.626   4.2759   76.844   5.3819 5.781570 6.873750 
1 1 1   16   28   20 o   47.808   5.1529   51.121   9.8098   44.570   14.180   57.133   13.585   44.240   8.0687   51.377   6.4113 -7.136963 10.30574 
1 1 1   16   28   21 o   40.364   5.3765   36.957   8.7043   40.773   11.994   32.711   12.652   43.209   6.7302   37.520   8.3865 5.689991 10.75307 
1 1 1   16   28   22 o   75.170   3.9809  128.690   11.291  101.922   19.120  143.023   13.991   68.062   6.8111   82.277   4.1229 -14.21442 7.961783 
1 1 1   16   28   23 o   60.301   4.6022   82.127   10.067   74.342   18.905   85.208   11.894   57.315   7.9973   63.287   4.5568 -5.971531 9.204412 
1 1 1   16   28   24 o   33.462   5.6348   26.662   7.5461   24.320   12.183   28.119   9.6121   31.807   8.9237   35.117   6.8825 -3.309927 11.26951 
1 1 1   16   28   25 f   26.764   5.4143   17.051   7.5785   0.4469   12.098   27.776   9.7226   18.845   8.2302   34.683   7.0373 -15.83796 10.82865 
1 1 1   16   28   26 o   44.337   4.6379   43.921   8.4224   43.387   12.599   44.352   11.324   43.879   6.9619   44.794   6.1296 -0.9147987 9.275736 
1 1 1   16   28   27 o   26.998   6.7733   16.995   9.3555   16.268   12.213   18.026   14.553   26.362   9.1694   27.634   9.9715 -1.272316 13.54651 
1 1 1   16   28   28 o   37.852   5.8147   35.053   8.7010   32.788   13.630   36.611   11.304   36.134   9.1394   39.570   7.1912 -3.435955 11.62937 
1 1 1   16   28   29 o   28.838   6.7946   20.657   9.1318   23.647   15.605   19.100   11.261   30.004   10.369   27.672   8.7838 2.331833 13.58921 
1 1 1   16   28   30 o   26.006   5.9608   16.320   8.3148   3.7880   12.833   25.386   10.916   20.073   8.6213   31.938   8.2340 -11.86542 11.92161 
1 1 1   16   28   31 o   35.683   6.0604   33.442   8.9572   25.129   13.455   40.057   12.003   30.636   9.5853   40.730   7.4185 -10.09425 12.12075 
1 1 1   16   28   32 o   23.459   6.2881   12.025   8.5427   18.703   12.754   6.5919   11.505   26.693   9.3654   20.225   8.3936 6.467995 12.57624 
1 1 1   16   29    0 o  170.250   2.5047  601.607   24.849  601.607   24.849  601.607   24.849  170.250   3.5422  170.250   3.5422 0.000000 0.000000 
1 1 1   16   29    1 o   36.496   4.5890   29.844   6.5513   20.004   9.3912   39.172   9.1437   29.877   7.6023   43.114   5.1420 -13.23700 9.178005 
1 1 1   16   29    2 o   94.267   2.4773  185.113   9.6221  196.305   13.712  174.254   13.506   97.095   3.4240   91.438   3.5812 5.657150 4.954689 
1 1 1   16   29    3 f   58.758   3.1807   72.254   7.6997   67.991   10.638   76.943   11.158   56.935   4.5304   60.581   4.4658 -3.646427 6.361398 
1 1 1   16   29    4 o   79.406   2.6983  131.749   8.8132  119.951   12.395  143.812   12.533   75.768   3.9664   83.043   3.6593 -7.275047 5.396585 
1 1 1   16   29    5 o   32.015   5.0203   22.590   6.4501   26.488   9.6055   19.388   8.7045   34.573   6.9768   29.457   7.2205 5.115942 10.04053 
1 1 1   16   29    6 o   78.429   2.7313  128.685   8.8189  121.699   12.595  135.403   12.352   76.301   4.0023   80.557   3.7177 -4.255707 5.462532 
1 1 1   16   29    7 o  116.780   2.3762  284.172   11.426  264.534   16.110  304.049   16.208  112.681   3.4664  120.878   3.2510 -8.197151 4.752363 
1 1 1   16   29    8 o   74.670   2.7085  116.398   8.2182  116.567   12.763  116.279   10.741   74.636   4.1462   74.703   3.4862 -0.6668854E-01 5.416996 
1 1 1   16   29    9 o  122.548   3.6635  333.602   14.214  289.972   32.119  344.227   15.851  116.385   6.6911  128.711   2.9858 -12.32606 7.327081 
1 1 1   16   29   10 o   57.804   3.4983   71.293   7.0914   68.525   14.362   72.185   8.1549   56.730   6.1381   58.878   3.3581 -2.148319 6.996665 
1 1 1   16   29   11 o   34.433   5.0148   31.363   5.9725   15.928   12.280   36.146   6.8354   27.298   9.2030   41.567   3.9870 -14.26990 10.02955 
1 1 1   16   29   12 o  128.963   2.6685  352.714   13.151  334.236   23.172  361.493   15.972  126.085   4.4559  131.841   2.9372 -5.755432 5.336901 
1 1 1   16   29   13 o   64.613   3.5418   90.547   8.8809   81.190   14.928   95.672   11.049   61.659   5.8701   67.567   3.9647 -5.907124 7.083610 
1 1 1   16   29   14 o   57.671   3.5900   70.942   8.1345   68.601   13.632   72.236   10.137   56.688   5.8306   58.654   4.1903 -1.966469 7.180083 
1 1 1   16   29   15 o   54.344   3.7207   66.169   7.8480   48.128   12.183   78.967   10.261   47.341   6.2395   61.347   4.0552 -14.00675 7.441472 
1 1 1   16   29   16 o   29.235   4.8316   20.947   6.8177   1.7569   10.911   33.236   8.7321   18.963   8.0409   39.506   5.3591 -20.54279 9.663102 
1 1 1   16   29   17 o   82.580   2.8263  144.570   9.5336  130.213   14.003  156.975   13.016   78.595   4.3198   86.565   3.6456 -7.970306 5.652515 
1 1 1   16   29   18 o   54.369   3.6615   63.910   8.0339   57.299   12.298   68.831   10.611   51.670   5.7708   57.068   4.5081 -5.398010 7.322910 
1 1 1   16   29   19 o   29.298   5.0598   20.827   7.1696   3.3736   11.386   32.295   9.2291   19.874   8.3075   38.723   5.7787 -18.84924 10.11964 
1 1 1   16   29   20 o   44.161   5.3139   50.415   8.3132   28.010   14.007   62.598   10.329   34.058   9.5734   54.263   4.6151 -20.20467 10.62773 
1 1 1   16   29   21 o   50.211   4.5271   55.257   9.2961   55.430   12.401   55.035   14.046   50.500   5.9538   49.922   6.8215 0.5782890 9.054298 
1 1 1   16   29   22 o   26.909   6.2081   15.809   8.3519   8.1867   11.521   24.251   12.125   22.034   8.6603   31.784   8.8972 -9.750132 12.41620 
1 1 1   16   29   23 o   52.100   5.3428   63.772   9.4623   58.315   18.533   65.697   11.005   48.880   9.5351   55.320   4.8232 -6.440498 10.68555 
1 1 1   16   29   24 o   62.455   3.5129   82.697   8.9317   93.852   14.071   75.169   11.559   65.792   5.1853   59.118   4.7406 6.673824 7.025760 
1 1 1   16   29   25 o   32.023   5.7539   26.870   8.3169   11.728   14.292   34.624   10.227   24.540   9.6456   39.506   6.2765 -14.96610 11.50789 
1 1 1   16   29   26 o   15.662   5.1381  -7.3668   7.4349  -1.4971   12.749 -10.3919   9.1524   18.430   8.2286   12.894   6.1554 5.536292 10.27614 
1 1 1   16   29   27 f   37.149   6.8380   35.952   10.624   39.080   14.507   32.332   15.604   39.370   9.1137   34.927   10.197 4.443195 13.67605 
1 1 1   16   29   28 o   59.080   4.3317   78.668   10.135   77.471   16.676   79.370   12.763   58.003   6.9709   60.158   5.1441 -2.154762 8.663421 
1 1 1   16   29   29 f   26.207   6.1799   17.337   8.3685   8.8030   13.255   22.994   10.791   22.213   9.0922   30.201   8.3724 -7.987803 12.35980 
1 1 1   16   29   30 o   32.496   6.8027   28.556   9.8245   24.808   13.705   32.516   14.090   30.238   9.7001   34.753   9.5401 -4.515324 13.60533 
1 1 1   16   29   31 o   24.397   6.6622   13.992   9.7201   8.8455   13.863   18.968   13.633   22.045   9.1867   26.748   9.6510 -4.703251 13.32436 
1 1 1   16   30    0 o   18.962   6.6347   11.307   8.8271   11.307   8.8271   11.307   8.8271   18.962   9.3828   18.962   9.3828 0.000000 0.000000 
1 1 1   16   30    1 o  108.507   2.5492  245.413   11.406  240.632   15.950  250.418   16.319  107.428   3.5997  109.587   3.6105 -2.158936 5.098391 
1 1 1   16   30    2 o   59.657   3.0566   74.622   7.5146   71.624   10.673   77.570   10.582   58.444   4.4276   60.869   4.2152 -2.424774 6.113200 
1 1 1   16   30    3 o   24.241   5.4385   12.459   6.1782   15.538   8.9196   9.6194   8.5658   26.465   7.7045   22.017   7.6778 4.448305 10.87698 
1 1 1   16   30    4 o  129.413   2.3279  348.606   12.425  344.994   17.459  352.311   17.686  128.736   3.2881  130.091   3.2961 -1.355072 4.655799 
1 1 1   16   30    5 o  138.919   2.5081  402.363   14.367  390.729   20.175  414.335   20.466  136.870   3.5738  140.967   3.5200 -4.097549 5.016196 
1 1 1   16   30    6 o   87.799   2.9836  154.577   10.488  134.315   13.055  191.447   17.611   80.127   3.9504   95.471   4.4724 -15.34389 5.967242 
1 1 1   16   30    7 o   97.640   2.7925  200.678   10.966  194.378   17.412  204.820   14.117   96.191   4.3888   99.088   3.4542 -2.896294 5.585073 
1 1 1   16   30    8 o   52.665   4.1353   58.971   8.9629   62.178   13.218   56.242   12.194   53.958   5.9396   51.372   5.7554 2.586502 8.270610 
1 1 1   16   30    9 o   47.257   4.6665   39.434   7.8555   67.624   17.307   32.120   8.8159   55.652   7.5401   38.863   5.5001 16.78956 9.332980 
1 1 1   16   30   10 o   45.981   4.3498   47.856   6.3997   42.252   13.619   49.444   7.2499   43.324   7.9133   48.638   3.6140 -5.314186 8.699542 
1 1 1   16   30   11 o   53.817   3.4830   65.212   6.7213   52.689   12.516   70.288   7.9677   49.587   6.1196   58.047   3.3281 -8.459488 6.966059 
1 1 1   16   30   12 o   27.665   4.6468   20.746   5.5660   3.0513   11.038   26.781   6.4456   19.662   8.1959   35.668   4.3814 -16.00566 9.293531 
1 1 1   16   30   13 o   15.411   4.4826  -2.0735   5.8171 -30.7933   11.854   7.0355   6.6761   11.763   5.8805   19.060   6.7672 -7.296838 8.965200 
1 1 1   16   30   14 o   73.971   3.3163  122.051   9.5363   89.746   14.835  144.801   12.449   64.795   5.5510   83.147   3.6302 -18.35236 6.632685 
1 1 1   16   30   15 o   47.407   4.4060   52.174   7.6776   38.917   12.572   60.060   9.6958   41.471   7.6310   53.343   4.4070 -11.87159 8.812096 
1 1 1   16   30   16 o   47.812   4.1976   50.504   7.7555   45.291   13.107   53.313   9.6202   45.467   6.9896   50.157   4.6504 -4.690041 8.395250 
1 1 1   16   30   17 o   56.155   4.3149   68.139   9.6273   94.151   14.284   46.488   13.032   66.319   5.2222   45.990   6.8704 20.32942 8.629804 
1 1 1   16   30   18 o   32.258   5.8939   24.275   7.9368   28.993   11.670   20.215   10.826   35.178   8.1954   29.339   8.4728 5.838337 11.78788 
1 1 1   16   30   19 o   59.378   3.7506   75.281   8.6791   77.648   15.015   74.094   10.636   59.675   6.1004   59.080   4.3649 0.5949402 7.501170 
1 1 1   16   30   20 o   35.487   5.1673   30.466   7.1841   21.914   11.605   35.778   9.1475   30.285   8.7801   40.689   5.4508 -10.40333 10.33452 
1 1 1   16   30   21 o   39.758   4.6893   34.573   7.4357   41.284   11.831   30.192   9.5597   43.082   6.6583   36.434   6.6049 6.647438 9.378592 
1 1 1   16   30   22 o   19.797   5.5560   6.3035   6.5411   5.8831   11.168   6.5231   8.0702   20.482   8.3604   19.112   7.3199 1.369495 11.11199 
1 1 1   16   30   23 o   27.431   6.4792   17.794   8.8596   23.020   12.344   12.242   12.724   30.571   9.1078   24.291   9.2178 6.279718 12.95838 
1 1 1   16   30   24 o   50.486   5.3317   58.661   9.4489   59.746   18.229   58.262   11.049   49.204   9.3236   51.768   5.1749 -2.563671 10.66349 
1 1 1   16   30   25 o   22.895   6.0633   10.818   7.6388   13.877   11.935   8.6956   9.9421   24.662   9.0098   21.127   8.1166 3.535456 12.12665 
1 1 1   16   30   26 o   54.011   4.0548   63.735   8.9086   71.836   14.066   58.310   11.512   56.623   6.0230   51.398   5.4304 5.224640 8.109558 
1 1 1   16   30   27 o   17.959   5.6042  -2.2928   8.6776   6.6887   11.796 -12.8859   12.811   20.744   8.5440   15.174   7.2546 5.569902 11.20842 
1 1 1   16   30   28 o   25.750   6.7185   14.893   9.8418   25.178   14.693   6.5213   13.255   30.380   10.064   21.119   8.9036 9.260521 13.43701 
1 1 1   16   30   29 o   32.962   7.0661   29.595   10.529   23.088   14.049   37.934   15.904   29.042   9.8435   36.882   10.140 -7.839170 14.13217 
1 1 1   16   30   30 o   34.982   6.7720   33.493   10.117   29.614   14.278   37.403   14.337   32.641   9.8116   37.324   9.3367 -4.682434 13.54403 
1 1 1   16   31    0 o   49.107   3.6398   52.000   10.164   52.000   10.164   52.000   10.164   49.107   5.1475   49.107   5.1475 0.000000 0.000000 
1 1 1   16   31    1 o   35.924   4.4017   28.063   6.3826   26.697   8.9896   29.452   9.0635   34.725   6.5161   37.123   5.9195 -2.398800 8.803382 
1 1 1   16   31    2 o   18.082   5.0114   2.7605   5.9119  -3.8433   8.3458   9.4118   8.3757   14.481   6.5452   21.683   7.5904 -7.202236 10.02270 
1 1 1   16   31    3 o   31.036   5.1840   21.726   6.5292   21.082   9.1266   22.401   9.3448   30.560   7.3342   31.512   7.3285 -0.9515095 10.36804 
1 1 1   16   31    4 o   83.402   2.6310  145.469   9.0488  149.136   12.900  141.917   12.696   84.442   3.7041   82.363   3.7374 2.079338 5.261983 
1 1 1   16   31    5 o   44.258   3.7252   41.244   6.7735   45.614   10.123   37.701   9.1143   46.359   5.2945   42.158   5.2418 4.200821 7.450399 
1 1 1   16   31    6 o  114.150   2.7928  270.039   12.610  284.033   21.291  262.478   15.649  116.156   4.4441  112.144   3.3834 4.012802 5.585505 
1 1 1   16   31    7 o   75.258   3.0944  121.457   9.2845  109.371   14.737  129.410   11.955   71.874   4.9715   78.642   3.6859 -6.768646 6.188807 
1 1 1   16   31    8 o   53.410   4.3080   63.441   9.0995   46.105   13.391   78.312   12.403   46.022   7.0549   60.799   4.9460 -14.77731 8.615991 
1 1 1   16   31    9 o   50.417   3.5052   54.250   7.1734   51.770   11.019   56.075   9.4501   49.274   5.4220   51.560   4.4438 -2.286686 7.010431 
1 1 1   16   31   10 o   60.809   3.1684   79.544   7.7824   67.677   11.641   89.133   10.464   56.457   4.9994   65.161   3.8937 -8.703461 6.336774 
1 1 1   16   31   11 o   24.531   5.0816   12.778   4.9372   14.641   9.9749   12.174   5.6820   25.690   8.2789   23.372   5.8951 2.318136 10.16327 
1 1 1   16   31   12 o   50.653   3.5878   53.808   7.2580   57.712   12.018   51.567   9.1062   51.904   5.6140   49.402   4.4692 2.501781 7.175662 
1 1 1   16   31   13 o   54.527   3.3917   63.056   7.4645   63.620   11.851   62.685   9.6106   54.566   5.2657   54.488   4.2764 0.7803345E-01 6.783479 
1 1 1   16   31   14 o   40.561   4.2024   35.146   6.7902   37.376   11.281   33.880   8.5031   41.328   6.6182   39.794   5.1808 1.534225 8.404819 
1 1 1   16   31   15 o   14.065   4.4954  -3.6259   5.6469 -12.7391   10.123   0.4909   6.8039   13.374   6.4087   14.756   6.3058 -1.381701 8.990842 
1 1 1   16   31   16 o   62.464   3.2701   84.858   8.1934   73.370   12.593   93.290   10.789   58.447   5.2241   66.481   3.9349 -8.034168 6.540203 
1 1 1   16   31   17 o   27.046   5.5208   17.470   6.4826   13.569   11.044   19.521   8.0070   24.891   8.7160   29.201   6.7787 -4.309784 11.04165 
1 1 1   16   31   18 o   41.435   5.2545   39.292   8.6768   38.110   13.157   40.203   11.543   40.228   8.2076   42.642   6.5632 -2.414364 10.50904 
1 1 1   16   31   19 o   30.060   6.0009   23.468   7.6054   13.943   15.646   26.415   8.7027   26.054   10.134   34.067   6.4295 -8.012911 12.00189 
1 1 1   16   31   20 o   71.426   3.1162  109.656   9.0957  104.444   13.612  113.860   12.226   69.686   4.7359   73.165   4.0515 -3.478050 6.232465 
1 1 1   16   31   21 o   20.952   5.6855   7.3126   6.6914   12.087   11.218   4.6761   8.3367   23.748   8.7262   18.155   7.2906 5.593536 11.37100 
1 1 1   16   31   22 o   53.283   3.9429   64.476   8.2256   52.996   13.093   71.962   10.573   48.633   6.5274   57.932   4.4248 -9.298183 7.885790 
1 1 1   16   31   23 o   22.816   5.9075   11.311   7.0750   10.891   11.980   11.536   8.7671   23.073   8.8978   22.559   7.7731 0.5140572 11.81490 
1 1 1   16   31   24 o   24.037   7.2124   8.7324   11.483   11.911   21.423   7.4511   13.602   26.110   11.174   21.964   9.1219 4.145468 14.42489 
1 1 1   16   31   25 o   24.608   7.0357   12.343   11.321  -1.2108   21.612   17.468   13.290   22.631   10.347   26.586   9.5362 -3.954645 14.07131 
1 1 1   16   31   26 o   19.235   6.4628  -5.8764   11.307  -1.7343   12.263 -29.3853   29.214   17.659   7.9620   20.810   10.182 -3.151587 12.92569 
1 1 1   16   31   27 o   27.710   7.1027   20.762   10.553   16.973   16.961   23.155   13.479   26.166   10.437   29.253   9.6369 -3.086266 14.20539 
1 1 1   16   31   28 o   21.897   6.9992   3.2699   11.284   8.1192   24.632   1.9818   12.695   24.853   11.238   18.941   8.3468 5.912073 13.99848 
1 1 1   16   32    0 o   12.279   5.4644   1.8681   8.2370   1.8681   8.2370   1.8681   8.2370   12.279   7.7279   12.279   7.7279 0.000000 0.000000 
1 1 1   16   32    1 o   55.092   3.3027   64.795   7.3570   49.987   10.319   80.103   10.492   48.476   5.1611   61.708   4.1224 -13.23106 6.605400 
1 1 1   16   32    2 o   45.345   3.7597   43.832   7.0297   44.838   9.9275   42.820   9.9555   45.887   5.2455   44.803   5.3875 1.083679 7.519326 
1 1 1   16   32    3 o   71.724   2.8471  108.252   8.4089  110.646   11.652  105.650   12.148   72.597   3.8914   70.851   4.1570 1.746384 5.694202 
1 1 1   16   32    4 o   31.598   4.9676   22.500   6.2748   23.077   9.4366   22.043   8.4013   31.867   7.3321   31.328   6.7044 0.5389385 9.935216 
1 1 1   16   32    5 o   66.032   3.2428   93.002   8.5830   88.478   13.668   95.948   11.029   64.487   5.1387   67.578   3.9570 -3.090958 6.485691 
1 1 1   16   32    6 f   62.374   3.3517   82.996   8.3706   79.835   13.407   85.016   10.716   61.181   5.3132   63.566   4.0872 -2.385254 6.703404 
1 1 1   16   32    7 o   58.944   3.1428   74.253   7.5448   63.843   10.978   83.571   10.386   54.848   4.8529   63.041   3.9946 -8.192753 6.285502 
1 1 1   16   32    8 o   29.853   6.0030   21.093   7.7996   16.774   12.428   23.898   10.018   27.432   9.2584   32.274   7.6438 -4.842113 12.00601 
1 1 1   16   32    9 o   25.288   4.5782   14.146   6.1772  -2.4045   9.7033   25.423   8.0099   16.189   7.2070   34.387   5.6477 -18.19759 9.156303 
1 1 1   16   32   10 o   76.138   2.7934  123.064   8.6991  107.807   12.509  137.352   12.106   71.407   4.2474   80.869   3.6294 -9.462326 5.586854 
1 1 1   16   32   11 o   15.603   4.7588  -0.1975   5.7024  -6.6893   9.6544   3.2808   7.0669   14.609   6.7640   16.598   6.6958 -1.989108 9.517677 
1 1 1   16   32   12 o   21.419   5.9565   7.4806   7.6540   8.3382   9.9308   6.2256   12.013   21.420   8.1399   21.418   8.6985 0.2334595E-02 11.91309 
1 1 1   16   32   13 o   61.911   3.1874   82.618   7.9387   75.768   12.366   87.421   10.354   59.463   5.0421   64.360   3.9006 -4.897560 6.374798 
1 1 1   16   32   14 o   38.885   4.8231   37.679   6.9229   22.148   11.119   47.512   8.8469   30.536   8.5104   47.234   4.5412 -16.69829 9.646169 
1 1 1   16   32   15 f   21.962   5.5782   9.8150   6.2070   10.489   10.608   9.4640   7.6540   22.836   8.4684   21.087   7.2631 1.749212 11.15646 
1 1 1   16   32   16 o   16.540   5.0573   0.6295   5.8632   1.7965   10.667   0.1243   7.0185   18.406   7.8815   14.674   6.3393 3.732491 10.11453 
1 1 1   16   32   17 o   38.218   4.8470   34.341   6.9952   29.662   11.722   36.929   8.7175   35.136   8.2329   41.299   5.1178 -6.163403 9.693963 
1 1 1   16   32   18 o   26.383   5.9884   11.711   7.7033   30.052   13.627   3.0980   9.3385   34.753   9.3169   18.012   7.5260 16.74051 11.97685 
1 1 1   16   32   19 o   57.902   3.5250   71.616   8.2094   76.481   13.322   68.638   10.424   59.203   5.4557   56.601   4.4652 2.602501 7.050005 
1 1 1   16   32   20 o   26.754   6.6795   16.925   9.2486   14.121   13.039   19.763   13.120   25.185   9.3790   28.323   9.5129 -3.138639 13.35892 
1 1 1   16   32   21 o   21.206   6.1981   5.9556   9.0000   10.828   12.719   1.0698   12.736   23.246   9.1112   19.166   8.4054 4.080702 12.39617 
1 1 1   16   32   22 o   48.190   5.4352   55.359   10.195   39.445   14.124   72.669   14.731   39.634   8.8628   56.745   6.2941 -17.11113 10.87035 
1 1 1   16   32   23 o   30.200   6.5617   23.364   9.4335   14.693   13.412   31.853   13.271   25.140   9.4822   35.260   9.0727 -10.12043 13.12349 
1 1 1   16   32   24 o   35.330   8.4480   32.388   12.964   52.356   26.573   26.151   14.851   39.647   13.537   31.014   10.110 8.632912 16.89597 
1 1 1   16   32   25 o   31.901   8.1989   26.267   12.140   42.652   25.783   21.600   13.761   35.453   13.191   28.350   9.7402 7.102303 16.39775 
1 1 1   16   32   26 o   30.836   8.9694   21.538   18.908  -0.0914   23.858   58.064   31.004   22.929   10.622   38.744   14.456 -15.81511 17.93878 
1 1 1   16   33    0 o  101.714   2.5013  215.984   14.799  215.984   14.799  215.984   14.799  101.714   3.5374  101.714   3.5374 0.000000 0.000000 
1 1 1   16   33    1 o   57.603   3.2258   70.431   7.6607   70.633   10.693   70.217   10.981   57.713   4.4922   57.493   4.6306 0.2197342 6.451517 
1 1 1   16   33    2 o   87.187   2.6825  159.974   9.6170  160.282   13.111  159.615   14.149   87.347   3.6393   87.026   3.9421 0.3204269 5.365084 
1 1 1   16   33    3 o   53.915   3.3807   61.901   7.5174   61.701   10.590   62.104   10.673   53.832   4.7696   53.999   4.7923 -0.1674614 6.761318 
1 1 1   16   33    4 o   53.437   3.6531   60.850   7.7901   62.384   12.786   59.945   9.8241   53.724   5.7702   53.150   4.4815 0.5746841 7.306140 
1 1 1   16   33    5 o   54.844   3.2418   64.368   7.2625   54.807   10.328   73.718   10.214   50.655   4.9437   59.033   4.1949 -8.378979 6.483648 
1 1 1   16   33    6 o   95.265   2.5095  190.630   9.8467  177.610   13.796  204.148   14.058   91.905   3.6396   98.626   3.4559 -6.720596 5.019014 
1 1 1   16   33    7 o   70.958   2.8678  107.465   8.2713   87.498   11.754  127.051   11.642   64.192   4.4396   77.724   3.6315 -13.53136 5.735669 
1 1 1   16   33    8 o   21.135   5.8698   7.3419   7.3658   5.7532   12.079   8.2826   9.2940   21.214   8.6809   21.056   7.9031 0.1581039 11.73955 
1 1 1   16   33    9 o   77.920   2.7254  128.066   8.7346  128.661   12.848  127.555   11.910   78.024   3.9926   77.817   3.7109 0.2077789 5.450797 
1 1 1   16   33   10 o   17.689   5.4072   0.6132   7.2080   1.2208   9.6911  -0.1391   10.783   17.559   7.5153   17.818   7.7763 -0.2592049 10.81443 
1 1 1   16   33   11 o   52.323   4.1551   60.340   8.7450   63.250   11.384   56.149   13.660   54.233   5.0893   50.413   6.5695 3.819878 8.310168 
1 1 1   16   33   12 f   34.310   5.7495   27.051   8.1230   18.691   10.708   38.383   12.467   28.039   8.5123   40.580   7.7308 -12.54064 11.49894 
1 1 1   16   33   13 o   22.188   5.9965   9.4250   7.7173   11.634   10.257   6.5433   11.716   23.254   8.3739   21.121   8.5855 2.132549 11.99303 
1 1 1   16   33   14 o   82.149   3.4749  135.381   11.133  116.363   13.370  178.386   20.105   73.768   4.3942   90.531   5.3844 -16.76302 6.949885 
1 1 1   16   33   15 o   63.338   3.3508   85.997   8.4995   87.437   13.795   85.116   10.791   63.455   5.2710   63.221   4.1385 0.2346268 6.701501 
1 1 1   16   33   16 o   44.778   5.0801   46.001   9.0463   46.525   11.972   45.305   13.811   45.744   6.3455   43.813   7.9350 1.931099 10.16024 
1 1 1   16   33   17 o   84.508   3.5795  153.439   12.395  131.677   16.709  180.068   18.483   77.787   5.2079   91.229   4.9121 -13.44117 7.159000 
1 1 1   16   33   18 o   61.195   4.8956   84.959   12.159   87.169   18.995   83.425   15.826   61.360   7.5058   61.030   6.2873 0.3292274 9.791223 
1 1 1   16   33   19 o   39.069   6.2213   37.803   9.8130   30.947   13.314   45.956   14.519   34.839   9.1485   43.299   8.4334 -8.460056 12.44256 
1 1 1   16   33   20 o   19.702   5.9927   3.2558   8.7870   3.0474   12.188   3.4812   12.680   19.483   8.3855   19.922   8.5634 -0.4390144 11.98534 
1 1 1   16   33   21 o   58.353   6.5846   85.488   13.398   84.804   25.587   85.746   15.726   55.102   11.624   61.605   6.1892 -6.502357 13.16918 
1 1 1   16   33   22 o   50.764   6.9723   65.155   12.887   73.367   24.401   61.980   15.175   50.138   11.966   51.391   7.1596 -1.253368 13.94454 
1 1 1   16   33   23 o   48.696   7.6749   63.577   14.010   73.748   26.476   59.621   16.511   48.100   13.025   49.292   8.1216 -1.192089 15.34977 
1 1 1   16   33   24 o   67.651   6.5340  120.780   15.180  108.119   28.268  125.910   17.995   60.905   11.678   74.398   5.8644 -13.49260 13.06793 
1 1 1   16   34    0 o   31.395   5.6932   24.714   9.0117   24.714   9.0117   24.714   9.0117   31.395   8.0514   31.395   8.0514 0.000000 0.000000 
1 1 1   16   34    1 o   48.840   3.5669   51.073   7.1635   45.878   9.8989   56.784   10.379   46.179   5.1972   51.500   4.8866 -5.320305 7.133718 
1 1 1   16   34    2 o   58.175   3.3045   72.645   7.8742   77.000   10.756   67.615   11.559   60.204   4.3317   56.147   4.9915 4.057194 6.608979 
1 1 1   16   34    3 o   43.856   4.1457   40.682   7.3801   49.054   11.783   35.277   9.4672   47.397   6.0274   40.314   5.6938 7.082752 8.291454 
1 1 1   16   34    4 o   35.185   4.6620   28.385   6.5131   21.861   9.4730   34.233   8.9696   30.594   7.5528   39.777   5.4674 -9.182917 9.324000 
1 1 1   16   34    5 o  116.324   2.3882  284.376   11.457  288.644   16.252  280.160   16.154  117.202   3.3622  115.447   3.3926 1.754761 4.776390 
1 1 1   16   34    6 o   24.657   5.2452   12.649   6.0655   21.494   9.4256   6.3968   7.9243   30.270   7.5695   19.044   7.2630 11.22651 10.49036 
1 1 1   16   34    7 o   56.607   3.3126   68.750   7.6638   67.966   11.595   69.357   10.212   56.169   5.0052   57.044   4.3406 -0.8748436 6.625146 
1 1 1   16   34    8 o   30.888   7.6358   14.496   10.953   5.3260   12.432   46.294   23.150   20.963   8.7147   40.813   12.541 -19.85044 15.27152 
1 1 1   16   34    9 o   41.792   5.2512   43.644   8.2926   56.267   10.902   26.315   12.774   50.952   5.1879   32.632   9.1316 18.31943 10.50236 
1 1 1   16   34   10 o   42.856   5.1948   44.542   8.4467   52.784   10.981   32.599   13.218   49.233   5.4079   36.479   8.8711 12.75461 10.38950 
1 1 1   16   34   11 o   21.181   5.8929   7.1731   7.9079   12.160   10.389   0.3048   12.193   23.576   8.4343   18.786   8.2320 4.790041 11.78571 
1 1 1   16   34   12 o   17.295   5.3652  -0.9361   7.3680  -4.2084   9.9114   3.1059   11.016   15.469   7.0471   19.121   8.0919 -3.652124 10.73037 
1 1 1   16   34   13 o   21.811   6.2496   6.3111   8.8107   13.003   13.564   1.4263   11.588   24.856   9.4968   18.766   8.1265 6.089752 12.49916 
1 1 1   16   34   14 o   40.809   6.2395   40.917   10.198   42.795   14.422   39.039   14.423   41.913   8.6305   39.704   9.0135 2.209557 12.47909 
1 1 1   16   34   15 o   25.082   6.6482   13.994   9.2243   15.549   14.060   12.819   12.223   25.988   9.7270   24.176   9.0654 1.811609 13.29649 
1 1 1   16   34   16 o   35.343   6.7373   32.011   10.003   35.679   15.047   29.106   13.390   37.027   9.7271   33.660   9.3246 3.366943 13.47459 
1 1 1   16   34   17 o   21.980   7.2880  -8.2535   16.391  -8.5729   21.301  -7.7899   25.665   21.016   9.8363   22.943   10.757 -1.926870 14.57606 
1 1 1   16   34   18 o   15.158   7.1225  -8.4636   11.360   0.0000   0.0000  -8.4636   11.360  ?   ?    15.158   7.1225      ?      ? 
1 1 1   16   34   19 o   23.789   7.0488   9.7919   10.618   12.481   20.543   8.8116   12.403   25.703   10.970   21.876   8.8547 3.826708 14.09760 
1 1 1   16   34   20 o   27.540   7.6235   18.287   11.468   24.798   22.411   15.977   13.347   29.651   11.937   25.430   9.4854 4.221279 15.24699 
1 1 1   16   34   21 o   31.211   7.8678   21.270   11.396   49.435   23.597   12.704   13.014   38.834   12.749   23.587   9.2239 15.24767 15.73553 
1 1 1   16   34   22 o   25.731   6.6424   15.832   11.831 -25.7965   24.239   28.853   13.556   18.962   9.2774   32.499   9.5088 -13.53697 13.28484 
1 1 1   16   35    0 o   70.592   2.7867  105.227   11.392  105.227   11.392  105.227   11.392   70.592   3.9409   70.592   3.9409 0.000000 0.000000 
1 1 1   16   35    1 o  122.729   2.4587  314.590   12.356  292.560   16.328  344.113   18.902  117.844   3.3593  127.614   3.5912 -9.769531 4.917494 
1 1 1   16   35    2 f   52.287   3.8586   59.365   8.3059   63.926   12.177   55.397   11.358   54.161   5.4511   50.413   5.4627 3.747913 7.717219 
1 1 1   16   35    3 o   69.784   2.9255  103.913   8.3351   86.079   11.611  122.872   11.972   63.427   4.4386   76.142   3.8123 -12.71477 5.851007 
1 1 1   16   35    4 o   29.034   5.1331   20.289   6.3099   13.817   9.3171   25.773   8.5760   24.464   8.0097   33.605   6.4217 -9.140270 10.26614 
1 1 1   16   35    5 o   39.093   4.0867   33.126   6.5494   37.824   9.9204   29.497   8.7198   41.515   5.7938   36.672   5.7650 4.842480 8.173336 
1 1 1   16   35    6 o   75.712   2.8031  122.276   8.7133  111.493   12.491  132.495   12.160   72.318   4.1879   79.105   3.7271 -6.786560 5.606234 
1 1 1   16   35    7 o   22.199   6.2384   8.5892   8.5485   7.1963   12.708   9.7405   11.553   21.839   8.9168   22.559   8.7271 -0.7195988 12.47678 
1 1 1   16   35    8 o   19.830   6.4081  -3.2149   10.983   1.2505   12.682 -16.6091   21.964   19.389   8.4484   20.271   9.6373 -0.8811569 12.81613 
1 1 1   16   35    9 o   35.428   6.4038   31.231   9.3585   31.235   14.032   31.229   12.560   35.166   9.4653   35.689   8.6279 -0.5226250 12.80752 
1 1 1   16   35   10 o   16.587   5.4161  -6.2613   8.6609  -9.4123   13.227  -3.8964   11.459   16.460   7.7186   16.714   7.5999 -0.2539806 10.83216 
1 1 1   16   35   11 o   76.096   3.8420  126.826   11.966  124.235   15.914  130.195   18.152   75.471   5.1126   76.721   5.7364 -1.249374 7.684043 
1 1 1   16   35   12 o   23.237   5.9423   8.2586   8.7135  -6.6887   12.408   22.801   12.239   16.484   7.6448   29.991   9.0996 -13.50773 11.88470 
1 1 1   16   35   13 o   31.150   7.5087   24.812   10.892   29.849   19.920   22.663   13.010   32.605   11.677   29.696   9.4428 2.908890 15.01736 
1 1 1   16   35   14 o   19.220   6.1613  -1.8857   10.286  -8.8489   18.074   1.4493   12.509   19.373   9.0652   19.066   8.3466 0.3073082 12.32252 
1 1 1   16   35   15 o   26.705   7.0079   17.835   10.521   8.2440   19.442   21.806   12.510   24.287   10.522   29.122   9.2597 -4.835445 14.01587 
1 1 1   16   35   16 o   29.250   7.5220   21.702   10.925   27.133   20.563   19.566   12.895   30.915   11.722   27.584   9.4302 3.331526 15.04402 
1 1 1   16   35   17 o   23.922   11.101  -0.4528   26.223   0.0000   0.0000  -0.4528   26.223  ?   ?    23.922   11.101      ?      ? 
1 1 1   16   35   18 o   24.792   6.9081   14.327   11.184  -3.1625   21.386   20.910   13.121   21.585   10.020   27.999   9.5127 -6.413937 13.81617 
1 1 1   16   35   19 o   18.839   6.2344  -4.8734   10.399  -1.4224   20.799  -6.0234   12.007   21.630   9.9843   16.048   7.4690 5.581860 12.46882 
1 1 1   16   35   20 o   33.125   8.1192   31.296   12.622   41.829   23.457   27.003   14.974   35.350   12.670   30.900   10.156 4.449869 16.23847 
1 1 1   16   36    0 o   72.256   2.8069  110.440   11.748  110.440   11.748  110.440   11.748   72.256   3.9695   72.256   3.9695 0.000000 0.000000 
1 1 1   16   36    1 o   21.335   5.3928   6.8945   6.4706   17.890   10.297  -0.2798   8.3178   27.131   8.3685   15.538   6.8041 11.59279 10.78556 
1 1 1   16   36    2 f   46.795   4.2013   48.094   8.0645   54.900   12.139   42.716   10.790   49.741   5.9169   43.850   5.9660 5.891090 8.402517 
1 1 1   16   36    3 o   19.631   5.6137   6.0068   6.7577   4.5043   12.018   6.7015   8.1720   20.126   8.4810   19.135   7.3570 0.9906273 11.22732 
1 1 1   16   36    4 o   55.260   4.0346   70.020   8.4669   59.941   14.484   75.252   10.436   51.304   6.8451   59.217   4.2727 -7.912376 8.069211 
1 1 1   16   36    5 o   21.740   5.8230   8.9041   6.7165   12.956   12.164   7.1272   8.0558   24.168   9.0474   19.313   7.3332 4.855072 11.64602 
1 1 1   16   36    6 o   27.811   6.4944   18.750   8.9564   26.053   12.979   12.110   12.375   31.886   9.2970   23.736   9.0706 8.149788 12.98883 
1 1 1   16   36    7 f   19.090   6.2200  -3.5683   10.598 -31.2876   24.635   2.7270   11.740   19.048   9.3266   19.131   8.2321 -0.8310890E-01 12.43994 
1 1 1   16   36    8 o   36.149   8.4048   34.522   14.207   24.475   17.632   53.118   23.987   30.293   10.969   42.005   12.738 -11.71143 16.80961 
1 1 1   16   36    9 o   52.031   5.8264   60.011   11.683   93.716   19.748   41.864   14.490   63.207   7.5751   40.856   8.8547 22.35091 11.65284 
1 1 1   16   36   10 o   31.288   7.0701   26.175   10.299   23.374   16.725   27.886   13.071   29.712   10.694   32.864   9.2516 -3.152046 14.14024 
1 1 1   16   36   11 o   47.084   6.4767   56.014   11.962   54.529   19.198   56.956   15.294   44.978   10.534   49.190   7.5386 -4.211357 12.95337 
1 1 1   16   36   12 o   41.210   6.7257   47.892   11.385   31.640   19.350   56.496   14.079   33.043   11.539   49.377   6.9135 -16.33334 13.45145 
1 1 1   16   36   13 o   45.644   6.9466   56.529   12.432   49.068   20.788   60.682   15.511   40.699   11.737   50.589   7.4338 -9.889793 13.89326 
1 1 1   16   36   14 o   30.433   7.4121   26.006   11.040   23.668   20.211   27.000   13.180   29.119   11.462   31.747   9.4005 -2.628311 14.82417 
1 1 1   16   36   15 f   34.164   7.3876   25.299   11.272   59.448   21.423   12.226   13.255   44.911   11.512   23.417   9.2620 21.49353 14.77529 
1 1 1   16   36   16 o   52.885   6.9313   78.182   12.763   64.851   24.079   83.390   15.050   45.395   12.475   60.374   6.0441 -14.97854 13.86252 
1 1 1   16   36   17 o   35.643   13.774   46.912   28.757   0.0000   0.0000   46.912   28.757  ?   ?    35.643   13.774      ?      ? 
1 1 1   16   37    0 o   17.032   6.9673   9.1923   11.243   9.1923   11.243   9.1923   11.243   17.032   9.8533   17.032   9.8533 0.000000 0.000000 
1 1 1   16   37    1 o   27.656   6.3098   19.063   8.2698   23.134   12.017   15.401   11.398   30.071   8.9927   25.240   8.8537 4.830498 12.61963 
1 1 1   16   37    2 o   22.945   9.1498   10.408   13.034   10.408   13.034   0.0000   0.0000   22.945   9.1498  ?   ?       ?      ? 
1 1 1   16   37    3 o   24.237   9.5460   12.616   14.025   12.616   14.025   0.0000   0.0000   24.237   9.5460  ?   ?       ?      ? 
1 1 1   16   37    4 o   77.059   7.1477  157.270   19.346  165.908   23.301  138.100   34.711   85.100   6.6386   69.018   12.660 16.08199 14.29540 
1 1 1   16   37    5 o   32.460   8.0836   31.915   14.259   37.425   16.031   11.053   31.195   37.212   10.160   27.708   12.576 9.504797 16.16724 
1 1 1   16   37    6 o   31.004   7.2779   27.187   13.186   40.523   16.029  -0.7348   23.194   38.895   9.9512   23.112   10.623 15.78274 14.55587 
1 1 1   16   37    7 o   17.781   7.9638  -0.9300   12.042   0.0000   0.0000  -0.9300   12.042  ?   ?    17.781   7.9638      ?      ? 
1 1 1   16   37    8 o   30.528   7.9042   18.207   13.610   1.9028   16.671   50.788   23.566   21.051   9.4034   40.006   12.708 -18.95486 15.80847 
1 1 1   16   37    9 o   47.686   6.2861   58.489   11.588   54.206   18.792   61.116   14.720   44.330   10.449   51.043   6.9919 -6.713245 12.57227 
1 1 1   16   37   10 o   18.102   5.8821  -3.4575   9.9176  -9.9574   16.768   0.0401   12.300   18.067   8.5398   18.137   8.0912 -0.6958580E-01 11.76417 
1 1 1   16   37   11 o   34.372   7.6946   33.997   11.954   37.366   19.720   32.039   15.030   34.861   11.663   33.882   10.040 0.9794998 15.38920 
1 1 1   16   37   12 o   26.067   7.1626   15.318   10.600   26.252   18.291   9.7895   13.006   29.960   11.118   22.173   9.0331 7.787203 14.32513 
1 1 1   16   37   13 o   35.354   7.5476   32.574   11.700   53.091   20.245   22.286   14.337   42.258   11.367   28.450   9.9323 13.80878 15.09521 
1 1 1   16   38    6 o   26.502   12.221   10.048   31.050   0.0000   0.0000   10.048   31.050  ?   ?    26.502   12.221      ?      ? 
1 1 1   16   38    7 o   32.310   13.924   37.689   33.696   0.0000   0.0000   37.689   33.696  ?   ?    32.310   13.924      ?      ? 
1 1 1   16   38    8 o   23.188   7.4258   5.4597   14.483   11.158   16.063 -19.3070   33.486   23.559   9.8592   22.818   11.107 0.7407093 14.85163 
1 1 1   17    0    1 o  316.655   2.6692  2069.49   49.284  2069.49   49.284  2069.49   49.284  316.655   3.7748  316.655   3.7748 0.000000 0.000000 
1 1 1   17    0    2 o  212.474   2.2217  931.862   27.520  931.862   27.520  931.862   27.520  212.474   3.1419  212.474   3.1419 0.000000 0.000000 
1 1 1   17    0    3 o  464.180   3.4643  4447.87   93.773  4447.87   93.773  4447.87   93.773  464.180   4.8993  464.180   4.8993 0.000000 0.000000 
1 1 1   17    0    4 o  165.436   2.1103  565.112   20.349  565.112   20.349  565.112   20.349  165.436   2.9844  165.436   2.9844 0.000000 0.000000 
1 1 1   17    0    5 o  391.766   3.0659  3168.08   70.039  3168.08   70.039  3168.08   70.039  391.766   4.3358  391.766   4.3358 0.000000 0.000000 
1 1 1   17    0    6 o   85.062   2.3281  149.932   11.512  149.932   11.512  149.932   11.512   85.062   3.2924   85.062   3.2924 0.000000 0.000000 
1 1 1   17    0    7 o   30.264   5.4889   22.262   8.3753   22.262   8.3753   22.262   8.3753   30.264   7.7625   30.264   7.7625 0.000000 0.000000 
1 1 1   17    0    8 f  347.539   2.8298  2493.11   57.347  2493.11   57.347  2493.11   57.347  347.539   4.0020  347.539   4.0020 0.000000 0.000000 
1 1 1   17    0    9 o  334.733   2.7678  2312.82   54.022  2312.82   54.022  2312.82   54.022  334.733   3.9142  334.733   3.9142 0.000000 0.000000 
1 1 1   17    0   10 o  184.563   2.1792  703.304   23.445  703.304   23.445  703.304   23.445  184.563   3.0819  184.563   3.0819 0.000000 0.000000 
1 1 1   17    0   11 o   74.617   2.5387  115.673   10.991  115.673   10.991  115.673   10.991   74.617   3.5903   74.617   3.5903 0.000000 0.000000 
1 1 1   17    0   12 o  240.513   2.3542  1194.18   33.012  1194.18   33.012  1194.18   33.012  240.513   3.3294  240.513   3.3294 0.000000 0.000000 
1 1 1   17    0   13 o  123.378   3.2459  315.537   23.286  315.537   23.286  315.537   23.286  123.378   4.5904  123.378   4.5904 0.000000 0.000000 
1 1 1   17    0   14 o   12.052   5.6514  -2.8206   10.496  -2.8206   10.496  -2.8206   10.496   12.052   7.9923   12.052   7.9923 0.000000 0.000000 
1 1 1   17    0   15 o  435.898   3.8823  3926.69   98.672  3926.69   98.672  3926.69   98.672  435.898   5.4903  435.898   5.4903 0.000000 0.000000 
1 1 1   17    0   16 o  197.148   2.6101  802.974   29.990  802.974   29.990  802.974   29.990  197.148   3.6912  197.148   3.6912 0.000000 0.000000 
1 1 1   17    0   17 o   26.255   6.9955   19.263   10.026   19.263   10.026   19.263   10.026   26.255   9.8931   26.255   9.8931 0.000000 0.000000 
1 1 1   17    0   18 o  125.049   2.4475  323.467   17.821  323.467   17.821  323.467   17.821  125.049   3.4612  125.049   3.4612 0.000000 0.000000 
1 1 1   17    0   19 o  200.255   2.6585  828.645   31.028  828.645   31.028  828.645   31.028  200.255   3.7597  200.255   3.7597 0.000000 0.000000 
1 1 1   17    0   20 o  163.266   3.1809  551.751   30.240  551.751   30.240  551.751   30.240  163.266   4.4985  163.266   4.4985 0.000000 0.000000 
1 1 1   17    0   21 o  139.873   2.6633  404.768   21.693  404.768   21.693  404.768   21.693  139.873   3.7664  139.873   3.7664 0.000000 0.000000 
1 1 1   17    0   22 o   74.814   3.0435  116.732   13.180  116.732   13.180  116.732   13.180   74.814   4.3041   74.814   4.3041 0.000000 0.000000 
1 1 1   17    0   23 o  167.627   2.4730  580.794   24.156  580.794   24.156  580.794   24.156  167.627   3.4973  167.627   3.4973 0.000000 0.000000 
1 1 1   17    0   24 f  237.733   3.1360  1168.70   43.452  1168.70   43.452  1168.70   43.452  237.733   4.4350  237.733   4.4350 0.000000 0.000000 
1 1 1   17    0   25 o  189.616   3.0804  743.926   34.029  743.926   34.029  743.926   34.029  189.616   4.3564  189.616   4.3564 0.000000 0.000000 
1 1 1   17    0   26 o  176.915   4.2316  649.977   43.553  649.977   43.553  649.977   43.553  176.915   5.9843  176.915   5.9843 0.000000 0.000000 
1 1 1   17    0   28 o  149.462   2.6769  462.459   23.303  462.459   23.303  462.459   23.303  149.462   3.7857  149.462   3.7857 0.000000 0.000000 
1 1 1   17    0   29 o   44.870   5.5529   45.459   13.201   45.459   13.201   45.459   13.201   44.870   7.8531   44.870   7.8531 0.000000 0.000000 
1 1 1   17    0   30 o   27.677   7.9013   22.313   12.453   22.313   12.453   22.313   12.453   27.677   11.174   27.677   11.174 0.000000 0.000000 
1 1 1   17    0   31 o   65.021   4.5779   90.544   16.967   90.544   16.967   90.544   16.967   65.021   6.4742   65.021   6.4742 0.000000 0.000000 
1 1 1   17    0   32 o  234.738   2.9410  1142.77   40.239  1142.77   40.239  1142.77   40.239  234.738   4.1591  234.738   4.1591 0.000000 0.000000 
1 1 1   17    0   33 o  117.940   5.9268  297.008   40.299  297.008   40.299  297.008   40.299  117.940   8.3818  117.940   8.3818 0.000000 0.000000 
1 1 1   17    0   34 o   81.075   3.6657  138.493   17.173  138.493   17.173  138.493   17.173   81.075   5.1841   81.075   5.1841 0.000000 0.000000 
1 1 1   17    0   35 o   16.290   6.8324   6.5659   11.273   6.5659   11.273   6.5659   11.273   16.290   9.6624   16.290   9.6624 0.000000 0.000000 
1 1 1   17    0   36 o   21.683   9.5687   8.7495   24.695   8.7495   24.695   8.7495   24.695   21.683   13.532   21.683   13.532 0.000000 0.000000 
1 1 1   17    0   37 o   11.041   5.3660  -7.4010   11.265  -7.4010   11.265  -7.4010   11.265   11.041   7.5886   11.041   7.5886 0.000000 0.000000 
1 1 1   17    0   38 f   24.351   9.9871   18.190   23.192   18.190   23.192   18.190   23.192   24.351   14.124   24.351   14.124 0.000000 0.000000 
1 1 1   17    0   39 o   83.611   4.2176  149.329   20.328  149.329   20.328  149.329   20.328   83.611   5.9646   83.611   5.9646 0.000000 0.000000 
1 1 1   17    0   40 o   16.796   8.0294  -7.0403   23.094  -7.0403   23.094  -7.0403   23.094   16.796   11.355   16.796   11.355 0.000000 0.000000 
1 1 1   17    0   41 o   57.496   8.2639   81.620   24.527   81.620   24.527   81.620   24.527   57.496   11.687   57.496   11.687 0.000000 0.000000 
1 1 1   17    0   42 o   18.140   7.2649   10.353   11.856   10.353   11.856   10.353   11.856   18.140   10.274   18.140   10.274 0.000000 0.000000 
1 1 1   17    0   43 o   23.867   9.7621   20.001   22.066   20.001   22.066   20.001   22.066   23.867   13.806   23.867   13.806 0.000000 0.000000 
1 1 1   17    0   44 o   29.940   11.402   36.189   27.590   36.189   27.590   36.189   27.590   29.940   16.124   29.940   16.124 0.000000 0.000000 
1 1 1   17    0   45 o   14.913   7.5676 -37.8652   31.315 -37.8652   31.315 -37.8652   31.315   14.913   10.702   14.913   10.702 0.000000 0.000000 
1 1 1   17    1    0 o  310.116   2.6307  1984.89   47.569  1984.89   47.569  1984.89   47.569  310.116   3.7203  310.116   3.7203 0.000000 0.000000 
1 1 1   17    1    1 o  291.109   2.5428  1748.86   30.531  1745.72   43.099  1752.02   43.255  290.846   3.5928  291.371   3.5994 -0.5244141 5.085673 
1 1 1   17    1    2 o  147.891   2.0752  451.261   12.658  451.294   17.921  451.228   17.882  147.896   2.9379  147.885   2.9317 0.1072693E-01 4.150431 
1 1 1   17    1    3 o  188.087   2.1451  729.859   16.639  722.445   23.382  737.467   23.685  187.120   3.0296  189.055   3.0375 -1.935226 4.290107 
1 1 1   17    1    4 o  106.839   2.1432  235.496   9.4428  236.969   13.476  234.076   13.235  107.166   3.0489  106.511   3.0128 0.6555405 4.286347 
1 1 1   17    1    5 o  258.304   2.4014  1376.90   25.584  1376.28   36.173  1377.52   36.189  258.246   3.3962  258.362   3.3961 -0.1168213 4.802865 
1 1 1   17    1    6 o   55.341   2.9130   63.330   6.6314   68.687   9.3851   57.989   9.3714   57.685   3.9447   52.998   4.2873 4.686756 5.825929 
1 1 1   17    1    7 o  315.332   2.6683  2052.35   34.703  2059.58   49.269  2045.22   48.888  315.883   3.7817  314.781   3.7655 1.101807 5.336698 
1 1 1   17    1    8 o  277.548   2.5032  1589.64   28.651  1574.50   40.130  1605.37   40.918  276.202   3.5227  278.894   3.5572 -2.692047 5.006332 
1 1 1   17    1    9 o  155.097   2.1150  496.358   13.529  501.124   19.199  491.658   19.067  155.836   2.9871  154.357   2.9949 1.479141 4.229904 
1 1 1   17    1   10 o  292.638   2.5644  1767.79   30.952  1766.88   43.748  1768.69   43.797  292.564   3.6255  292.714   3.6277 -0.1500244 5.128809 
1 1 1   17    1   11 o   62.458   2.7848   80.790   7.1410   71.898   10.098   89.686   10.100   59.005   4.1493   65.910   3.7153 -6.905182 5.569601 
1 1 1   17    1   12 o  200.735   2.2189  831.406   18.368  816.534   25.695  846.946   26.266  198.900   3.1321  202.570   3.1438 -3.669586 4.437792 
1 1 1   17    1   13 f  286.665   2.7658  1697.29   32.345  1697.61   42.713  1696.86   49.524  286.729   3.6118  286.602   4.1896 0.1269531 5.531521 
1 1 1   17    1   14 o   41.143   5.0573   35.660   8.4024   34.938   11.995   36.355   11.774   40.405   7.4729   41.881   6.8161 -1.475632 10.11455 
1 1 1   17    1   15 o   49.104   3.9021   47.789   7.3995   55.835   13.431   44.283   8.8664   51.922   6.2716   46.285   4.6446 5.637531 7.804174 
1 1 1   17    1   16 o  233.314   2.4375  1123.76   23.451  1109.76   32.788  1138.42   33.556  231.829   3.4291  234.800   3.4650 -2.971191 4.874931 
1 1 1   17    1   17 o  132.885   2.5975  364.732   14.235  360.230   20.096  369.267   20.168  132.061   3.6896  133.709   3.6570 -1.648148 5.194903 
1 1 1   17    1   18 o  189.966   2.3879  745.302   18.709  747.325   26.517  743.297   26.401  190.223   3.3798  189.710   3.3741 0.5128937 4.775719 
1 1 1   17    1   19 o   87.730   3.3116  159.642   11.736  156.855   18.490  161.523   15.187   87.060   5.1495   88.399   4.1653 -1.339462 6.623180 
1 1 1   17    1   20 o   65.365   3.9007   88.959   10.461   81.647   15.150   95.621   14.461   62.766   5.8522   67.963   5.1589 -5.196606 7.801458 
1 1 1   17    1   21 o  276.676   3.0706  1580.67   35.008  1674.05   50.568  1494.72   48.514  284.517   4.3092  268.835   4.3754 15.68210 6.141117 
1 1 1   17    1   22 o   74.272   3.1486  114.085   9.6427  110.414   13.525  117.880   13.751   73.056   4.4887   75.489   4.4167 -2.433281 6.297246 
1 1 1   17    1   23 o   62.532   3.5778   81.355   9.1392   67.945   12.837   95.141   13.015   57.262   5.4352   67.803   4.6541 -10.54102 7.155549 
1 1 1   17    1   24 f   92.015   2.9499  174.877   11.185  185.577   16.136  164.981   15.518   94.723   4.1302   89.307   4.2129 5.416145 5.899740 
1 1 1   17    1   25 o   62.136   3.7705   80.600   9.4694  101.372   13.626   61.200   13.169   69.968   4.7219   54.303   5.8797 15.66496 7.541035 
1 1 1   17    1   26 o  225.690   3.0079  1055.79   27.906  1074.70   38.143  1034.02   40.935  227.905   4.0578  223.476   4.4411 4.428284 6.015777 
1 1 1   17    1   27 o   47.051   6.8126   55.407   12.314   26.047   21.139   70.488   15.150   35.910   12.075   58.192   6.3124 -22.28141 13.62523 
1 1 1   17    1   28 o   32.586   6.1814   23.071   8.5291   26.565   12.144   19.671   11.981   34.866   8.5179   30.306   8.9602 4.560946 12.36282 
1 1 1   17    1   29 o  225.003   3.7224  1063.99   31.975  1083.41   38.719  1022.33   56.702  228.630   4.1061  221.376   6.2101 7.253738 7.444837 
1 1 1   17    1   30 o  135.543   3.2489  378.939   17.909  364.785   23.263  399.534   28.060  132.538   4.2555  138.548   4.9105 -6.010147 6.497858 
1 1 1   17    1   31 f   81.575   3.7922  139.017   12.727  126.343   17.790  152.305   18.215   77.730   5.5490   85.421   5.1702 -7.691032 7.584361 
1 1 1   17    1   32 o   78.195   3.3589  127.813   10.817  134.788   15.231  120.715   15.365   80.381   4.5943   76.009   4.9012 4.372009 6.717824 
1 1 1   17    1   33 o   92.271   4.0113  187.199   14.084  203.928   17.393  155.343   24.002   98.912   4.2634   85.629   6.7960 13.28214 8.022568 
1 1 1   17    1   34 o   21.767   6.1250   5.9452   8.2430   7.6891   12.063   4.4178   11.290   22.813   8.8918   20.721   8.4259 2.092085 12.24992 
1 1 1   17    1   35 o   60.269   4.1105   77.173   10.190   71.967   14.566   82.163   14.260   58.201   6.0681   62.338   5.5463 -4.137165 8.220938 
1 1 1   17    1   36 o   24.736   7.4930  -1.2371   11.098   17.023   25.085  -5.6814   12.375   31.925   12.705   17.546   7.9469 14.37828 14.98591 
1 1 1   17    1   37 o   33.557   10.613 -15.1415   10.864   87.447   60.945 -18.5083   11.041   54.010   20.245   13.103   6.3781 40.90638 21.22558 
1 1 1   17    1   38 o   45.507   5.3067   46.565   9.3373   29.795   12.921   64.893   13.508   35.925   8.7920   55.089   5.9452 -19.16366 10.61341 
1 1 1   17    1   39 o   33.324   6.6988   26.486   9.7220   21.995   14.932   29.790   12.809   30.890   10.141   35.758   8.7551 -4.868303 13.39767 
1 1 1   17    1   40 o   29.563   6.4619   20.285   8.7306   17.196   12.159   23.572   12.544   27.548   9.1565   31.578   9.1205 -4.030441 12.92383 
1 1 1   17    1   41 o   21.164   6.0205   4.7293   8.4083  -2.0980   11.544   12.445   12.272   17.691   7.8693   24.636   9.1138 -6.944674 12.04101 
1 1 1   17    1   42 o   19.484   5.8375   2.9539   8.1512   4.6502   11.180   1.0288   11.910   20.010   8.2869   18.958   8.2239 1.052748 11.67499 
1 1 1   17    1   43 o   32.086   8.9247   14.713   17.749  -4.5928   21.744   53.267   30.727   22.617   10.355   41.554   14.539 -18.93715 17.84943 
1 1 1   17    1   44 o   35.805   9.4733   38.241   18.859   40.032   26.886   36.506   26.461   36.423   13.487   35.187   13.307 1.235504 18.94658 
1 1 1   17    1   45 o   27.793   8.7565   12.190   20.336   15.210   27.438   8.5083   30.294   28.241   12.363   27.346   12.405 0.8958073 17.51300 
1 1 1   17    2    0 o  199.072   2.1817  818.062   25.319  818.062   25.319  818.062   25.319  199.072   3.0853  199.072   3.0853 0.000000 0.000000 
1 1 1   17    2    1 o  200.232   2.1868  826.684   18.053  847.714   25.975  807.035   25.108  202.693   3.1071  197.771   3.0781 4.922012 4.373660 
1 1 1   17    2    2 o  138.424   2.0724  395.278   11.831  387.373   16.624  403.390   16.841  137.021   2.9416  139.826   2.9201 -2.804672 4.144865 
1 1 1   17    2    3 o   70.938   2.5063  104.008   7.3122   94.717   10.312  113.403   10.370   67.745   3.6907   74.131   3.3918 -6.386208 5.012511 
1 1 1   17    2    4 o  211.920   2.2242  926.679   19.440  929.048   27.588  924.342   27.398  212.189   3.1523  211.651   3.1386 0.5375061 4.448344 
1 1 1   17    2    5 o  139.687   2.0902  402.361   12.039  414.394   17.272  390.992   16.789  141.717   2.9550  137.658   2.9570 4.059662 4.180380 
1 1 1   17    2    6 o  107.052   2.1762  236.462   9.6073  241.928   13.638  231.077   13.536  108.280   3.0537  105.823   3.1014 2.457092 4.352449 
1 1 1   17    2    7 o  281.035   2.5097  1629.97   29.089  1639.39   41.374  1620.76   40.905  281.837   3.5593  280.232   3.5391 1.605164 5.019349 
1 1 1   17    2    8 o  120.609   2.1352  299.885   10.616  287.255   14.776  313.361   15.262  117.987   3.0364  123.232   3.0028 -5.245567 4.270404 
1 1 1   17    2    9 o   65.277   2.7042   87.967   7.2804   87.097   10.295   88.837   10.297   64.954   3.8429   65.600   3.8058 -0.6462326 5.408484 
1 1 1   17    2   10 o  183.226   2.1738  692.515   16.424  677.510   22.930  708.321   23.535  181.189   3.0684  185.263   3.0800 -4.073685 4.347590 
1 1 1   17    2   11 o  174.611   2.1539  629.186   15.512  623.219   21.846  635.252   22.029  173.776   3.0480  175.445   3.0443 -1.669785 4.307886 
1 1 1   17    2   12 o  274.084   2.4877  1550.86   28.122  1556.21   39.856  1545.56   39.686  274.554   3.5196  273.614   3.5166 0.9404297 4.975387 
1 1 1   17    2   13 o  171.778   2.6273  608.065   17.679  605.228   21.796  613.521   30.227  171.231   3.0862  172.326   4.2528 -1.094635 5.254656 
1 1 1   17    2   14 o  289.064   2.9579  1726.44   35.264  1714.76   49.773  1738.22   49.970  288.081   4.1890  290.047   4.1771 -1.965973 5.915783 
1 1 1   17    2   15 f  171.638   2.5830  613.311   16.971  595.133   30.054  621.821   20.563  169.708   4.2938  173.568   2.8725 -3.859772 5.165990 
1 1 1   17    2   16 o  174.862   2.3400  631.338   16.876  628.592   23.921  634.058   23.811  174.483   3.3240  175.242   3.2944 -0.7587585 4.679962 
1 1 1   17    2   17 o  282.327   2.6354  1646.43   30.687  1658.50   43.547  1634.53   43.249  283.354   3.7262  281.299   3.7277 2.055450 5.270709 
1 1 1   17    2   18 o  393.013   3.1633  3192.13   51.250  3240.72   73.858  3147.01   71.174  395.884   4.5234  390.142   4.4232 5.742737 6.326569 
1 1 1   17    2   19 o  225.645   2.7891  1051.41   25.909  1064.36   37.915  1040.06   35.488  226.935   4.0508  224.355   3.8351 2.579697 5.578280 
1 1 1   17    2   20 o  132.147   2.5795  361.633   14.023  346.219   20.289  375.733   19.405  129.434   3.8006  134.861   3.4886 -5.426422 5.158960 
1 1 1   17    2   21 o  113.701   2.9149  267.676   13.601  271.364   18.410  263.244   20.182  114.580   3.8956  112.822   4.3371 1.758423 5.829827 
1 1 1   17    2   22 o   48.147   4.2438   48.584   8.3087   57.436   11.689   39.544   11.812   52.654   5.3825   43.641   6.5627 9.012833 8.487658 
1 1 1   17    2   23 f   89.697   2.8848  166.341   10.667  173.500   15.199  159.391   14.975   91.602   4.0230   87.792   4.1358 3.810127 5.769657 
1 1 1   17    2   24 o  185.293   2.9319  713.795   22.291  771.668   30.923  651.195   32.162  193.186   3.8810  177.400   4.3956 15.78568 5.863735 
1 1 1   17    2   25 f  296.243   3.1255  1816.15   38.186  1834.50   54.375  1798.29   53.639  297.718   4.4282  294.769   4.4120 2.949738 6.250974 
1 1 1   17    2   26 o   66.528   9.1318   73.778   13.310   70.099   13.759  127.397   52.530   58.106   5.7411   74.950   17.338 -16.84379 18.26351 
1 1 1   17    2   27 o   72.534   5.6185  108.284   16.664  128.726   25.467   92.979   22.037   78.430   7.8729   66.638   8.0180 11.79169 11.23706 
1 1 1   17    2   28 o   99.544   3.2189  204.614   13.116  212.655   19.968  198.512   17.394  101.228   4.7827   97.861   4.3095 3.366074 6.437874 
1 1 1   17    2   29 o  155.065   2.6527  497.975   16.963  486.848   23.922  509.230   24.058  153.317   3.7830  156.813   3.7197 -3.495956 5.305387 
1 1 1   17    2   30 o   55.854   4.5720   64.743   10.475   71.896   15.853   59.200   13.955   58.551   6.5647   53.157   6.3653 5.394344 9.143978 
1 1 1   17    2   31 o   68.481   3.8369   98.017   10.831  102.575   15.416   93.573   15.220   70.068   5.3344   66.893   5.5164 3.175285 7.673750 
1 1 1   17    2   32 o   68.777   3.7017   99.035   10.486   99.140   15.242   98.942   14.448   68.784   5.3725   68.771   5.0938 0.1358795E-01 7.403393 
1 1 1   17    2   33 o   93.496   4.4920  184.533   17.319  186.260   24.779  182.883   24.215   93.909   6.3977   93.084   6.3072 0.8245697 8.983901 
1 1 1   17    2   34 o   49.474   4.6583   52.286   9.4016   43.156   13.153   61.824   13.443   44.917   7.0999   54.031   6.0325 -9.114677 9.316607 
1 1 1   17    2   35 o   81.853   4.5813  155.910   13.656  178.242   16.706  110.948   23.704   92.239   4.3914   71.468   8.0418 20.77046 9.162646 
1 1 1   17    2   36 o   66.297   4.9101   84.097   12.615  128.915   23.211   65.308   15.029   77.336   7.2770   55.258   6.5942 22.07723 9.820239 
1 1 1   17    2   37 o   17.250   5.3442  -6.0784   8.0997 -19.9126   12.019   5.4310   10.963   13.686   6.6600   20.815   8.3598 -7.129344 10.68844 
1 1 1   17    2   38 o   20.507   5.9942   3.9145   8.2562   4.8270   11.402   2.9089   11.970   20.750   8.4562   20.265   8.4978 0.4854298 11.98833 
1 1 1   17    2   39 o   69.992   3.8525  104.111   11.068  109.486   16.634   99.841   14.826   71.520   5.6391   68.464   5.2503 3.056000 7.704918 
1 1 1   17    2   40 o   21.884   6.2903   6.2489   8.9325   4.2018   12.870   8.1518   12.408   21.126   8.8316   22.643   8.9595 -1.517332 12.58052 
1 1 1   17    2   41 o   59.790   4.2699   77.711   10.514   72.178   14.545   83.766   15.216   57.516   6.1315   62.064   5.9442 -4.547611 8.539825 
1 1 1   17    2   42 o   38.173   6.9849   41.073   11.760   49.119   13.685   18.364   22.992   46.734   7.1000   29.612   12.031 17.12144 13.96981 
1 1 1   17    2   43 o   22.716   7.4302  -6.9639   16.290  -5.7360   21.529  -8.6086   24.917   22.260   10.233   23.172   10.776 -0.9116077 14.86041 
1 1 1   17    2   44 o   28.284   8.5971   14.617   18.175   9.3163   25.745   19.884   25.663   26.882   11.864   29.686   12.445 -2.804741 17.19420 
1 1 1   17    2   45 o   33.356   10.473   32.813   27.843   30.700   51.912   33.666   32.990   33.395   15.538   33.318   14.046 0.7656860E-01 20.94611 
1 1 1   17    3    0 o  103.458   2.1439  221.359   12.913  221.359   12.913  221.359   12.913  103.458   3.0320  103.458   3.0320 0.000000 0.000000 
1 1 1   17    3    1 o  355.157   2.8603  2603.65   41.898  2611.28   59.484  2596.15   59.024  355.672   4.0550  354.642   4.0353 1.030151 5.720677 
1 1 1   17    3    2 f  205.282   2.1979  869.223   18.605  883.919   26.653  855.257   25.982  206.973   3.1223  203.591   3.0942 3.382248 4.395808 
1 1 1   17    3    3 o  501.564   3.6822  5196.31   76.173  5197.76  107.779  5194.87  107.671  501.633   5.2093  501.495   5.2056 0.1386719 7.364433 
1 1 1   17    3    4 o  307.705   2.6268  1954.16   33.337  1960.70   47.326  1947.72   46.967  308.215   3.7229  307.194   3.7069 1.020416 5.253638 
1 1 1   17    3    5 o  249.409   2.3656  1283.65   24.333  1288.62   34.582  1278.77   34.246  249.887   3.3554  248.930   3.3355 0.9562988 4.731197 
1 1 1   17    3    6 o  108.261   2.1729  241.563   9.6963  230.889   13.465  253.061   13.975  105.780   3.0862  110.743   3.0596 -4.963058 4.345813 
1 1 1   17    3    7 o  473.623   3.5239  4632.80   68.827  4600.38   96.369  4666.56   98.332  471.936   4.9510  475.309   5.0160 -3.372650 7.047827 
1 1 1   17    3    8 o  262.585   2.4322  1422.92   26.339  1411.72   36.973  1434.47   37.531  261.536   3.4276  263.633   3.4516 -2.096954 4.864356 
1 1 1   17    3    9 o  386.812   3.0408  3089.71   48.511  3099.25   68.857  3080.31   68.356  387.404   4.3094  386.220   4.2912 1.183258 6.081527 
1 1 1   17    3   10 o  138.383   2.1332  395.205   12.175  397.885   17.207  392.519   17.229  138.853   3.0046  137.913   3.0289 0.9402924 4.266311 
1 1 1   17    3   11 o  198.287   2.2064  811.026   18.038  793.950   25.128  829.183   25.911  196.135   3.1062  200.438   3.1342 -4.303207 4.412716 
1 1 1   17    3   12 o  105.015   2.4053  224.358   10.294  248.639   16.116  207.623   13.380  109.740   3.5607  100.291   3.2346 9.448814 4.810515 
1 1 1   17    3   13 o  249.150   2.8942  1284.27   28.208  1288.35   34.792  1276.44   48.186  249.798   3.3769  248.502   4.7014 1.296555 5.788485 
1 1 1   17    3   14 o  249.221   2.8925  1289.55   27.074  1267.87   49.758  1298.67   32.269  247.630   4.8719  250.813   3.1194 -3.182755 5.784921 
1 1 1   17    3   15 o   72.158   4.1145   91.896   9.1457  133.255   24.245   85.035   9.8752   80.150   7.3343   64.165   3.7315 15.98446 8.228956 
1 1 1   17    3   16 o   96.313   2.7954  190.469   11.020  200.696   16.817  182.772   14.590   98.557   4.1370   94.069   3.7605 4.488518 5.590722 
1 1 1   17    3   17 o  166.460   2.3556  571.838   16.167  557.323   22.522  587.270   23.222  164.282   3.3239  168.637   3.3388 -4.354965 4.711236 
1 1 1   17    3   18 o  116.767   2.4823  281.648   11.954  285.468   16.900  277.824   16.910  117.561   3.4855  115.974   3.5353 1.587303 4.964565 
1 1 1   17    3   19 o  139.697   2.6967  402.554   15.458  409.792   23.155  396.736   20.761  140.815   3.9869  138.579   3.6324 2.236099 5.393479 
1 1 1   17    3   20 o  225.610   2.6143  1050.08   24.155  1066.00   36.516  1037.70   32.208  227.102   3.8985  224.118   3.4843 2.984436 5.228669 
1 1 1   17    3   21 o  247.127   2.9342  1263.39   29.887  1284.60   41.729  1241.06   42.825  249.271   4.0588  244.983   4.2383 4.288834 5.868369 
1 1 1   17    3   22 f  164.728   2.6721  559.406   17.915  552.037   23.430  569.777   27.796  163.454   3.4754  166.001   4.0599 -2.547226 5.344256 
1 1 1   17    3   23 o  161.809   2.8295  535.552   18.248  563.593   30.296  519.586   22.860  165.047   4.4505  158.571   3.4954 6.475800 5.659027 
1 1 1   17    3   24 o  137.377   3.2708  391.049   18.514  376.642   26.422  404.948   25.950  134.874   4.7497  139.879   4.4980 -5.005081 6.541532 
1 1 1   17    3   25 o  139.756   2.9809  406.134   16.749  394.875   26.670  413.466   21.523  138.095   4.6825  141.417   3.6901 -3.322235 5.961769 
1 1 1   17    3   26 o   85.351   4.3645  157.514   13.596  165.375   16.109  138.050   25.347   89.371   4.3703   81.330   7.5562 8.040222 8.728951 
1 1 1   17    3   27 o  110.370   3.4287  251.262   14.829  257.069   25.409  248.262   18.262  111.237   5.5383  109.504   4.0435 1.733452 6.857344 
1 1 1   17    3   28 o   32.249   6.3019   23.056   9.1943   11.738   13.987   31.668   12.201   26.342   9.7328   38.156   8.0081 -11.81379 12.60384 
1 1 1   17    3   29 o   35.220   7.8751   23.591   13.995   41.649   20.244   7.0622   19.368   43.302   11.238   27.137   11.036 16.16538 15.75021 
1 1 1   17    3   30 o   79.113   6.7456  156.259   15.528  103.677   34.098  170.016   17.441   67.828   12.654   90.398   4.6779 -22.57007 13.49123 
1 1 1   17    3   31 o  114.236   3.5931  279.548   16.182  300.581   20.582  245.496   26.188  120.241   4.1501  108.231   5.8667 12.01018 7.186224 
1 1 1   17    3   32 o  138.604   2.9758  396.763   16.765  381.111   21.744  419.712   26.328  135.361   3.8947  141.848   4.5002 -6.486771 5.951519 
1 1 1   17    3   33 o   72.980   3.4460  111.290   10.368  114.188   14.947  108.603   14.393   73.888   4.9046   72.071   4.8419 1.816765 6.891982 
1 1 1   17    3   34 o  111.066   3.6469  270.065   15.713  224.201   25.792  297.134   19.815  102.831   6.0814  119.301   4.0269 -16.47026 7.293779 
1 1 1   17    3   35 o   33.144   7.2160   11.807   9.7939   2.9282   10.823   51.968   23.017   19.619   8.1415   46.668   11.916 -27.04910 14.43205 
1 1 1   17    3   36 o   52.350   4.5237   59.464   9.5765   48.166   13.888   69.705   13.223   47.320   7.1160   57.381   5.5871 -10.06151 9.047311 
1 1 1   17    3   37 f   36.292   5.7926   29.837   8.8159   19.469   12.424   40.351   12.511   29.400   9.2127   43.185   7.0244 -13.78555 11.58513 
1 1 1   17    3   38 o   30.326   6.4497   19.968   8.9480   29.185   13.595   12.923   11.885   35.406   9.2192   25.246   9.0222 10.15949 12.89934 
1 1 1   17    3   39 o   55.556   4.4280   66.635   10.140   66.701   14.590   66.573   14.104   55.540   6.3691   55.572   6.1534 -0.3219223E-01 8.856052 
1 1 1   17    3   40 o   58.856   4.5758   74.891   11.038   69.442   14.645   82.057   16.795   56.493   6.2853   61.218   6.6517 -4.725483 9.151548 
1 1 1   17    3   41 o   28.771   6.2800   18.677   8.6893   10.026   12.010   28.181   12.588   23.233   8.9220   34.309   8.8405 -11.07656 12.56008 
1 1 1   17    3   42 o   58.951   6.3047   87.002   12.684   93.033   14.988   71.784   23.808   65.339   5.5617   52.564   11.316 12.77501 12.60933 
1 1 1   17    3   43 o   68.516   5.4943   90.199   13.211   75.948   14.770  147.204   29.541   58.614   6.1095   78.417   9.1337 -19.80260 10.98868 
1 1 1   17    3   44 o   32.395   10.281   18.462   23.960   53.693   50.725   8.3431   27.184   37.829   16.677   26.961   12.028 10.86769 20.56187 
1 1 1   17    3   45 o   31.655   9.9498   25.732   26.163   2.1098   52.508   33.534   30.176   30.062   14.455   33.247   13.676 -3.185139 19.89963 
1 1 1   17    3   46 o   19.940   9.8451 -36.3236   29.374   0.0000   0.0000 -36.3236   29.374  ?   ?    19.940   9.8451      ?      ? 
1 1 1   17    4    0 o   71.124   2.4959  105.127   10.296  105.127   10.296  105.127   10.296   71.124   3.5298   71.124   3.5298 0.000000 0.000000 
1 1 1   17    4    1 o  209.698   2.2134  906.745   19.136  886.059   26.601  928.930   27.548  207.222   3.1124  212.175   3.1480 -4.952438 4.426826 
1 1 1   17    4    2 o  110.799   2.1242  253.290   9.7070  251.202   13.658  255.422   13.799  110.338   3.0012  111.261   3.0070 -0.9228134 4.248419 
1 1 1   17    4    3 o  439.934   3.3269  3996.70   60.366  3995.19   85.271  3998.21   85.469  439.852   4.7004  440.017   4.7095 -0.1651611 6.653779 
1 1 1   17    4    4 o  305.030   2.6133  1919.86   32.869  1943.09   47.108  1897.82   45.883  306.826   3.7225  303.234   3.6687 3.591339 5.226514 
1 1 1   17    4    5 o  175.903   2.1393  638.060   15.516  621.485   21.619  655.667   22.281  173.549   3.0202  178.258   3.0305 -4.708389 4.278534 
1 1 1   17    4    6 o   89.000   2.3072  163.462   8.4691  163.387   11.991  163.538   11.963   88.980   3.2673   89.021   3.2583 -0.4113007E-01 4.614352 
1 1 1   17    4    7 o  298.490   2.5902  1838.95   31.887  1848.36   45.330  1829.72   44.863  299.246   3.6727  297.735   3.6534 1.511261 5.180334 
1 1 1   17    4    8 o  138.704   2.1210  396.991   12.133  399.514   17.210  394.498   17.109  139.142   2.9989  138.266   3.0001 0.8763580 4.241924 
1 1 1   17    4    9 o  281.093   2.5104  1630.93   29.103  1638.93   41.367  1623.10   40.951  281.774   3.5595  280.411   3.5409 1.362976 5.020729 
1 1 1   17    4   10 o  274.292   2.4868  1553.05   28.133  1547.20   39.626  1558.99   39.947  273.773   3.5093  274.812   3.5244 -1.039246 4.973606 
1 1 1   17    4   11 f  185.411   2.1823  709.270   16.685  695.803   23.330  723.368   23.871  183.610   3.0808  187.212   3.0915 -3.601074 4.364500 
1 1 1   17    4   12 o  152.880   2.7601  484.594   17.128  493.826   22.440  471.708   26.511  154.652   3.5181  151.107   4.2538 3.545319 5.520124 
1 1 1   17    4   13 f  237.873   2.8680  1159.65   26.385  1142.58   32.033  1195.67   46.528  235.243   3.3015  240.502   4.6906 -5.258698 5.736049 
1 1 1   17    4   14 o  120.684   2.7395  305.403   12.381  289.884   22.657  312.010   14.784  118.422   4.6388  122.946   2.9154 -4.523781 5.478907 
1 1 1   17    4   15 o  149.040   2.7227  450.633   14.889  476.770   28.952  441.234   17.361  151.873   4.6220  146.208   2.8790 5.665405 5.445359 
1 1 1   17    4   16 o   83.247   2.9400  142.887   10.037  146.009   15.089  140.410   13.443   84.053   4.3526   82.442   3.9534 1.611809 5.879981 
1 1 1   17    4   17 o  267.690   2.8189  1473.26   30.550  1442.79   39.400  1519.19   48.376  264.285   3.6146  271.095   4.3266 -6.810181 5.637770 
1 1 1   17    4   18 o   61.234   5.6747   77.654   14.332   77.654   14.332   0.0000   0.0000   61.234   5.6747  ?   ?       ?      ? 
1 1 1   17    4   19 o  198.682   2.5964  814.638   21.073  822.344   32.164  808.843   27.895  199.480   3.9094  197.885   3.4178 1.594940 5.192707 
1 1 1   17    4   20 o  102.285   2.7696  216.918   11.638  207.205   16.996  225.492   15.969  100.111   4.1164  104.460   3.7064 -4.349480 5.539107 
1 1 1   17    4   21 o  244.435   2.7772  1235.44   27.706  1237.70   36.651  1232.43   42.324  244.737   3.6309  244.132   4.2033 0.6052856 5.554402 
1 1 1   17    4   22 o  144.055   2.9393  433.093   17.277  395.261   25.674  464.404   23.357  138.217   4.5037  149.892   3.7781 -11.67497 5.878597 
1 1 1   17    4   23 o  153.014   3.3528  484.770   21.052  483.300   31.367  485.975   28.398  152.773   4.9780  153.254   4.4927 -0.4804840 6.705590 
1 1 1   17    4   24 o   91.695   3.0020  174.159   11.333  169.944   16.402  178.011   15.678   90.622   4.3883   92.768   4.0977 -2.146416 6.004022 
1 1 1   17    4   25 o   43.635   6.4164   47.764   10.940   20.308   18.726   61.991   13.480   32.626   11.354   54.643   5.9813 -22.01671 12.83280 
1 1 1   17    4   26 o  181.290   2.7132  682.097   20.114  697.628   26.927  662.490   30.255  183.674   3.5544  178.907   4.1002 4.766479 5.426394 
1 1 1   17    4   27 o  230.656   2.9369  1101.78   27.433  1102.32   43.090  1101.42   35.574  230.610   4.5304  230.703   3.7387 -0.9280396E-01 5.873875 
1 1 1   17    4   28 o   57.024   4.2618   68.127   9.9677   62.188   14.418   73.564   13.795   54.593   6.4033   59.456   5.6257 -4.862644 8.523575 
1 1 1   17    4   29 o  193.781   2.8436  778.432   22.726  775.939   32.282  780.882   31.998  193.467   4.0457  194.094   3.9972 -0.6273499 5.687255 
1 1 1   17    4   30 o  164.024   2.7286  556.530   18.382  576.644   27.466  540.210   24.740  166.663   3.9957  161.384   3.7169 5.278809 5.457192 
1 1 1   17    4   31 o   82.713   3.2935  142.277   11.219  147.963   16.413  137.291   15.371   84.248   4.7235   81.177   4.5910 3.070961 6.587018 
1 1 1   17    4   32 o   65.772   4.0302   89.464   10.822   81.345   14.129  100.987   16.832   62.261   5.5021   69.284   5.8905 -7.023033 8.060431 
1 1 1   17    4   33 o   83.744   3.2979  146.512   11.390  144.789   16.090  148.243   16.127   83.245   4.6864   84.242   4.6414 -0.9974899 6.595818 
1 1 1   17    4   34 o   28.388   6.3146   17.573   8.2543   15.755   11.370   19.600   12.003   27.095   8.8470   29.681   9.0126 -2.585897 12.62917 
1 1 1   17    4   35 o   92.890   4.7628  195.750   15.340  207.145   17.810  163.004   30.191   99.440   4.3425   86.341   8.4782 13.09909 9.525589 
1 1 1   17    4   36 o   30.584   5.9715   20.670   8.3265   30.999   11.829   10.527   11.723   37.147   7.9603   24.022   8.9034 13.12445 11.94304 
1 1 1   17    4   37 o   19.304   5.6827   0.6532   8.0658  -8.7965   11.927   8.6160   10.949   16.165   7.4963   22.444   8.5427 -6.279936 11.36538 
1 1 1   17    4   38 o   86.701   3.6995  161.385   13.063  143.525   19.314  176.445   17.735   81.991   5.7113   91.411   4.7039 -9.420570 7.399042 
1 1 1   17    4   39 o   18.419   5.6676  -0.3418   8.0527   0.0232   11.332  -0.7142   11.445   18.519   8.0279   18.319   8.0026 0.2006187 11.33527 
1 1 1   17    4   40 o   59.802   4.5953   78.908   11.201   89.543   15.573   67.508   16.123   64.330   5.8693   55.274   7.0725 9.056400 9.190655 
1 1 1   17    4   41 o   26.050   6.2774   14.735   8.4830   7.7362   12.149   21.394   11.850   22.136   8.8318   29.963   8.9232 -7.826052 12.55485 
1 1 1   17    4   42 o   38.350   8.1466   36.465   11.678   35.122   12.774   43.300   28.820   38.292   8.3257   38.408   14.005 -0.1152840 16.29328 
1 1 1   17    4   43 o   38.800   7.9718   38.984   11.836   38.529   13.113   40.984   27.496   40.155   8.1953   37.445   13.676 2.709969 15.94368 
1 1 1   17    4   44 o   33.358   9.1129   32.049   19.179   43.420   24.055   12.207   31.777   37.996   12.880   28.720   12.895 9.275768 18.22572 
1 1 1   17    4   45 o   33.257   10.052   33.226   26.974  -6.6980   49.358   50.228   32.210   28.616   13.823   37.898   14.597 -9.281233 20.10339 
1 1 1   17    4   46 o   29.616   12.839   24.446   28.988   0.0000   0.0000   24.446   28.988  ?   ?    29.616   12.839      ?      ? 
1 1 1   17    5    0 o  107.355   2.5470  238.569   15.908  238.569   15.908  238.569   15.908  107.355   3.6020  107.355   3.6020 0.000000 0.000000 
1 1 1   17    5    1 o  213.302   2.2300  938.831   19.618  935.561   27.679  942.133   27.811  212.929   3.1518  213.675   3.1557 -0.7464447 4.460028 
1 1 1   17    5    2 o  189.866   2.1577  743.834   16.897  747.571   23.949  740.130   23.843  190.341   3.0507  189.391   3.0524 0.9497375 4.315493 
1 1 1   17    5    3 o  274.918   2.4716  1559.82   28.025  1559.33   39.636  1560.31   39.632  274.874   3.4961  274.961   3.4947 -0.8648682E-01 4.943248 
1 1 1   17    5    4 o  106.113   2.1601  232.335   9.4534  235.276   13.406  229.427   13.333  106.781   3.0440  105.445   3.0657 1.335968 4.320200 
1 1 1   17    5    5 f   66.532   2.6372   91.286   7.2284   97.662   10.379   85.281   10.073   68.787   3.6585   64.277   3.7994 4.510033 5.274458 
1 1 1   17    5    6 o  191.324   2.1815  755.274   17.214  746.437   24.186  764.345   24.505  190.191   3.0832  192.458   3.0871 -2.267731 4.363081 
1 1 1   17    5    7 o  200.915   2.2046  833.031   18.268  829.070   25.819  837.001   25.851  200.436   3.1232  201.393   3.1122 -0.9569550 4.409141 
1 1 1   17    5    8 f   88.093   2.3132  160.164   8.4042  157.883   11.861  162.465   11.910   87.463   3.2879   88.723   3.2548 -1.260628 4.626430 
1 1 1   17    5    9 o  119.161   2.1663  292.995   10.646  287.250   14.958  298.892   15.155  117.977   3.0739  120.345   3.0533 -2.367470 4.332654 
1 1 1   17    5   10 o   74.978   2.4861  116.094   7.6853  118.917   10.821  113.221   10.917   75.899   3.4566   74.056   3.5742 1.842712 4.972270 
1 1 1   17    5   11 o  320.003   2.6982  2114.48   35.610  2103.76   50.037  2125.48   50.690  319.183   3.8009  320.823   3.8308 -1.640167 5.396491 
1 1 1   17    5   12 f  154.933   2.5739  492.624   15.557  486.340   19.057  505.175   26.932  153.495   3.0102  156.371   4.1758 -2.875534 5.147733 
1 1 1   17    5   13 o  369.760   3.6789  2799.99   51.814  2756.20   62.070  2900.65   94.103  365.243   4.1203  374.277   6.0960 -9.033966 7.357886 
1 1 1   17    5   14 o   96.943   3.3189  208.025   12.334  146.378   19.538  248.872   15.904   84.105   5.6324  109.781   3.5124 -25.67666 6.637800 
1 1 1   17    5   15 o  163.808   3.4085  543.446   17.243  572.016   42.499  537.816   18.866  166.196   6.2001  161.420   2.8337 4.775726 6.816933 
1 1 1   17    5   16 o  176.069   2.7128  642.334   19.049  632.821   31.087  648.054   24.105  174.982   4.3074  177.156   3.2990 -2.174393 5.425616 
1 1 1   17    5   17 o  279.705   2.6330  1616.02   30.371  1597.17   42.569  1635.57   43.345  278.045   3.7120  281.365   3.7351 -3.320282 5.265948 
1 1 1   17    5   18 o  122.635   2.7645  311.807   13.903  299.960   20.568  321.775   18.866  120.468   4.1396  124.802   3.6653 -4.334129 5.529040 
1 1 1   17    5   19 o  102.364   2.6567  216.602   11.212  212.552   15.969  220.540   15.746  101.416   3.8177  103.312   3.6954 -1.895065 5.313305 
1 1 1   17    5   20 o   96.597   3.2663  194.488   12.736  200.544   16.547  185.686   19.948   98.490   4.0734   94.704   5.1070 3.786354 6.532509 
1 1 1   17    5   21 o  223.975   3.2938  1033.44   30.015  1065.33   46.749  1011.08   39.150  226.845   4.9967  221.106   4.2930 5.739044 6.587620 
1 1 1   17    5   22 o  247.385   2.7850  1267.80   28.151  1284.60   37.483  1246.06   42.637  249.313   3.6452  245.456   4.2116 3.856491 5.570006 
1 1 1   17    5   23 o  241.148   2.5763  1201.35   25.617  1178.29   35.707  1225.81   36.771  238.767   3.6259  243.529   3.6609 -4.762283 5.152631 
1 1 1   17    5   24 o  286.608   3.0569  1699.00   36.125  1731.67   51.855  1668.20   50.354  289.278   4.3462  283.937   4.2998 5.340424 6.113726 
1 1 1   17    5   25 o   69.505   4.8679   99.630   12.125   98.708   13.999  102.399   24.255   69.023   4.9175   69.988   8.4026 -0.9652710 9.735754 
1 1 1   17    5   26 o  133.630   2.6552  369.470   14.632  372.205   20.551  366.658   20.837  134.136   3.7147  133.124   3.7950 1.012375 5.310444 
1 1 1   17    5   27 f  134.721   2.6872  375.574   14.920  396.371   21.305  355.558   20.901  138.389   3.7326  131.053   3.8668 7.335434 5.374411 
1 1 1   17    5   28 f   98.696   3.5952  197.195   13.892  218.792   24.274  186.676   16.940  102.509   5.7413   94.883   4.3288 7.626221 7.190375 
1 1 1   17    5   29 o   76.682   3.9626  118.004   12.252  145.194   20.087  101.895   15.461   83.419   5.8384   69.946   5.3594 13.47256 7.925231 
1 1 1   17    5   30 o   74.955   3.4477  116.940   10.571   97.800   14.606  137.992   15.318   68.473   5.1718   81.438   4.5605 -12.96501 6.895319 
1 1 1   17    5   31 o   17.311   5.3527  -4.3378   7.5461   3.6102   11.139 -11.0793   10.259   20.388   8.3390   14.234   6.7131 6.154358 10.70538 
1 1 1   17    5   32 f   84.502   3.5001  147.723   12.062  138.951   15.735  160.224   18.783   81.558   4.6777   87.446   5.2080 -5.887222 7.000298 
1 1 1   17    5   33 o   65.847   3.6854   91.071   9.9650   80.707   13.987  101.753   14.201   61.981   5.4715   69.714   4.9388 -7.732571 7.370839 
1 1 1   17    5   34 o   73.700   3.5615  114.331   10.823  116.013   15.202  112.602   15.412   74.272   4.9627   73.129   5.1097 1.142647 7.123056 
1 1 1   17    5   35 o   56.032   4.2628   66.890   9.8270   70.948   13.752   62.656   14.047   57.844   5.7643   54.220   6.2816 3.624718 8.525618 
1 1 1   17    5   36 o   22.725   6.1277   8.3734   8.0885   11.426   11.090   4.9035   11.823   24.252   8.7099   21.197   8.6216 3.054537 12.25537 
1 1 1   17    5   37 f   91.034   4.0718  179.926   14.170  167.734   24.761  185.864   17.279   88.094   6.8149   93.974   4.4582 -5.880043 8.143597 
1 1 1   17    5   38 o   26.414   6.4669   14.723   8.8201   9.3991   13.113   19.121   11.919   23.833   9.2759   28.995   9.0133 -5.161922 12.93377 
1 1 1   17    5   39 o   54.188   4.3391   63.859   9.6020   58.155   14.156   68.720   13.067   51.726   6.6356   56.650   5.5927 -4.924320 8.678166 
1 1 1   17    5   40 o   30.674   6.5094   22.469   9.0059   18.418   13.231   25.966   12.293   28.303   9.5528   33.044   8.8450 -4.740580 13.01882 
1 1 1   17    5   41 o   45.432   5.2843   47.011   9.6319   51.091   13.493   42.771   13.753   48.023   6.8126   42.841   8.0800 5.181599 10.56868 
1 1 1   17    5   42 o   76.510   6.3459  133.178   19.542  102.402   25.032  181.202   31.270   65.307   9.2934   87.713   8.6436 -22.40570 12.69171 
1 1 1   17    5   43 o   32.460   7.5002   29.207   12.015   34.354   13.503   9.6366   26.330   37.376   8.8892   27.545   12.083 9.831264 15.00033 
1 1 1   17    5   44 o   24.593   8.1808 -10.5205   21.888 -30.1025   32.412   5.8963   29.677   22.313   10.876   26.873   12.224 -4.560028 16.36167 
1 1 1   17    5   45 o   27.566   8.9200   2.4611   25.542 -63.8820   48.519   27.896   30.042   23.673   11.844   31.458   13.341 -7.785076 17.84004 
1 1 1   17    5   46 o   29.720   12.818   25.400   28.599   0.0000   0.0000   25.400   28.599  ?   ?    29.720   12.818      ?      ? 
1 1 1   17    6    0 o  227.096   2.2806  1064.53   30.195  1064.53   30.195  1064.53   30.195  227.096   3.2252  227.096   3.2252 0.000000 0.000000 
1 1 1   17    6    1 o  212.512   2.2309  931.554   19.549  949.397   28.009  914.604   27.299  214.495   3.1660  210.529   3.1439 3.966064 4.461780 
1 1 1   17    6    2 o  281.310   2.5029  1632.11   29.023  1602.13   40.213  1664.70   41.930  278.618   3.4993  284.002   3.5796 -5.383789 5.005886 
1 1 1   17    6    3 o  292.027   2.5525  1760.13   30.744  1755.71   43.377  1764.60   43.580  291.658   3.6059  292.395   3.6137 -0.7366638 5.105076 
1 1 1   17    6    4 o  152.838   2.1109  482.024   13.306  486.991   18.814  477.053   18.821  153.626   2.9692  152.049   3.0012 1.576462 4.221817 
1 1 1   17    6    5 o  429.302   3.2692  3806.05   57.882  3827.98   82.467  3784.75   81.261  430.518   4.6443  428.086   4.6024 2.431824 6.538470 
1 1 1   17    6    6 o  170.868   2.1393  602.279   15.074  589.654   21.094  615.451   21.547  169.039   3.0256  172.697   3.0251 -3.658005 4.278517 
1 1 1   17    6    7 o  241.984   2.3470  1208.56   23.424  1203.30   33.034  1213.88   33.220  241.455   3.3171  242.514   3.3213 -1.058502 4.694039 
1 1 1   17    6    8 o   45.897   3.3905   43.550   6.4140   45.065   9.0292   42.006   9.1130   46.706   4.6872   45.089   4.9003 1.616974 6.781047 
1 1 1   17    6    9 o  278.041   2.6945  1597.65   30.623  1607.45   40.745  1584.92   46.425  279.045   3.5402  277.037   4.0630 2.007874 5.388997 
1 1 1   17    6   10 o  255.948   2.4093  1348.78   25.385  1297.59   34.624  1408.28   37.328  250.716   3.3484  261.181   3.4652 -10.46509 4.818620 
1 1 1   17    6   11 o  260.569   2.7764  1402.19   29.836  1388.52   41.881  1416.29   42.514  259.280   3.9164  261.858   3.9364 -2.578064 5.552777 
1 1 1   17    6   12 o  206.964   2.7101  883.236   21.895  880.060   26.901  889.469   37.688  206.467   3.1590  207.461   4.4046 -0.9936981 5.420292 
1 1 1   17    6   13 o  338.972   3.0464  2378.67   42.427  2321.06   62.389  2428.23   57.866  335.113   4.5139  342.831   4.0924 -7.717377 6.092889 
1 1 1   17    6   14 o  277.758   3.0281  1594.58   31.396  1593.24   58.540  1595.12   37.198  277.558   5.1137  277.958   3.2447 -0.3999329 6.056234 
1 1 1   17    6   15 o   60.421   3.7078   69.729   7.9909   87.293   16.826   64.614   9.0801   64.916   6.2845   55.926   3.9365 8.989887 7.415617 
1 1 1   17    6   16 o  113.493   3.6646  266.079   17.154   0.0000   0.0000  266.079   17.154  ?   ?   113.493   3.6646      ?      ? 
1 1 1   17    6   17 o  253.587   4.4707  1283.55   33.353  1405.23   88.040  1263.16   36.039  259.885   8.2136  247.289   3.5335 12.59575 8.941384 
1 1 1   17    6   18 f  295.268   3.0833  1802.14   37.508  1811.97   54.400  1793.23   51.786  296.019   4.4557  294.518   4.2632 1.501221 6.166699 
1 1 1   17    6   19 o  146.309   2.3725  441.763   14.310  459.576   20.592  425.127   19.900  149.159   3.3472  143.458   3.3633 5.700470 4.745039 
1 1 1   17    6   20 o  305.100   2.7509  1923.98   34.616  1913.13   48.740  1935.02   49.171  304.233   3.8843  305.967   3.8965 -1.733978 5.501828 
1 1 1   17    6   21 o  297.656   2.9101  1832.27   35.486  1830.23   53.349  1833.88   47.525  297.461   4.3484  297.851   3.8686 -0.3901367 5.820193 
1 1 1   17    6   22 o   27.337   6.2968   15.194   8.2741   18.523   10.730   10.311   12.995   29.445   8.4148   25.229   9.3696 4.216747 12.59353 
1 1 1   17    6   23 o   89.915   2.9097  167.261   10.788  163.587   15.297  170.895   15.216   88.929   4.1707   90.901   4.0585 -1.972130 5.819463 
1 1 1   17    6   24 o  177.149   2.9594  652.670   21.434  678.891   28.831  620.271   32.048  181.191   3.8579  173.107   4.4887 8.083206 5.918752 
1 1 1   17    6   25 f  137.272   3.4510  380.816   17.549  369.076   20.541  412.543   33.768  133.590   3.7280  140.953   5.8085 -7.362915 6.901931 
1 1 1   17    6   26 o   74.779   3.4399  115.881   10.601  109.495   14.799  122.610   15.192   72.658   4.9384   76.899   4.7899 -4.241455 6.879715 
1 1 1   17    6   27 o  121.447   2.7961  305.455   14.001  295.399   19.714  315.689   19.888  119.424   4.0025  123.470   3.9054 -4.046143 5.592139 
1 1 1   17    6   28 o  137.661   3.0738  393.302   16.875  391.836   27.612  394.177   21.320  137.357   4.8739  137.965   3.7467 -0.6082458 6.147577 
1 1 1   17    6   29 o   97.496   3.6668  199.463   14.240  192.199   23.153  203.883   18.059   95.924   5.8522   99.068   4.4197 -3.143761 7.333613 
1 1 1   17    6   30 f  181.688   3.0955  689.981   22.926  711.103   30.475  662.439   34.799  185.037   3.9931  178.339   4.7310 6.697968 6.190911 
1 1 1   17    6   31 o  111.829   2.9373  259.316   13.523  277.643   19.861  243.478   18.463  115.495   4.1694  108.163   4.1386 7.331909 5.874683 
1 1 1   17    6   32 o   69.131   5.5845  102.178   15.876  102.729   23.380  101.707   21.628   69.211   8.1902   69.052   7.5939 0.1588593 11.16904 
1 1 1   17    6   33 o   36.106   6.1583   28.876   9.0613   24.283   12.131   34.674   13.629   32.886   8.7791   39.327   8.6387 -6.440777 12.31666 
1 1 1   17    6   34 o   44.071   7.4001   39.196   11.274   34.611   12.624   57.266   25.060   39.309   8.0572   48.834   12.415 -9.524746 14.80029 
1 1 1   17    6   35 o   41.936   5.3254   38.736   8.9735   34.916   12.809   42.418   12.575   39.405   8.1506   44.468   6.8562 -5.062836 10.65075 
1 1 1   17    6   36 o   75.844   4.8791  133.670   13.365  148.822   16.117  100.322   23.910   84.139   4.6444   67.549   8.5822 16.59007 9.758301 
1 1 1   17    6   37 o   72.866   7.2174  127.196   14.436  113.683   36.464  129.708   15.720   67.377   13.591   78.355   4.8643 -10.97720 14.43488 
1 1 1   17    6   38 f   29.001   6.0243   18.582   8.8439   3.7107   13.126   30.944   11.968   21.262   8.9064   36.740   8.1146 -15.47851 12.04868 
1 1 1   17    6   39 o   42.692   5.4359   41.209   9.2952   37.308   13.524   44.701   12.797   40.152   8.4347   45.233   6.8594 -5.080956 10.87173 
1 1 1   17    6   40 o   38.926   5.8042   35.345   9.0205   36.451   13.020   34.324   12.509   39.500   8.2577   38.353   8.1588 1.147106 11.60838 
1 1 1   17    6   41 o   27.470   8.2219   3.2952   11.108  -1.4518   11.874   36.577   31.440   18.095   8.0181   36.844   14.357 -18.74844 16.44386 
1 1 1   17    6   42 o   26.118   7.3363   14.009   11.541   18.449   12.904  -3.7468   25.806   27.743   9.4335   24.493   11.238 3.250801 14.67261 
1 1 1   17    6   43 o   25.650   7.5330   11.375   11.066   11.375   12.249   11.376   25.814   23.576   9.0206   27.724   12.067 -4.148294 15.06602 
1 1 1   17    6   44 o   23.810   8.0007 -17.7003   21.342   7.5886   32.017 -37.9239   28.631   27.643   12.621   19.977   9.8358 7.666512 16.00134 
1 1 1   17    6   45 o   31.171   9.9308   25.512   25.891   17.868   51.145   28.146   30.022   31.048   14.745   31.294   13.306 -0.2458191 19.86160 
1 1 1   17    6   46 o   25.306   8.6380  -4.8761   23.934  -2.8630   48.439  -5.5264   27.530   27.493   13.377   23.118   10.932 4.374916 17.27605 
1 1 1   17    7    0 o  234.666   2.3137  1136.70   31.656  1136.70   31.656  1136.70   31.656  234.666   3.2721  234.666   3.2721 0.000000 0.000000 
1 1 1   17    7    1 o  113.260   2.1524  264.681   10.054  261.061   14.144  268.378   14.294  112.478   3.0489  114.043   3.0388 -1.565651 4.304718 
1 1 1   17    7    2 o  264.915   2.4303  1448.32   26.552  1438.27   37.281  1458.67   37.826  263.983   3.4241  265.847   3.4498 -1.863586 4.860615 
1 1 1   17    7    3 o  204.433   2.2049  862.373   18.590  856.025   26.103  868.908   26.482  203.670   3.1074  205.196   3.1291 -1.525848 4.409881 
1 1 1   17    7    4 o  363.011   3.1426  2722.17   46.577  2726.62   61.676  2716.25   71.054  363.394   4.1150  362.628   4.7507 0.7662964 6.285123 
1 1 1   17    7    5 o  136.690   2.2768  382.625   12.654  368.789   16.429  402.802   19.840  133.683   2.9797  139.696   3.4434 -6.013260 4.553643 
1 1 1   17    7    6 o  135.813   2.2632  380.870   12.554  379.368   19.115  382.009   16.649  135.570   3.4185  136.057   2.9668 -0.4864807 4.526382 
1 1 1   17    7    7 o  156.608   2.2803  506.225   14.596  506.067   22.183  506.347   19.382  156.577   3.4349  156.639   3.0001 -0.6095886E-01 4.560632 
1 1 1   17    7    8 o  261.922   2.6301  1421.25   28.303  1345.32   41.169  1489.30   38.974  255.250   3.9105  268.594   3.5182 -13.34428 5.260202 
1 1 1   17    7    9 o  173.686   2.1341  622.497   15.286  613.183   21.435  632.134   21.805  172.364   3.0152  175.007   3.0208 -2.643082 4.268124 
1 1 1   17    7   10 o  171.958   2.1383  610.331   15.165  605.869   21.362  614.864   21.532  171.325   3.0232  172.592   3.0248 -1.267136 4.276558 
1 1 1   17    7   11 o  137.911   2.4481  392.694   13.892  357.339   19.412  429.804   19.888  131.543   3.5780  144.279   3.3422 -12.73544 4.896129 
1 1 1   17    7   12 o   83.841   2.9624  144.284   10.180  137.255   13.532  153.449   15.451   81.510   4.0252   86.172   4.3475 -4.661507 5.924736 
1 1 1   17    7   13 o  229.551   2.8611  1104.81   25.864  1032.20   42.831  1146.48   32.448  223.461   4.6472  235.642   3.3386 -12.18015 5.722144 
1 1 1   17    7   14 o  216.627   2.5318  968.278   22.474  976.462   33.830  961.813   30.068  217.428   3.7724  215.825   3.3778 1.603226 5.063688 
1 1 1   17    7   15 f  222.423   2.9145  1028.22   25.533  1002.25   42.764  1042.61   31.830  220.158   4.7095  224.689   3.4347 -4.531281 5.828958 
1 1 1   17    7   16 o   58.865   3.3493   75.024   7.6785   59.794   12.357   84.603   9.8003   53.737   5.5753   63.993   3.7131 -10.25591 6.698572 
1 1 1   17    7   17 o  153.494   3.0595  487.538   18.448  485.558   31.248  488.597   22.856  153.196   4.9455  153.792   3.6033 -0.5958710 6.118937 
1 1 1   17    7   18 o  159.084   2.4535  524.044   16.060  552.775   22.402  493.667   23.035  163.592   3.3202  154.576   3.6131 9.016159 4.906931 
1 1 1   17    7   19 o  166.956   2.6021  575.977   17.917  565.193   25.243  586.926   25.434  165.380   3.7008  168.533   3.6590 -3.153473 5.204267 
1 1 1   17    7   20 o   86.477   2.8635  154.517   10.209  161.275   14.619  148.086   14.262   88.323   4.0132   84.630   4.0859 3.692421 5.727097 
1 1 1   17    7   21 o   88.703   4.0173  161.790   14.609  174.861   22.184  151.781   19.413   91.827   5.8573   85.580   5.4998 6.246346 8.034648 
1 1 1   17    7   22 o  228.893   2.7486  1084.48   25.650  1091.98   33.872  1074.39   39.273  229.867   3.5727  227.919   4.1778 1.948578 5.497137 
1 1 1   17    7   23 o  142.590   2.9153  422.394   16.759  411.771   26.500  429.473   21.634  141.041   4.5555  144.139   3.6391 -3.097443 5.830564 
1 1 1   17    7   24 o  122.711   3.4773  312.008   17.594  314.426   24.630  309.489   25.141  123.205   4.8470  122.218   4.9874 0.9868393 6.954675 
1 1 1   17    7   25 o  114.987   3.7467  279.121   15.781  285.045   18.583  263.797   29.886  117.380   3.8385  112.595   6.4356 4.785194 7.493402 
1 1 1   17    7   26 o   85.550   3.1080  151.684   10.964  150.159   15.641  153.156   15.372   85.122   4.4551   85.979   4.3349 -0.8564911 6.216028 
1 1 1   17    7   27 o   56.903   3.9656   67.403   9.3032   68.913   13.074   65.854   13.241   57.558   5.5074   56.249   5.7073 1.309681 7.931230 
1 1 1   17    7   28 o   70.793   6.0420  104.858   13.412  107.037   32.016  104.395   14.771   70.720   10.976   70.866   5.0535 -0.1463242 12.08394 
1 1 1   17    7   29 o   63.141   4.0517   84.824   10.353   71.942   15.382   95.492   13.998   58.581   6.3666   67.701   5.0132 -9.120369 8.103443 
1 1 1   17    7   30 o   65.517   3.7188   89.660   10.039   90.095   14.537   89.263   13.881   65.651   5.3686   65.383   5.1473 0.2683411 7.437516 
1 1 1   17    7   31 o   69.515   3.7003  101.193   10.609  100.426   14.944  101.973   15.063   69.249   5.2324   69.780   5.2336 -0.5309372 7.400580 
1 1 1   17    7   32 o  204.001   3.0959  869.611   25.866  882.908   34.747  853.083   38.738  205.898   4.0917  202.104   4.6472 3.794296 6.191817 
1 1 1   17    7   33 o   48.392   4.9432   50.095   9.7923   50.427   13.110   49.677   14.728   48.682   6.5292   48.103   7.4235 0.5796661 9.886300 
1 1 1   17    7   34 f   47.180   7.1181   49.808   11.392   49.285   12.806   51.793   24.942   48.067   6.4594   46.293   12.686 1.773121 14.23615 
1 1 1   17    7   35 o   37.035   5.6467   30.255   8.6061   40.545   12.576   21.190   11.803   43.436   7.0196   30.634   8.8469 12.80202 11.29345 
1 1 1   17    7   36 o   91.989   3.1599  177.886   11.987  175.227   17.000  180.516   16.905   91.287   4.5152   92.691   4.4219 -1.404076 6.319828 
1 1 1   17    7   37 o   29.419   7.6282   18.914   11.067 -11.6206   32.150   23.018   11.787   27.198   12.503   31.640   8.7422 -4.441324 15.25639 
1 1 1   17    7   38 o   35.681   6.1478   30.040   9.0548   23.882   13.287   35.379   12.373   31.950   9.4328   39.411   7.8869 -7.460405 12.29560 
1 1 1   17    7   39 o   36.610   6.2252   31.482   9.2926   34.391   13.409   28.793   12.889   38.308   8.6870   34.912   8.9189 3.395718 12.45034 
1 1 1   17    7   40 o   18.159   5.6078  -1.4386   8.0832   4.2702   11.850  -6.4068   11.054   20.424   8.5009   15.894   7.3159 4.529725 11.21553 
1 1 1   17    7   41 o   29.874   9.5684   7.2569   12.267   5.2368   12.615   42.314   52.552   21.121   8.7795   38.627   17.004 -17.50614 19.13674 
1 1 1   17    7   42 o   30.614   8.1985   14.181   11.434   7.7066   12.569   45.265   27.539   22.037   8.9157   39.191   13.761 -17.15475 16.39692 
1 1 1   17    7   43 o   30.918   7.9902   23.265   11.932   21.870   13.604   27.914   24.839   29.491   9.6798   32.345   12.715 -2.853527 15.98047 
1 1 1   17    7   44 f   28.332   8.8273   11.087   21.425 -13.1718   32.450   29.834   28.526   24.351   11.615   32.314   13.295 -7.962740 17.65464 
1 1 1   17    7   45 o   25.957   8.8581  -6.8687   24.510   2.1553   49.781  -9.7563   28.160   28.889   13.937   23.025   10.937 5.864584 17.71611 
1 1 1   17    7   46 o   32.776   9.9651   40.163   26.966   2.1597   51.314   54.662   31.695   28.166   13.719   37.386   14.457 -9.219011 19.93027 
1 1 1   17    8    0 o  420.134   3.7205  3645.55   91.141  3645.55   91.141  3645.55   91.141  420.134   5.2616  420.134   5.2616 0.000000 0.000000 
1 1 1   17    8    1 o  150.956   2.1055  469.869   13.104  485.136   18.848  455.588   18.229  153.327   2.9805  148.585   2.9746 4.742569 4.210914 
1 1 1   17    8    2 o  283.005   2.7097  1654.51   31.332  1646.12   47.622  1660.92   41.606  282.350   4.0894  283.660   3.5562 -1.310486 5.419366 
1 1 1   17    8    3 o  209.838   2.2242  908.659   19.248  915.250   27.407  902.245   27.039  210.589   3.1555  209.088   3.1354 1.500458 4.448327 
1 1 1   17    8    4 o  211.032   2.2294  918.863   19.402  905.088   27.138  933.266   27.749  209.415   3.1419  212.649   3.1638 -3.233688 4.458876 
1 1 1   17    8    5 o   22.539   5.1827   10.012   5.5773   12.301   7.9523   7.7954   7.8243   24.290   7.3270   20.787   7.3318 3.503452 10.36537 
1 1 1   17    8    6 o  152.150   2.1051  477.397   13.205  492.263   18.979  463.448   18.385  154.444   2.9795  149.856   2.9745 4.588333 4.210111 
1 1 1   17    8    7 o  452.836   3.4070  4237.37   63.633  4239.37   90.020  4235.37   89.961  452.943   4.8187  452.729   4.8178 0.2138062 6.814046 
1 1 1   17    8    8 o  244.213   2.5455  1231.41   25.371  1231.42   38.787  1231.41   33.542  244.191   3.8512  244.234   3.3298 -0.4260254E-01 5.091067 
1 1 1   17    8    9 o   68.254   2.5660   96.160   7.2217   99.170   10.325   93.277   10.104   69.299   3.6125   67.208   3.6453 2.091232 5.132051 
1 1 1   17    8   10 o   74.453   2.9336  114.504   8.5972  114.441   10.668  114.621   14.520   74.445   3.4746   74.462   4.7278 -0.1683807E-01 5.867237 
1 1 1   17    8   11 o  162.949   2.7616  550.243   18.298  559.389   24.054  537.684   28.188  164.585   3.5435  161.313   4.2368 3.272217 5.523283 
1 1 1   17    8   12 o  141.008   2.3861  411.763   13.818  395.409   20.265  425.973   18.890  138.375   3.5508  143.642   3.1884 -5.267593 4.772264 
1 1 1   17    8   13 o  227.628   2.5117  1072.38   23.378  1051.31   35.276  1088.89   31.218  225.607   3.7910  229.648   3.2959 -4.041122 5.023434 
1 1 1   17    8   14 o  241.928   2.4850  1209.26   24.136  1206.66   38.850  1210.89   30.802  241.675   3.8976  242.180   3.0837 -0.5051422 4.969933 
1 1 1   17    8   15 o  289.033   3.2135  1723.11   36.163  1740.46   62.613  1714.43   44.299  289.995   5.2349  288.071   3.7284 1.924011 6.426914 
1 1 1   17    8   16 o  368.220   3.0936  2801.14   45.582  2811.49   74.115  2794.84   57.807  368.655   4.8744  367.786   3.8108 0.8699036 6.187254 
1 1 1   17    8   17 f  444.380   4.4291  4085.93   78.953  4132.04  127.759  4057.45  100.424  446.127   6.9433  442.633   5.5008 3.494171 8.858284 
1 1 1   17    8   18 o  151.514   2.5550  475.255   15.856  466.247   23.745  482.505   21.301  150.197   3.8331  152.831   3.3793 -2.633636 5.110004 
1 1 1   17    8   19 o  297.096   2.7161  1823.77   33.274  1850.64   47.661  1798.22   46.475  299.226   3.8619  294.965   3.8202 4.260986 5.432153 
1 1 1   17    8   20 o  206.588   2.4562  881.811   20.928  885.529   29.684  878.136   29.510  207.020   3.4765  206.155   3.4706 0.8653564 4.912323 
1 1 1   17    8   21 o  142.811   3.3289  422.649   19.527  416.090   28.841  428.200   26.533  141.762   4.9327  143.861   4.4717 -2.099106 6.657889 
1 1 1   17    8   22 o  232.665   2.5505  1118.66   24.470  1129.54   35.010  1108.28   34.215  233.766   3.6311  231.563   3.5825 2.203003 5.100917 
1 1 1   17    8   23 o  123.013   2.9223  313.084   14.632  313.293   19.205  312.794   22.590  123.093   3.7828  122.933   4.4553 0.1606064 5.844545 
1 1 1   17    8   24 o   88.921   4.1354  167.641   13.391  171.797   15.731  156.706   25.516   91.113   4.1861   86.730   7.1331 4.382042 8.270741 
1 1 1   17    8   25 o   94.667   4.1822  186.286   16.318  195.741   23.254  177.113   22.906   97.047   5.8096   92.287   6.0177 4.759392 8.364474 
1 1 1   17    8   26 o   68.773   3.5594   98.143   10.027  114.092   14.486   83.473   13.894   74.161   4.7361   63.385   5.3147 10.77556 7.118722 
1 1 1   17    8   27 o  193.126   2.7641  772.622   22.017  775.144   31.138  770.100   31.137  193.443   3.9027  192.810   3.9154 0.6332245 5.528260 
1 1 1   17    8   28 f  116.152   4.0672  268.493   16.795  307.477   34.853  256.701   19.168  121.075   6.9794  111.229   4.1782 9.845482 8.134422 
1 1 1   17    8   29 o   31.063   6.1618   21.122   8.2534   18.474   11.680   23.764   11.664   29.296   8.8894   32.830   8.5351 -3.534124 12.32352 
1 1 1   17    8   30 o  126.840   2.8975  333.432   15.048  344.000   22.844  325.332   20.000  128.552   4.3085  125.127   3.8753 3.425491 5.794974 
1 1 1   17    8   31 o   98.489   2.9958  202.005   12.159  214.097   17.434  190.555   16.966  101.373   4.1698   95.606   4.3025 5.767197 5.991553 
1 1 1   17    8   32 o   51.923   4.4297   56.939   9.4861   56.992   13.374   56.885   13.457   51.951   6.2417   51.894   6.2874 0.5745697E-01 8.859462 
1 1 1   17    8   33 f   19.650   5.8976   1.3799   8.3103   1.7441   11.451   0.9746   12.079   19.577   8.2658   19.723   8.4145 -0.1453838 11.79520 
1 1 1   17    8   34 o   83.435   3.4509  147.070   11.809  154.082   16.132  138.976   17.333   85.690   4.5646   81.181   5.1768 4.509125 6.901789 
1 1 1   17    8   35 o   41.924   5.2464   38.438   8.8741   35.726   12.365   41.318   12.743   40.006   7.7742   43.842   7.0471 -3.836521 10.49287 
1 1 1   17    8   36 o   23.900   5.4136   7.0816   8.0231 -12.5430   11.680   24.615   11.040   14.969   7.0907   32.831   8.1822 -17.86277 10.82713 
1 1 1   17    8   37 o   18.713   6.2535  -9.9767   9.0953  -5.9811   22.055 -10.7955   9.9838   23.569   10.648   13.856   6.5613 9.713262 12.50696 
1 1 1   17    8   38 o   66.365   3.8017   94.488   10.341   84.462   14.834  103.968   14.423   62.770   5.7296   69.960   4.9984 -7.190357 7.603483 
1 1 1   17    8   39 o   62.045   4.1690   83.255   10.628   83.699   15.736   82.883   14.411   62.071   6.1467   62.019   5.6340 0.5149460E-01 8.338092 
1 1 1   17    8   40 o   29.069   6.4183   19.385   8.8677   27.287   12.853   12.206   12.251   33.664   9.0579   24.475   9.0956 9.189627 12.83653 
1 1 1   17    8   41 o   53.047   7.6454   83.743   13.882   94.104   15.811   48.903   28.994   65.519   5.8511   40.576   14.127 24.94319 15.29079 
1 1 1   17    8   42 o   26.369   7.8298   9.3152   11.497   6.5227   12.697   22.025   27.089   21.552   8.8693   31.185   12.906 -9.632132 15.65961 
1 1 1   17    8   43 o   25.406   7.5817   11.427   12.986   16.403   14.308 -11.8411   30.940   26.432   9.8283   24.381   11.547 2.050749 15.16334 
1 1 1   17    8   44 o   27.295   8.6931   6.6937   21.341 -11.4685   30.781   23.506   29.615   24.023   11.418   30.566   13.112 -6.543184 17.38615 
1 1 1   17    8   45 o   27.421   8.8236   11.484   21.843   22.693   32.468   2.2155   29.523   29.628   13.187   25.214   11.727 4.413982 17.64717 
1 1 1   17    8   46 o   25.441   8.5135  -2.5369   25.187 -62.5018   50.451   17.369   29.068   23.258   11.698   27.623   12.373 -4.365225 17.02694 
1 1 1   17    9    0 o  195.096   2.1751  785.820   24.738  785.820   24.738  785.820   24.738  195.096   3.0760  195.096   3.0760 0.000000 0.000000 
1 1 1   17    9    1 o  233.520   2.3029  1125.38   22.178  1114.77   31.111  1136.33   31.625  232.402   3.2457  234.638   3.2679 -2.235291 4.605833 
1 1 1   17    9    2 o   39.330   3.9552   31.370   6.3539   26.807   8.3598   37.612   9.7773   36.008   5.6291   42.653   5.5578 -6.644943 7.910480 
1 1 1   17    9    3 o  253.530   2.7484  1327.14   28.737  1321.04   40.417  1333.36   40.869  252.942   3.8741  254.117   3.8993 -1.174759 5.496713 
1 1 1   17    9    4 o  133.727   2.2733  368.586   12.385  372.406   19.112  365.820   16.261  134.314   3.4500  133.139   2.9613 1.175400 4.546598 
1 1 1   17    9    5 o  237.524   2.6951  1164.85   26.401  1172.46   37.601  1157.46   37.078  238.288   3.8259  236.761   3.7970 1.527206 5.390226 
1 1 1   17    9    6 o  243.643   2.5390  1228.67   25.324  1251.89   33.986  1199.69   37.972  246.257   3.3461  241.030   3.8197 5.226959 5.078035 
1 1 1   17    9    7 o  149.223   2.0973  459.608   12.908  460.197   18.281  459.021   18.229  149.318   2.9684  149.127   2.9637 0.1907196 4.194584 
1 1 1   17    9    8 o  198.741   2.1847  815.279   17.907  806.911   25.153  823.878   25.499  197.708   3.0846  199.775   3.0946 -2.067139 4.369416 
1 1 1   17    9    9 o  106.142   2.1531  232.590   9.4251  234.986   13.290  230.166   13.369  106.693   3.0201  105.591   3.0697 1.101639 4.306269 
1 1 1   17    9   10 o  339.693   3.0142  2378.29   41.647  2348.52   54.390  2420.48   64.750  337.184   3.9110  342.203   4.5877 -5.019073 6.028459 
1 1 1   17    9   11 o  136.821   2.5327  380.758   13.570  368.656   16.621  404.958   23.503  133.637   3.0155  140.005   4.0701 -6.368134 5.065447 
1 1 1   17    9   12 o  179.566   2.4202  667.259   17.853  647.845   26.235  684.002   24.364  177.116   3.5913  182.015   3.2454 -4.899261 4.840467 
1 1 1   17    9   13 o   77.066   2.9219  121.896   9.2530  137.019   13.704  109.224   12.544   81.432   4.0802   72.701   4.1835 8.730598 5.843771 
1 1 1   17    9   14 o  203.940   2.4369  861.106   20.291  843.893   30.806  874.299   26.968  202.112   3.6955  205.768   3.1777 -3.656235 4.873856 
1 1 1   17    9   15 o  124.093   2.7418  321.882   12.660  309.587   23.500  326.909   15.027  122.350   4.6570  125.836   2.8953 -3.486382 5.483639 
1 1 1   17    9   16 o  288.211   3.6330  1716.10   43.186   0.0000   0.0000  1716.10   43.186  ?   ?   288.211   3.6330      ?      ? 
1 1 1   17    9   17 o  201.227   2.7212  837.057   22.549  833.614   32.791  840.145   31.057  200.822   3.9590  201.633   3.7345 -0.8108521 5.442444 
1 1 1   17    9   18 o  200.277   2.6035  824.579   21.240  855.532   32.982  802.649   27.762  203.443   3.9307  197.111   3.4149 6.331635 5.206915 
1 1 1   17    9   19 f  148.055   2.5443  452.693   15.494  456.668   22.818  449.292   21.106  148.648   3.7219  147.463   3.4702 1.184418 5.088650 
1 1 1   17    9   20 o   68.500   3.9101  100.591   10.523  110.468   13.425   84.851   16.947   73.072   4.4546   63.929   6.4274 9.142212 7.820176 
1 1 1   17    9   21 f  217.064   2.6220  975.406   23.391  954.802   34.356  993.213   31.938  214.900   3.8761  219.228   3.5322 -4.327148 5.244071 
1 1 1   17    9   22 o  135.185   2.5721  377.679   14.338  382.737   20.523  372.855   20.041  136.068   3.6569  134.303   3.6180 1.764511 5.144163 
1 1 1   17    9   23 o  183.277   2.7752  693.342   20.598  687.474   26.658  702.036   32.449  182.365   3.5443  184.188   4.2714 -1.822083 5.550398 
1 1 1   17    9   24 o  143.486   3.3459  433.685   18.101  444.618   21.744  409.009   32.669  146.627   3.5955  140.345   5.6438 6.282425 6.691766 
1 1 1   17    9   25 o   82.463   3.9609  146.879   12.620  123.991   21.051  159.720   15.768   77.125   6.6179   87.801   4.3541 -10.67581 7.921779 
1 1 1   17    9   26 o   80.805   3.3296  135.497   11.095  135.594   15.846  135.404   15.540   80.829   4.7531   80.782   4.6641 0.4714203E-01 6.659220 
1 1 1   17    9   27 o   86.980   3.1221  156.923   11.198  158.749   16.013  155.176   15.667   87.473   4.4384   86.488   4.3920 0.9845047 6.244122 
1 1 1   17    9   28 o  141.304   3.9876  420.547   20.115  409.659   39.898  424.257   23.291  139.619   6.9286  142.990   3.9493 -3.371414 7.975117 
1 1 1   17    9   29 o   69.979   3.5604  102.448   10.245   94.715   14.632  109.886   14.350   67.343   5.2679   72.615   4.7912 -5.272049 7.120817 
1 1 1   17    9   30 o  102.517   4.6002  221.541   18.962  222.757   30.412  220.767   24.253  102.488   7.1946  102.546   5.7343 -0.5855560E-01 9.200301 
1 1 1   17    9   31 f   40.571   5.3416   35.646   8.6950   43.251   12.620   28.773   11.997   45.185   6.7718   35.957   8.2627 9.228283 10.68316 
1 1 1   17    9   32 o   67.868   3.7857   96.504   10.558  108.881   15.409   85.554   14.494   71.993   5.1894   63.742   5.5132 8.251282 7.571351 
1 1 1   17    9   33 o   29.966   6.8532   21.270   10.606   28.802   11.860  -8.8109   23.701   35.748   8.2159   24.185   10.971 11.56296 13.70643 
1 1 1   17    9   34 o   68.530   3.7757   99.345   10.596   84.845   14.786  114.655   15.194   63.279   5.6653   73.781   4.9929 -10.50172 7.551454 
1 1 1   17    9   35 o   36.325   5.8766   29.854   8.6128   31.953   12.447   27.926   11.930   37.583   8.2554   35.067   8.3658 2.515614 11.75322 
1 1 1   17    9   36 o   90.075   3.5669  171.499   13.120  173.338   20.046  170.121   17.352   90.337   5.3802   89.812   4.6845 0.5257111 7.133814 
1 1 1   17    9   37 o   20.227   5.8014   3.5814   7.7051   9.6021   11.567  -1.2209   10.331   23.180   8.7907   17.274   7.5730 5.906883 11.60285 
1 1 1   17    9   38 o   63.884   3.9773   87.306   10.468   91.134   15.251   83.896   14.394   65.185   5.6728   62.583   5.5763 2.601276 7.954592 
1 1 1   17    9   39 o   21.909   5.8494   6.0593   8.2950  -6.9340   12.351   16.735   11.196   16.806   7.7348   27.013   8.7770 -10.20605 11.69882 
1 1 1   17    9   40 o   48.383   4.8747   52.009   9.6934   51.542   14.261   52.409   13.215   48.025   7.1999   48.742   6.5737 -0.7162628 9.749466 
1 1 1   17    9   41 o   26.903   7.7323   13.964   12.008   14.693   13.542   11.281   25.976   25.784   9.5667   28.021   12.150 -2.236933 15.46467 
1 1 1   17    9   42 o   29.274   7.5204   22.457   12.921   30.082   13.446 -69.4905   46.693   34.719   9.2308   23.830   11.875 10.88958 15.04076 
1 1 1   17    9   43 o   25.380   7.3016   13.038   12.360   19.764   13.507 -21.5827   30.644   28.020   9.6487   22.740   10.962 5.280346 14.60323 
1 1 1   17    9   44 o   30.907   8.4152   25.746   13.749   26.066   15.294   24.402   31.387   31.102   10.266   30.713   13.337 0.3887882 16.83049 
1 1 1   17    9   45 o   40.104   9.8956   60.134   21.814   39.966   33.378   75.173   28.822   33.284   14.086   46.925   13.903 -13.64100 19.79119 
1 1 1   17   10    0 o   78.375   2.7474  127.692   12.489  127.692   12.489  127.692   12.489   78.375   3.8854   78.375   3.8854 0.000000 0.000000 
1 1 1   17   10    1 o   88.998   2.6646  160.970   9.3347  155.251   11.491  172.067   16.007   86.726   3.2125   91.270   4.2521 -4.543999 5.329244 
1 1 1   17   10    2 o  341.301   2.7939  2405.63   39.329  2402.62   55.480  2408.68   55.761  341.087   3.9437  341.514   3.9587 -0.4279175 5.587874 
1 1 1   17   10    3 o  193.086   2.1706  769.428   17.284  761.553   24.259  777.549   24.634  192.083   3.0620  194.089   3.0772 -2.005966 4.341125 
1 1 1   17   10    4 o  154.243   2.0860  490.968   13.269  484.566   18.629  497.562   18.906  153.223   2.9478  155.263   2.9523 -2.040833 4.171994 
1 1 1   17   10    5 o  257.617   2.3970  1370.21   25.469  1375.49   36.158  1365.02   35.880  258.109   3.3965  257.126   3.3833 0.9830322 4.794089 
1 1 1   17   10    6 o  207.154   2.2097  885.889   18.879  885.124   26.674  886.657   26.725  207.065   3.1233  207.244   3.1266 -0.1789551 4.419346 
1 1 1   17   10    7 o   72.222   2.4354  107.701   7.2442  115.512   10.341  100.172   10.152   74.796   3.3521   69.648   3.5340 5.147850 4.870857 
1 1 1   17   10    8 o  241.348   2.5283  1200.73   24.843  1189.55   32.549  1216.33   38.452  240.031   3.2878  242.665   3.8419 -2.634415 5.056630 
1 1 1   17   10    9 o  109.399   2.2706  247.311   10.174  249.033   13.633  245.146   15.283  109.836   3.0095  108.961   3.4007 0.8754120 4.541138 
1 1 1   17   10   10 o  289.063   2.9366  1723.48   34.951  1773.68   51.226  1679.75   47.808  292.983   4.2392  285.143   4.0651 7.840485 5.873295 
1 1 1   17   10   11 o  297.314   2.8277  1828.15   34.457  1808.16   51.555  1844.29   46.323  295.812   4.2256  298.816   3.7586 -3.003265 5.655328 
1 1 1   17   10   12 o  193.254   2.3136  767.421   17.892  786.542   29.235  755.971   22.623  195.141   3.6324  191.368   2.8663 3.772415 4.627114 
1 1 1   17   10   13 o  124.648   2.3186  317.999   11.736  336.686   18.500  305.413   15.182  127.672   3.5132  121.623   3.0266 6.048645 4.637117 
1 1 1   17   10   14 o  205.785   2.4450  878.477   20.584  841.873   30.777  908.104   27.688  201.867   3.6965  209.704   3.2013 -7.837463 4.890018 
1 1 1   17   10   15 o   91.763   3.8791  189.236   13.091   94.464   18.808  278.312   18.234   67.471   6.7585  116.056   3.8093 -48.58546 7.758128 
1 1 1   17   10   16 o  134.722   3.7195  398.860   15.248  342.094   36.294  411.027   16.803  128.353   6.8558  141.091   2.8874 -12.73843 7.439044 
1 1 1   17   10   17 o   68.831   3.2452   98.050   9.1910   89.423   12.882  106.997   13.118   65.738   4.7510   71.924   4.4220 -6.186478 6.490475 
1 1 1   17   10   18 o  194.889   2.6025  787.281   20.726  766.637   31.295  803.411   27.663  192.576   3.9401  197.201   3.4011 -4.625458 5.204976 
1 1 1   17   10   19 o   54.793   3.8481   62.704   8.5841   51.045   12.111   74.474   12.169   49.610   5.9190   59.976   4.9192 -10.36602 7.696260 
1 1 1   17   10   20 o  176.065   2.4218  640.493   17.585  638.527   24.723  642.507   25.019  175.793   3.4098  176.337   3.4400 -0.5439148 4.843568 
1 1 1   17   10   21 o  373.012   3.5074  2881.90   53.959  2890.06   76.580  2873.86   76.042  373.532   4.9708  372.491   4.9496 1.041107 7.014795 
1 1 1   17   10   22 o   92.757   2.9676  177.835   11.340  181.490   16.507  174.569   15.605   93.653   4.2734   91.861   4.1188 1.791969 5.935181 
1 1 1   17   10   23 o   49.528   5.4651   56.781   9.9336   69.420   12.725   37.058   15.895   57.850   5.3330   41.205   9.5409 16.64545 10.93025 
1 1 1   17   10   24 o  222.568   3.0340  1029.29   27.710  1064.29   37.739  988.338   40.819  226.742   4.0355  218.393   4.5316 8.348984 6.068005 
1 1 1   17   10   25 o   94.389   3.0030  184.615   11.690  184.865   16.619  184.371   16.447   94.450   4.2661   94.328   4.2276 0.1222687 6.005951 
1 1 1   17   10   26 o  106.176   2.8694  233.396   12.559  223.378   17.485  244.073   18.051  103.822   4.0832  108.531   4.0325 -4.709496 5.738796 
1 1 1   17   10   27 o  143.527   4.2959  437.087   24.909  390.150   38.025  472.365   32.966  136.454   6.7565  150.601   5.3073 -14.14742 8.591722 
1 1 1   17   10   28 o  168.232   3.3380  589.407   23.134  626.235   32.889  553.341   32.547  173.476   4.5966  162.987   4.8416 10.48872 6.676065 
1 1 1   17   10   29 o   92.228   3.8014  180.032   13.422  172.201   23.630  183.762   16.308   90.475   6.3325   93.981   4.2073 -3.506653 7.602745 
1 1 1   17   10   30 o  100.066   3.1005  209.400   12.712  203.314   18.940  214.389   17.148   98.669   4.6541  101.463   4.0977 -2.794518 6.200907 
1 1 1   17   10   31 o   73.318   3.4983  112.485   10.578  112.788   15.059  112.190   14.863   73.410   4.9735   73.226   4.9211 0.1837463 6.996652 
1 1 1   17   10   32 o  126.335   2.7695  333.227   14.424  325.722   20.547  340.521   20.254  124.904   3.9884  127.766   3.8435 -2.861900 5.538946 
1 1 1   17   10   33 o   31.608   7.5164   22.378   10.950   24.953   12.448   13.574   23.018   33.123   8.9153   30.094   12.104 3.029514 15.03286 
1 1 1   17   10   34 o   63.005   8.2886  120.215   14.469  132.382   15.761   55.024   36.483   79.342   4.8165   46.668   15.862 32.67382 16.57730 
1 1 1   17   10   35 o   53.343   4.7132   62.894   9.5670   87.209   13.827   40.561   13.251   64.173   5.2239   42.513   7.8465 21.66000 9.426377 
1 1 1   17   10   36 o   28.931   6.4900   17.574   8.8340   26.274   13.716   11.406   11.549   33.601   9.4830   24.261   8.8629 9.339647 12.97995 
1 1 1   17   10   37 o   74.430   3.5703  118.232   10.906  109.623   15.809  126.048   15.065   71.701   5.3459   77.160   4.7338 -5.458420 7.140544 
1 1 1   17   10   38 o   20.523   6.4881  -0.2855   9.6226  -8.9720   21.553   1.8770   10.754   22.273   10.238   18.773   7.9726 3.499805 12.97625 
1 1 1   17   10   39 o   42.325   5.7046   41.214   9.4835   43.947   14.753   39.290   12.380   43.244   8.5744   41.406   7.5266 1.838406 11.40926 
1 1 1   17   10   40 o   43.681   7.6610   51.414   12.720   54.611   14.427   40.254   26.954   49.374   7.0847   37.989   13.586 11.38496 15.32195 
1 1 1   17   10   41 o   49.763   7.2831   56.405   12.860   50.546   14.703   75.473   26.524   46.997   7.5854   52.530   12.435 -5.533443 14.56621 
1 1 1   17   10   42 o   46.974   8.1193   77.958   14.474   83.924   15.137   14.314   49.439   61.550   5.9627   32.398   15.104 29.15241 16.23862 
1 1 1   17   10   43 f   42.359   8.4848   53.228   14.486   54.337   16.256   48.950   31.919   46.826   8.7387   37.891   14.547 8.934788 16.96962 
1 1 1   17   10   44 o   38.522   7.7815   46.669   13.362   51.618   15.142   29.261   28.400   45.610   8.3575   31.435   13.129 14.17529 15.56302 
1 1 1   17   10   45 o   26.245   8.5032   7.3259   21.047   23.657   30.632  -7.2794   28.968   29.259   12.926   23.231   11.052 6.027735 17.00645 
1 1 1   17   11    0 o  140.002   2.0787  404.928   16.958  404.928   16.958  404.928   16.958  140.002   2.9397  140.002   2.9397 0.000000 0.000000 
1 1 1   17   11    1 o   19.794   4.5850   5.1539   5.2046  -4.0302   7.3231   14.528   7.3984   13.581   6.1354   26.006   6.8152 -12.42537 9.170063 
1 1 1   17   11    2 o  342.103   2.7942  2417.44   39.423  2405.80   55.413  2429.37   56.098  341.271   3.9368  342.935   3.9662 -1.663513 5.588312 
1 1 1   17   11    3 o  150.373   2.0841  466.544   12.923  454.522   18.065  479.144   18.494  148.389   2.9517  152.356   2.9430 -3.966568 4.168232 
1 1 1   17   11    4 o  189.286   2.3319  739.122   18.011  744.117   27.600  735.417   23.771  189.826   3.5252  188.745   3.0535 1.080811 4.663812 
1 1 1   17   11    5 o  224.953   2.2730  1044.68   21.088  1051.56   30.008  1037.96   29.640  225.685   3.2238  224.222   3.2051 1.463135 4.545916 
1 1 1   17   11    6 o  253.153   2.5497  1326.70   26.483  1358.09   35.919  1289.32   39.202  256.462   3.3958  249.844   3.8043 6.617813 5.099426 
1 1 1   17   11    7 o  197.177   2.1834  802.190   17.751  786.778   24.725  818.583   25.499  195.225   3.0707  199.129   3.1048 -3.904556 4.366763 
1 1 1   17   11    8 f  262.103   2.4206  1418.41   26.166  1429.55   37.240  1407.54   36.772  263.119   3.4316  261.088   3.4148 2.031494 4.841143 
1 1 1   17   11    9 o   99.714   2.2925  205.584   9.3851  208.632   12.732  201.958   13.888  100.530   3.0708   98.897   3.4048 1.632912 4.584962 
1 1 1   17   11   10 o  187.166   2.3078  724.096   17.692  730.173   23.717  716.474   26.564  188.066   3.0576  186.266   3.4577 1.800552 4.615696 
1 1 1   17   11   11 o  211.345   2.6040  922.691   22.699  924.328   32.116  921.056   32.086  211.533   3.6812  211.158   3.6842 0.3750153 5.208095 
1 1 1   17   11   12 o  224.939   2.4873  1040.24   22.713  1072.30   35.649  1018.33   29.469  227.813   3.7940  222.065   3.2176 5.748169 4.974644 
1 1 1   17   11   13 o   54.100   3.4936   61.245   7.6900   55.320   11.514   66.016   10.332   51.694   5.4005   56.506   4.4334 -4.812260 6.987132 
1 1 1   17   11   14 o  289.642   2.8102  1735.15   33.368  1721.31   49.910  1746.34   44.870  288.560   4.1936  290.723   3.7421 -2.162140 5.620450 
1 1 1   17   11   15 o  111.865   3.5946  242.692   12.116  283.659   31.551  235.605   13.122  116.913   6.5430  106.817   2.9786 10.09562 7.189103 
1 1 1   17   11   16 o  186.736   2.9261  732.302   21.827  672.114   34.760  771.483   28.046  180.234   4.6761  193.237   3.5190 -13.00224 5.852254 
1 1 1   17   11   17 o  316.171   2.7935  2066.48   36.427  2076.50   51.565  2056.50   51.468  316.937   3.9447  315.405   3.9564 1.531860 5.586917 
1 1 1   17   11   18 o  265.992   2.8170  1461.28   30.527  1472.58   47.072  1453.08   40.103  266.826   4.2773  265.158   3.6670 1.667999 5.634025 
1 1 1   17   11   19 o  207.352   2.8861  885.355   23.796  903.074   39.449  875.220   29.835  208.902   4.5785  205.801   3.5149 3.100952 5.772112 
1 1 1   17   11   20 o  186.608   2.4352  719.628   18.743  721.167   26.453  718.077   26.559  186.810   3.4333  186.406   3.4545 0.4030304 4.870470 
1 1 1   17   11   21 o   93.084   2.8446  179.310   10.914  172.450   15.465  186.118   15.405   91.304   4.1067   94.865   3.9373 -3.561249 5.689270 
1 1 1   17   11   22 o   38.758   5.5417   32.502   8.5499   30.908   12.244   34.020   11.945   37.765   8.1031   39.751   7.5619 -1.985798 11.08344 
1 1 1   17   11   23 o   57.462   4.4946   71.918   10.150   88.981   13.679   51.010   15.141   65.497   5.0636   49.426   7.4275 16.07063 8.989292 
1 1 1   17   11   24 o   97.955   3.2535  198.308   12.919  195.569   16.735  202.348   20.324   97.167   4.1758   98.743   4.9903 -1.576073 6.506986 
1 1 1   17   11   25 o   87.713   3.8022  165.539   12.968  179.206   16.278  141.796   21.456   92.978   4.2447   82.448   6.3095 10.53014 7.604460 
1 1 1   17   11   26 o   59.836   3.8669   74.442   9.5282   80.497   13.720   68.800   13.243   62.196   5.3483   57.476   5.5862 4.719559 7.733733 
1 1 1   17   11   27 o   29.405   5.8480   15.399   8.4821   33.589   12.979   1.8401   11.206   39.114   8.3023   19.696   8.2381 19.41799 11.69594 
1 1 1   17   11   28 o   92.233   4.2874  178.908   16.244  160.994   22.998  196.743   22.948   87.532   6.3703   96.933   5.7398 -9.401085 8.574711 
1 1 1   17   11   29 o  155.951   3.0539  510.636   18.998  490.697   30.754  522.941   24.160  153.256   4.8654  158.646   3.6923 -5.390045 6.107755 
1 1 1   17   11   30 f   47.671   4.6421   48.431   9.0320   40.986   12.865   55.667   12.683   43.929   7.1006   51.412   5.9813 -7.483711 9.284102 
1 1 1   17   11   31 o   55.717   4.2981   65.415   9.8427   68.307   14.656   63.038   13.285   56.794   6.2565   54.640   5.8948 2.153938 8.596121 
1 1 1   17   11   32 o   27.733   5.7945   15.515   8.1460   2.4744   11.573   28.320   11.468   19.970   8.3640   35.497   8.0218 -15.52663 11.58905 
1 1 1   17   11   33 o   67.111   4.7737   92.140   12.412   84.477   14.910  109.438   22.401   63.125   5.7267   71.097   7.6392 -7.971928 9.547367 
1 1 1   17   11   34 o   20.725   5.9614   4.2692   8.1102   7.6064   11.289   0.7097   11.659   22.200   8.6160   19.250   8.2412 2.950226 11.92279 
1 1 1   17   11   35 o   64.663   3.8514   89.264   10.213   79.297   14.540   98.970   14.348   60.962   5.7826   68.365   5.0886 -7.402241 7.702798 
1 1 1   17   11   36 o   97.699   3.1236  201.242   12.551  182.490   17.602  220.635   17.901   92.983   4.5899  102.414   4.2379 -9.430618 6.247143 
1 1 1   17   11   37 o   67.381   3.8143   97.200   10.562   93.135   15.390  100.819   14.521   65.929   5.6597   68.832   5.1149 -2.903076 7.628544 
1 1 1   17   11   38 o   53.926   6.6965   74.903   12.370   54.336   23.248   83.027   14.610   45.843   12.113   62.009   5.7127 -16.16664 13.39294 
1 1 1   17   11   39 o   52.435   4.6654   60.577   10.088   61.254   14.443   59.932   14.096   52.697   6.6450   52.173   6.5505 0.5240402 9.330858 
1 1 1   17   11   40 f   30.421   7.9545   10.747   11.674   1.1804   13.053   48.984   26.096   19.680   8.5731   41.162   13.401 -21.48243 15.90891 
1 1 1   17   11   41 o   33.977   8.1495   24.158   12.044   16.784   13.737   48.670   25.045   26.883   9.6898   41.071   13.106 -14.18765 16.29901 
1 1 1   17   11   42 o   32.936   9.7476   28.092   14.174   28.092   14.174   0.0000   0.0000   32.936   9.7476  ?   ?       ?      ? 
1 1 1   17   11   43 o   33.788   7.7923   35.118   13.840   42.156   15.452   6.5703   31.121   40.460   9.4336   27.117   12.405 13.34270 15.58456 
1 1 1   17   11   44 o   24.796   7.6273   10.111   12.527   8.8929   14.112   14.641   27.209   22.349   9.2873   27.244   12.102 -4.895164 15.25459 
1 1 1   17   11   45 o   31.269   13.639   33.041   33.129   33.041   33.129   0.0000   0.0000   31.269   13.639  ?   ?       ?      ? 
1 1 1   17   12    0 o  288.526   2.5300  1718.74   42.564  1718.74   42.564  1718.74   42.564  288.526   3.5780  288.526   3.5780 0.000000 0.000000 
1 1 1   17   12    1 o  222.677   2.2502  1023.68   20.666  1022.30   29.175  1025.07   29.279  222.526   3.1788  222.827   3.1858 -0.3006897 4.500474 
1 1 1   17   12    2 o  148.222   2.0745  453.367   12.680  443.257   17.774  463.845   18.095  146.540   2.9407  149.905   2.9267 -3.365234 4.148926 
1 1 1   17   12    3 o  154.692   2.0843  493.876   13.298  487.347   18.669  500.600   18.945  153.655   2.9459  155.730   2.9495 -2.075089 4.168697 
1 1 1   17   12    4 o  172.710   2.1138  615.594   15.055  605.537   21.103  626.021   21.486  171.274   2.9873  174.146   2.9914 -2.872528 4.227547 
1 1 1   17   12    5 o  437.004   3.3144  3947.01   59.727  3914.67   83.494  3980.92   85.475  435.178   4.6518  438.829   4.7226 -3.651062 6.628860 
1 1 1   17   12    6 o  280.338   2.4952  1622.81   28.850  1614.51   40.559  1631.32   41.044  279.614   3.5169  281.063   3.5406 -1.449066 4.990496 
1 1 1   17   12    7 o  151.362   2.0781  472.912   12.973  472.162   18.299  473.670   18.394  151.241   2.9336  151.482   2.9441 -0.2406921 4.156159 
1 1 1   17   12    8 o  143.707   2.2170  425.815   13.047  421.829   17.402  430.932   19.716  142.949   2.9515  144.465   3.3089 -1.515640 4.433996 
1 1 1   17   12    9 o  207.470   2.5276  888.904   21.627  873.987   30.370  904.250   30.805  205.704   3.5797  209.236   3.5696 -3.532135 5.055268 
1 1 1   17   12   10 o  277.067   3.0842  1590.78   33.622  1574.32   56.664  1599.72   41.770  275.855   4.9803  278.279   3.6393 -2.424011 6.168301 
1 1 1   17   12   11 o  160.733   2.5165  533.255   16.670  523.672   23.051  543.762   24.137  159.224   3.5100  162.242   3.6070 -3.018051 5.032985 
1 1 1   17   12   12 o  180.745   2.2948  677.275   16.753  661.360   26.360  688.060   21.700  178.930   3.5719  182.560   2.8819 -3.630173 4.589556 
1 1 1   17   12   13 o   67.815   2.8842   97.846   7.7228   84.339   12.395  106.418   9.8736   63.851   4.7066   71.779   3.3351 -7.927822 5.768446 
1 1 1   17   12   14 o   74.264   2.7387  113.481   8.1562  116.144   13.249  111.856   10.350   74.944   4.2862   73.584   3.4102 1.359383 5.477345 
1 1 1   17   12   15 o  116.825   3.7622  275.980   12.950  292.321   33.859  273.180   14.015  118.630   6.9201  115.019   2.9544 3.610916 7.524336 
1 1 1   17   12   16 o   88.680   3.1337  149.594   10.529  196.423   20.200  132.124   12.338   97.403   5.0282   79.956   3.7413 17.44749 6.267386 
1 1 1   17   12   17 o   90.393   2.7861  169.027   10.380  175.354   14.632  162.617   14.728   92.102   3.8518   88.684   4.0266 3.417938 5.572235 
1 1 1   17   12   18 o   36.177   5.6150   28.247   8.1575   24.751   11.313   32.034   11.773   33.791   8.2006   38.562   7.6723 -4.771076 11.23007 
1 1 1   17   12   19 o  192.735   2.8747  767.058   22.793  752.223   31.014  784.484   33.612  190.728   3.9425  194.742   4.1848 -4.013565 5.749394 
1 1 1   17   12   20 o  230.657   2.5263  1099.69   24.030  1097.15   33.685  1102.32   34.290  230.390   3.5450  230.924   3.6003 -0.5342865 5.052606 
1 1 1   17   12   21 o  186.368   3.2428  719.453   24.771  716.834   37.122  721.555   33.259  186.020   4.8384  186.717   4.3188 -0.6970673 6.485578 
1 1 1   17   12   22 o  125.792   3.1058  330.741   15.756  343.449   20.482  312.320   24.660  128.840   3.8543  122.743   4.8711 6.097359 6.211524 
1 1 1   17   12   23 o  204.762   3.8957  867.878   32.900  867.878   32.900   0.0000   0.0000  204.762   3.8957  ?   ?       ?      ? 
1 1 1   17   12   24 o  153.572   2.8544  485.451   17.729  473.129   22.794  504.321   28.206  151.184   3.6555  155.960   4.3849 -4.775864 5.708778 
1 1 1   17   12   25 o  191.843   2.9809  765.122   23.387  779.964   31.283  746.318   35.212  194.030   3.9091  189.656   4.5014 4.373322 5.961874 
1 1 1   17   12   26 o   74.907   3.6603  119.044   11.080  102.697   16.679  131.954   14.822   70.129   5.7665   79.686   4.5100 -9.556480 7.320666 
1 1 1   17   12   27 o   88.682   3.1366  163.152   11.450  149.705   15.783  178.095   16.637   84.822   4.5114   92.543   4.3588 -7.721107 6.273139 
1 1 1   17   12   28 o   58.856   3.8594   72.540   9.3677   73.929   13.280   71.164   13.216   59.424   5.4182   58.289   5.4975 1.134857 7.718795 
1 1 1   17   12   29 o  166.259   3.3103  577.035   22.691  592.689   32.635  562.384   31.572  168.433   4.6978  164.085   4.6651 4.348022 6.620604 
1 1 1   17   12   30 o  131.363   2.8616  358.287   15.389  368.631   23.364  350.360   20.453  132.962   4.2605  129.764   3.8215 3.197250 5.723279 
1 1 1   17   12   31 o  134.016   2.9899  377.811   16.218  363.490   25.229  387.898   21.173  131.645   4.6465  136.387   3.7640 -4.741974 5.979711 
1 1 1   17   12   32 o   49.947   6.7229   58.576   11.530   60.945   13.291   51.371   23.179   53.559   6.0167   46.336   12.025 7.222561 13.44585 
1 1 1   17   12   33 o  112.305   3.6225  270.173   16.104  282.748   20.413  249.449   26.205  116.200   4.2593  108.410   5.8608 7.790329 7.245027 
1 1 1   17   12   34 o   23.905   6.1641   10.529   8.0869   14.931   11.350   5.9891   11.526   26.374   8.8478   21.435   8.5849 4.938848 12.32817 
1 1 1   17   12   35 o   84.834   3.6387  152.691   12.617  151.156   19.102  153.880   16.803   84.295   5.4944   85.372   4.7721 -1.077171 7.277441 
1 1 1   17   12   36 o   76.640   3.4784  124.316   10.983  131.799   15.970  117.601   15.128   78.827   4.9121   74.454   4.9262 4.372795 6.956742 
1 1 1   17   12   37 o   21.130   5.4596   1.9466   7.7300   18.731   11.160 -13.5308   10.717   28.486   8.6997   13.775   6.5989 14.71070 10.91925 
1 1 1   17   12   38 o   44.429   7.2358   42.037   11.623   65.060   23.680   34.730   13.340   50.548   11.604   38.310   8.6478 12.23792 14.47167 
1 1 1   17   12   39 f   43.396   5.5714   43.532   9.7063   49.018   13.736   38.060   13.718   46.810   7.1146   39.982   8.5758 6.827835 11.14279 
1 1 1   17   12   40 o   40.569   7.9875   44.560   13.047   45.875   15.017   40.511   26.348   43.630   8.6506   37.508   13.430 6.122009 15.97500 
1 1 1   17   12   41 o   21.033   6.8441  -3.7778   11.148  -5.4112   12.575   2.2177   24.092   17.111   7.8489   24.955   11.214 -7.844032 13.68828 
1 1 1   17   12   42 o   57.422   7.1589   76.212   16.955   76.212   16.955   0.0000   0.0000   57.422   7.1589  ?   ?       ?      ? 
1 1 1   17   12   43 o   43.352   8.0106   60.703   15.528   69.043   17.832   34.547   31.581   53.577   8.0698   33.126   13.840 20.45101 16.02118 
1 1 1   17   12   44 o   30.833   7.6672   29.595   13.852   37.687   15.689   0.9759   29.505   36.892   10.042   24.774   11.589 12.11794 15.33444 
1 1 1   17   13    0 o  209.382   2.5763  905.575   31.443  905.575   31.443  905.575   31.443  209.382   3.6435  209.382   3.6435 0.000000 0.000000 
1 1 1   17   13    1 o  127.624   2.0584  336.203   10.835  333.025   15.294  339.405   15.352  127.019   2.9194  128.230   2.9028 -1.211632 4.116888 
1 1 1   17   13    2 o  124.665   2.0678  320.784   10.632  324.740   15.084  316.879   14.987  125.429   2.9159  123.901   2.9328 1.528061 4.135670 
1 1 1   17   13    3 o  212.582   2.2168  932.882   19.436  926.685   27.302  939.249   27.675  211.867   3.1244  213.297   3.1458 -1.429779 4.433698 
1 1 1   17   13    4 o  141.202   2.0600  411.553   11.997  414.425   17.000  408.704   16.932  141.693   2.9089  140.711   2.9176 0.9817047 4.119930 
1 1 1   17   13    5 f  181.042   2.1256  676.610   15.872  678.977   22.508  674.269   22.386  181.357   3.0090  180.727   3.0032 0.6293793 4.251273 
1 1 1   17   13    6 f  231.682   2.2896  1108.31   21.878  1111.82   30.998  1104.82   30.883  232.047   3.2388  231.316   3.2370 0.7311707 4.579100 
1 1 1   17   13    7 o  183.488   2.1406  695.045   16.199  702.877   23.029  687.373   22.792  184.511   3.0261  182.464   3.0285 2.046509 4.281261 
1 1 1   17   13    8 o   95.443   2.3039  189.014   9.0235  200.808   12.421  175.834   13.131   98.619   3.0537   92.267   3.4505 6.351540 4.607747 
1 1 1   17   13    9 o  287.369   2.9261  1702.84   34.628  1637.66   47.393  1777.49   50.719  281.493   4.0821  293.246   4.1935 -11.75311 5.852205 
1 1 1   17   13   10 o  111.302   2.5084  255.805   11.513  260.127   16.497  251.702   16.074  112.217   3.5644  110.387   3.5304 1.830551 5.016897 
1 1 1   17   13   11 o  169.626   2.3917  594.814   16.660  588.516   24.669  600.094   22.589  168.786   3.5437  170.465   3.2129 -1.678284 4.783353 
1 1 1   17   13   12 o  119.539   2.2972  294.915   11.006  296.077   17.822  294.198   13.993  119.708   3.6097  119.370   2.8422 0.3374405 4.594323 
1 1 1   17   13   13 o  268.904   2.5838  1495.90   27.885  1486.67   44.878  1501.70   35.590  268.165   4.0575  269.643   3.2001 -1.478882 5.167641 
1 1 1   17   13   14 o  327.761   3.2959  2218.85   40.372  2231.86   75.240  2213.59   47.842  328.206   5.5582  327.315   3.5439 0.8907471 6.591877 
1 1 1   17   13   15 o  145.693   3.6705  462.611   16.220  405.961   39.001  474.460   17.836  139.802   6.7639  151.584   2.8529 -11.78223 7.340927 
1 1 1   17   13   16 o  221.651   3.0317  1000.03   26.302  1066.91   45.625  966.733   32.190  227.017   4.8728  216.285   3.6085 10.73230 6.063422 
1 1 1   17   13   17 o  186.139   2.5658  713.822   19.489  701.104   25.649  731.196   29.978  184.210   3.3759  188.067   3.8648 -3.856735 5.131595 
1 1 1   17   13   18 o  137.338   2.4634  389.857   13.952  384.076   19.796  395.563   19.667  136.323   3.5208  138.353   3.4465 -2.029785 4.926864 
1 1 1   17   13   19 o  108.963   2.8029  246.879   12.491  233.920   18.627  257.469   16.839  106.328   4.2475  111.599   3.6584 -5.271385 5.605772 
1 1 1   17   13   20 o  251.844   2.5868  1310.92   26.864  1292.48   37.508  1330.34   38.494  250.029   3.6372  253.658   3.6794 -3.628922 5.173669 
1 1 1   17   13   21 o   37.754   5.4064   30.812   8.2496   39.435   11.652   22.146   11.681   43.530   6.4901   31.978   8.6485 11.55183 10.81286 
1 1 1   17   13   22 o   46.659   6.3971   54.064   10.974   66.316   13.378   28.864   19.186   56.482   5.7428   36.836   11.433 19.64536 12.79421 
1 1 1   17   13   23 o   41.944   6.5410   39.120   10.345   41.163   12.293   34.160   19.155   44.402   6.7124   39.486   11.229 4.915829 13.08206 
1 1 1   17   13   24 o  126.836   3.0979  334.630   15.597  337.323   19.608  329.990   25.738  127.633   3.7248  126.040   4.9511 1.592857 6.195734 
1 1 1   17   13   25 o   88.266   3.8621  168.930   13.059  182.539   16.159  143.306   22.173   93.791   4.1772   82.741   6.4973 11.05045 7.724265 
1 1 1   17   13   26 o   28.626   7.1119   16.056   10.314   18.415   12.872   11.823   17.239   29.507   9.3936   27.745   10.681 1.761992 14.22379 
1 1 1   17   13   27 o   50.086   4.3399   52.695   8.9649   52.560   12.725   52.827   12.632   50.018   6.1684   50.154   6.1065 -0.1358910 8.679798 
1 1 1   17   13   28 o   92.389   3.0322  177.900   11.554  176.505   16.377  179.281   16.302   92.023   4.3150   92.756   4.2613 -0.7328262 6.064466 
1 1 1   17   13   29 o  120.192   3.7163  302.730   18.420  305.764   26.292  299.805   25.815  120.775   5.2782  119.609   5.2329 1.166183 7.432537 
1 1 1   17   13   30 o  110.231   2.8781  253.255   13.054  229.971   18.117  278.395   18.826  104.931   4.1863  115.531   3.9508 -10.59991 5.756185 
1 1 1   17   13   31 o   18.763   5.5932  -0.5083   7.9847 -11.0686   12.294   7.1952   10.501   15.959   7.4704   21.567   8.3264 -5.607547 11.18643 
1 1 1   17   13   32 o   26.602   6.6157   13.740   10.506   23.467   12.012 -17.9109   21.669   32.141   8.8026   21.064   9.8784 11.07644 13.23133 
1 1 1   17   13   33 o   54.393   4.2348   62.933   9.4785   63.427   13.902   62.504   12.957   54.538   6.1804   54.249   5.7910 0.2892723 8.469534 
1 1 1   17   13   34 o   42.599   5.3370   40.578   8.9069   57.820   13.032   25.465   12.201   51.964   6.0806   33.234   8.7727 18.73001 10.67400 
1 1 1   17   13   35 o   36.956   6.4791   32.082   9.8903   27.265   14.203   36.617   13.781   34.060   9.6631   39.852   8.6337 -5.791759 12.95825 
1 1 1   17   13   36 o   66.940   3.7563   95.747   10.348   92.427   14.965   98.788   14.324   65.737   5.5196   68.142   5.0965 -2.404678 7.512635 
1 1 1   17   13   37 o   41.086   5.6071   39.190   9.2072   28.040   13.039   50.279   13.003   34.266   9.0802   47.906   6.5810 -13.64022 11.21421 
1 1 1   17   13   38 o   61.417   5.9382   91.012   12.558   77.187   23.527   96.520   14.850   55.925   10.587   66.908   5.3812 -10.98273 11.87638 
1 1 1   17   13   39 o   32.894   6.8475   30.915   11.943   41.564   13.537  -6.4813   25.369   41.908   8.1254   23.880   11.024 18.02772 13.69508 
1 1 1   17   13   40 o   34.932   8.6124   34.525   14.148   37.960   14.818  -0.9228   47.607   39.121   9.3170   30.743   14.488 8.378351 17.22486 
1 1 1   17   13   41 o   39.053   8.0354   39.353   12.353   36.656   14.126   48.124   25.471   38.234   9.0907   39.872   13.253 -1.637932 16.07078 
1 1 1   17   13   42 o   41.625   8.5233   37.337   13.554   24.855   15.218   85.230   29.809   30.610   10.245   52.641   13.624 -22.03161 17.04663 
1 1 1   17   13   43 o   19.674   8.7635   0.9510   14.370   0.9510   14.370   0.0000   0.0000   19.674   8.7635  ?   ?       ?      ? 
1 1 1   17   13   44 o   44.055   10.537   71.398   22.880  101.723   36.369   51.534   29.435   51.043   15.724   37.067   14.031 13.97566 21.07436 
1 1 1   17   14    0 o  111.720   2.1062  258.084   13.703  258.084   13.703  258.084   13.703  111.720   2.9787  111.720   2.9787 0.000000 0.000000 
1 1 1   17   14    1 o  190.325   2.1469  747.816   16.853  741.165   23.731  754.583   23.937  189.471   3.0367  191.179   3.0358 -1.707382 4.293885 
1 1 1   17   14    2 o  205.367   2.1918  870.723   18.564  876.721   26.439  864.891   26.071  206.064   3.1109  204.671   3.0884 1.393158 4.383575 
1 1 1   17   14    3 o  144.669   2.0631  431.961   12.308  439.673   17.572  424.533   17.246  145.936   2.9193  143.402   2.9159 2.534515 4.126110 
1 1 1   17   14    4 o  148.390   2.0659  454.412   12.641  465.963   18.077  443.357   17.684  150.235   2.9173  146.545   2.9259 3.689926 4.131782 
1 1 1   17   14    5 f  249.083   2.7213  1274.46   27.857  1196.71   37.508  1370.10   41.600  240.669   3.7786  257.497   3.9171 -16.82756 5.442548 
1 1 1   17   14    6 o  127.948   2.0664  337.955   10.903  346.535   15.493  329.536   15.347  129.558   2.8993  126.338   2.9452 3.219978 4.132831 
1 1 1   17   14    7 o   37.171   3.9113   29.384   5.7682   33.598   7.9715   24.752   8.3571   40.302   4.7956   34.039   6.1803 6.263142 7.822646 
1 1 1   17   14    8 o   98.583   2.2646  200.356   9.1637  197.375   12.326  204.040   13.701   97.770   3.0567   99.395   3.3422 -1.624931 4.529219 
1 1 1   17   14    9 o   98.560   2.3419  199.973   9.2828  203.565   14.945  197.716   11.845   99.263   3.6505   97.858   2.9347 1.404831 4.683830 
1 1 1   17   14   10 o  276.799   2.7356  1579.67   30.913  1609.57   47.414  1557.57   40.768  279.031   4.1199  274.567   3.6001 4.464569 5.471217 
1 1 1   17   14   11 f  188.110   2.2891  728.563   17.247  740.473   28.060  721.332   21.864  189.307   3.5938  186.912   2.8361 2.394653 4.578105 
1 1 1   17   14   12 o  106.390   2.3632  237.111   10.050  219.589   16.024  248.474   12.904  103.079   3.7690  109.700   2.8520 -6.620514 4.726415 
1 1 1   17   14   13 o  108.359   3.0206  240.679   13.149  233.722   16.680  252.098   21.369  106.340   3.8031  110.377   4.6940 -4.036880 6.041256 
1 1 1   17   14   14 f  196.525   2.6807  804.575   19.921  782.503   36.080  814.256   23.894  194.479   4.4981  198.572   2.9174 -4.092499 5.361355 
1 1 1   17   14   15 o  235.349   2.9366  1148.66   26.635  1136.48   46.804  1154.49   32.392  234.305   4.8433  236.393   3.3222 -2.089066 5.873195 
1 1 1   17   14   16 o   59.141   4.1896   74.055   8.4290   69.879   17.791   75.264   9.5714   57.944   7.4444   60.338   3.8461 -2.393898 8.379245 
1 1 1   17   14   17 o  249.234   2.8368  1283.83   29.149  1257.06   40.514  1312.57   41.971  246.546   3.9842  251.922   4.0394 -5.375320 5.673680 
1 1 1   17   14   18 o  129.891   4.2523  349.914   22.736  345.086   31.100  355.457   33.322  128.953   5.8475  130.829   6.1754 -1.876282 8.504612 
1 1 1   17   14   19 f  200.391   2.6434  831.538   21.623  821.936   32.931  838.816   28.669  199.332   4.0055  201.449   3.4505 -2.116913 5.286808 
1 1 1   17   14   20 o  147.540   3.3510  448.517   20.143  467.321   31.282  435.197   26.327  150.118   5.0524  144.963   4.4033 5.154816 6.701933 
1 1 1   17   14   21 o   93.787   3.1650  180.273   12.060  193.514   19.023  171.376   15.594   96.604   4.7745   90.971   4.1561 5.633018 6.330007 
1 1 1   17   14   22 o   67.617   3.6335   94.933   10.115   87.508   14.135  102.727   14.482   64.894   5.2812   70.339   4.9918 -5.445320 7.267017 
1 1 1   17   14   23 f   37.474   5.7233   30.745   8.6081   35.973   12.158   25.490   12.190   40.814   7.4986   34.133   8.6483 6.681396 11.44652 
1 1 1   17   14   24 o   87.585   3.0648  159.352   11.061  152.913   15.743  165.630   15.544   85.821   4.4477   89.349   4.2180 -3.527618 6.129697 
1 1 1   17   14   25 f   50.313   4.9826   51.938   9.8365   38.314   12.728   72.143   15.500   41.985   7.6313   58.642   6.4086 -16.65774 9.965239 
1 1 1   17   14   26 o  100.994   3.6615  215.489   14.279  220.318   17.486  205.824   24.735  102.946   4.1183   99.043   6.0552 3.903748 7.322972 
1 1 1   17   14   27 o  169.549   3.9311  638.670   24.526  692.622   29.539  518.927   44.006  182.483   3.9247  156.615   6.8126 25.86766 7.862267 
1 1 1   17   14   28 o  105.859   2.9378  233.221   12.819  226.782   17.745  240.249   18.537  104.341   4.1234  107.378   4.1857 -3.037086 5.875596 
1 1 1   17   14   29 o   46.057   6.4207   49.655   10.642   40.788   20.030   53.143   12.561   41.965   11.314   50.149   6.0731 -8.183346 12.84132 
1 1 1   17   14   30 o   60.813   3.9305   78.582   9.7082   95.690   13.913   62.348   13.553   67.440   5.0019   54.186   6.0645 13.25441 7.861069 
1 1 1   17   14   31 o   33.678   7.4463   25.272   10.562   25.355   12.185   25.020   21.182   33.387   8.7449   33.969   12.055 -0.5820351 14.89257 
1 1 1   17   14   32 o   35.022   7.3880   28.466   10.930   29.789   12.877   25.057   20.672   36.172   8.7307   33.872   11.921 2.300198 14.77593 
1 1 1   17   14   33 o   46.925   5.0622   48.785   9.4429   41.872   13.639   55.150   13.087   43.131   7.9603   50.719   6.2560 -7.587997 10.12439 
1 1 1   17   14   34 o   22.178   6.1641   7.1369   8.4079   2.8536   12.459   10.719   11.394   20.562   8.6484   23.794   8.7857 -3.231857 12.32821 
1 1 1   17   14   35 o   40.194   5.7419   38.193   9.2944   51.412   12.783   23.365   13.538   48.770   6.3548   31.619   9.5653 17.15076 11.48385 
1 1 1   17   14   36 o   29.479   6.4176   20.249   8.6326   17.334   12.368   23.018   12.055   27.679   9.2363   31.279   8.9125 -3.599236 12.83520 
1 1 1   17   14   37 f   33.773   6.2911   27.609   9.2263   36.077   12.771   18.363   13.344   39.327   8.1415   28.219   9.5932 11.10800 12.58229 
1 1 1   17   14   38 o   64.198   4.3425   91.811   11.263   80.372   16.964  100.829   15.062   60.099   6.8439   68.296   5.3471 -8.196835 8.685079 
1 1 1   17   14   39 o   33.836   7.9553   28.671   11.776   27.703   13.415   31.919   24.584   33.337   9.3683   34.335   12.860 -0.9980583 15.91070 
1 1 1   17   14   40 o   57.785   6.7042   78.278   13.745   74.049   16.006   90.159   26.827   57.317   6.7707   58.254   11.573 -0.9363594 13.40842 
1 1 1   17   14   41 o   30.212   7.6631   25.298   13.598   33.571   15.442  -3.2771   28.699   35.589   10.068   24.836   11.555 10.75291 15.32616 
1 1 1   17   14   42 o   22.826   7.6904 -18.4139   21.011 -49.0759   32.458   3.6999   27.565   20.162   10.024   25.490   11.666 -5.328192 15.38072 
1 1 1   17   14   43 o   41.343   9.6905   45.946   16.236   45.946   16.236   0.0000   0.0000   41.343   9.6905  ?   ?       ?      ? 
1 1 1   17   15    0 o  239.638   2.6641  1186.24   37.217  1186.24   37.217  1186.24   37.217  239.638   3.7676  239.638   3.7676 0.000000 0.000000 
1 1 1   17   15    1 o  257.962   2.3939  1374.31   25.469  1380.44   36.192  1368.31   35.848  258.530   3.3942  257.393   3.3768 1.136993 4.787810 
1 1 1   17   15    2 o  112.987   2.0879  263.565   9.7298  262.981   13.749  264.150   13.771  112.861   2.9536  113.112   2.9519 -0.2506332 4.175822 
1 1 1   17   15    3 o   99.988   2.1225  206.384   8.7508  199.763   12.296  213.180   12.457   98.362   3.0309  101.614   2.9723 -3.251900 4.245067 
1 1 1   17   15    4 o   53.610   2.7684   59.442   6.1157   57.615   8.7449   61.192   8.5561   52.800   4.0156   54.420   3.8120 -1.620056 5.536829 
1 1 1   17   15    5 o  320.786   2.6871  2126.11   35.550  2137.39   50.562  2115.08   49.993  321.626   3.8116  319.947   3.7885 1.679108 5.374124 
1 1 1   17   15    6 o   77.659   2.3290  124.569   7.4588  125.448   10.481  123.667   10.617   77.938   3.2604   77.380   3.3268 0.5575104 4.658067 
1 1 1   17   15    7 o  172.914   2.2493  619.285   15.955  636.941   21.654  598.315   23.598  175.633   2.9892  170.195   3.3618 5.437439 4.498544 
1 1 1   17   15    8 o   74.788   2.7120  119.949   7.9869   98.435   12.675  134.117   10.286   68.988   4.4546   80.588   3.0946 -11.59982 5.424067 
1 1 1   17   15    9 o  117.375   2.2607  283.994   10.668  287.017   17.162  282.090   13.618  117.864   3.5305  116.887   2.8248 0.9766922 4.521480 
1 1 1   17   15   10 o  110.414   2.4659  252.339   11.183  246.311   16.472  257.493   15.232  109.178   3.6579  111.649   3.3078 -2.471115 4.931710 
1 1 1   17   15   11 o  172.335   2.2651  613.793   15.681  611.835   25.195  615.031   20.033  172.079   3.5500  172.590   2.8143 -0.5109711 4.530184 
1 1 1   17   15   12 o  154.987   2.2568  498.282   14.100  485.943   22.307  506.492   18.195  153.354   3.5269  156.619   2.8167 -3.264816 4.513613 
1 1 1   17   15   13 o  193.641   2.6603  762.290   19.115  804.283   36.473  746.387   22.445  197.164   4.4851  190.119   2.8624 7.044830 5.320690 
1 1 1   17   15   14 o  155.167   2.6127  505.380   15.464  476.960   27.355  518.727   18.747  151.842   4.3680  158.492   2.8678 -6.649902 5.225329 
1 1 1   17   15   15 o  193.365   2.7949  782.006   20.860  747.539   36.220  799.112   25.516  190.046   4.6208  196.684   3.1454 -6.638092 5.589801 
1 1 1   17   15   16 o  267.659   3.0166  1481.22   30.100  1484.69   56.280  1479.83   35.623  267.691   5.0974  267.627   3.2273 0.6344604E-01 6.033192 
1 1 1   17   15   17 o  172.319   2.4050  613.690   17.092  617.798   24.125  609.549   24.220  172.900   3.3830  171.738   3.4193 1.162201 4.810047 
1 1 1   17   15   18 o  202.289   2.4324  845.819   20.294  840.762   28.585  850.958   28.816  201.680   3.4364  202.898   3.4434 -1.218201 4.864740 
1 1 1   17   15   19 o   25.425   6.0604   12.691   7.5318   12.058   10.930   13.264   10.394   25.145   8.6783   25.705   8.4619 -0.5607758 12.12088 
1 1 1   17   15   20 f   64.335   3.6519   86.124   9.6000   84.273   14.517   87.562   12.798   63.689   5.5265   64.981   4.7751 -1.291813 7.303709 
1 1 1   17   15   21 o   65.578   3.6110   89.439   9.7531   92.688   13.612   86.012   13.981   66.818   4.9394   64.337   5.2687 2.480728 7.221990 
1 1 1   17   15   22 o   83.674   3.7330  146.721   12.477  150.438   15.901  140.767   20.125   85.154   4.5275   82.194   5.9366 2.959816 7.466029 
1 1 1   17   15   23 o  136.925   2.6611  388.574   15.000  386.721   21.862  390.222   20.619  136.596   3.8805  137.254   3.6424 -0.6579590 5.322105 
1 1 1   17   15   24 o   82.462   3.0353  141.343   10.317  140.149   14.818  142.466   14.373   82.112   4.3755   82.812   4.2080 -0.7005386 6.070583 
1 1 1   17   15   25 f   86.208   3.6800  154.380   13.036  137.117   17.791  174.393   19.155   81.006   5.3249   91.410   5.0807 -10.40356 7.359910 
1 1 1   17   15   26 f   67.213   3.8893   95.635   10.625   88.193   16.077  101.407   14.158   64.761   6.0189   69.665   4.9275 -4.904739 7.778689 
1 1 1   17   15   27 o   84.309   3.4350  150.068   11.668  141.458   18.287  155.979   15.153   82.112   5.3997   86.506   4.2472 -4.393585 6.869911 
1 1 1   17   15   28 o   28.742   6.1908   17.899   8.0177   20.527   11.707   15.578   11.003   30.438   8.8170   27.047   8.6928 3.391129 12.38158 
1 1 1   17   15   29 o   92.734   3.6892  179.248   13.591  174.111   16.966  188.452   22.708   91.147   4.5131   94.320   5.8372 -3.173134 7.378352 
1 1 1   17   15   30 o   95.232   3.7167  193.319   13.834  184.842   23.373  197.890   17.163   93.246   6.0773   97.217   4.2803 -3.971336 7.433386 
1 1 1   17   15   31 o  125.591   3.8026  342.627   18.169  359.781   22.167  307.508   31.717  131.150   4.0980  120.032   6.4066 11.11758 7.605105 
1 1 1   17   15   32 o   87.976   3.3495  163.074   12.101  162.745   17.949  163.349   16.385   87.807   4.9562   88.146   4.5068 -0.3387604 6.698909 
1 1 1   17   15   33 o  104.865   4.0069  244.206   16.022  205.242   27.239  264.819   19.812   97.470   6.7757  112.260   4.2789 -14.78982 8.013714 
1 1 1   17   15   34 o   73.303   3.9188  114.946   11.774  112.925   17.559  116.597   15.869   72.564   5.8670   74.042   5.1966 -1.477264 7.837512 
1 1 1   17   15   35 o   31.122   6.5450   22.667   9.0608   25.049   12.714   20.209   12.916   32.646   9.1011   29.597   9.4084 3.048214 13.08999 
1 1 1   17   15   36 o   22.808   6.2282   9.1887   8.3371   7.4627   11.770   10.927   11.812   21.903   8.7073   23.712   8.9076 -1.808420 12.45637 
1 1 1   17   15   37 o   49.892   4.8780   55.615   9.9459   49.308   14.392   61.380   13.760   46.875   7.4443   52.908   6.3057 -6.033600 9.755973 
1 1 1   17   15   38 o   24.041   7.3869  -1.0287   10.942  -6.8918   12.162   23.883   25.069   16.465   7.6125   31.617   12.662 -15.15100 14.77379 
1 1 1   17   15   39 o   52.313   8.2648   73.934   17.435   83.725   23.771   62.533   25.651   57.574   10.393   47.052   12.854 10.52263 16.52965 
1 1 1   17   15   40 o   42.733   7.2490   54.091   12.709   62.497   14.817   30.682   24.725   52.396   6.8562   33.070   12.774 19.32553 14.49792 
1 1 1   17   15   41 o   73.485   6.0273  113.516   16.247   94.712   18.581  174.570   33.481   64.054   7.0332   82.916   9.7902 -18.86165 12.05463 
1 1 1   17   15   42 o   52.860   8.0322   88.370   16.165   99.956   19.116   59.286   30.287   65.250   7.1031   40.471   14.409 24.77903 16.06449 
1 1 1   17   15   43 o   18.859   8.4367   0.4730   13.473   0.4730   13.473   0.0000   0.0000   18.859   8.4367  ?   ?       ?      ? 
1 1 1   17   16    0 o   89.822   2.2076  167.097   11.534  167.097   11.534  167.097   11.534   89.822   3.1220   89.822   3.1220 0.000000 0.000000 
1 1 1   17   16    1 o   93.284   2.1428  179.615   8.2402  187.653   11.773  171.897   11.537   95.331   2.9944   91.238   3.0659 4.092682 4.285522 
1 1 1   17   16    2 o   78.495   2.2976  127.292   7.4292  119.238   10.447  135.531   10.567   75.979   3.3338   81.010   3.1626 -5.031433 4.595246 
1 1 1   17   16    3 o  162.986   2.0805  548.476   13.985  544.943   19.680  552.079   19.877  162.456   2.9372  163.515   2.9473 -1.059479 4.160995 
1 1 1   17   16    4 o  139.385   2.0680  401.045   11.887  392.251   16.659  410.166   16.966  137.829   2.9305  140.942   2.9187 -3.113037 4.135972 
1 1 1   17   16    5 o  223.019   2.2571  1027.18   20.761  1020.25   29.187  1034.29   29.536  222.257   3.1840  223.780   3.2002 -1.522324 4.514277 
1 1 1   17   16    6 o   62.755   2.6552   81.092   6.8578   76.981   9.3343   85.914   10.109   61.035   3.7080   64.475   3.8014 -3.440586 5.310365 
1 1 1   17   16    7 o  276.354   2.7130  1576.64   30.606  1591.12   46.853  1565.85   40.423  277.418   4.0948  275.291   3.5602 2.126831 5.426065 
1 1 1   17   16    8 f   74.519   2.6036  113.819   7.7797  118.684   12.694  110.892   9.8454   75.767   4.0621   73.271   3.2579 2.496758 5.207142 
1 1 1   17   16    9 o  116.354   2.4873  278.560   11.911  303.355   17.477  257.055   16.276  121.170   3.4971  111.538   3.5380 9.631920 4.974595 
1 1 1   17   16   10 o  191.994   2.4442  762.683   19.290  747.568   28.306  775.792   26.360  190.199   3.6083  193.789   3.2980 -3.590088 4.888394 
1 1 1   17   16   11 o   66.527   2.8307   90.715   7.4762   94.408   12.500   88.657   9.3287   67.550   4.4866   65.504   3.4529 2.046265 5.661438 
1 1 1   17   16   12 o  109.202   2.3399  245.232   10.244  251.130   16.655  241.641   12.993  110.231   3.6632  108.172   2.9123 2.058777 4.679789 
1 1 1   17   16   13 o  310.195   3.1731  1995.90   37.058  1979.02   67.951  2003.05   44.212  309.044   5.3310  311.347   3.4429 -2.303497 6.346170 
1 1 1   17   16   14 o  223.372   2.4233  1034.81   21.795  1013.62   34.635  1048.71   28.043  221.420   3.7926  225.325   3.0175 -3.905563 4.846539 
1 1 1   17   16   15 o  217.753   2.5023  983.760   22.251  952.280   33.633  1008.26   29.672  214.605   3.7998  220.900   3.2568 -6.295471 5.004545 
1 1 1   17   16   16 o  177.304   2.7255  655.078   18.080  638.248   33.363  662.075   21.512  175.573   4.6073  179.035   2.9133 -3.461731 5.451084 
1 1 1   17   16   17 o   47.002   4.1439   46.338   7.9240   42.619   11.947   49.259   10.588   45.270   6.3984   48.735   5.2677 -3.464539 8.287861 
1 1 1   17   16   18 o  127.691   2.9121  341.170   15.154  369.327   20.491  307.177   22.514  133.614   3.7183  121.768   4.4829 11.84660 5.824242 
1 1 1   17   16   19 o   46.929   4.5296   46.115   8.3222   61.866   12.406   33.229   11.222   54.565   5.5127   39.294   7.1890 15.27078 9.059289 
1 1 1   17   16   20 o   65.242   3.6227   88.486   9.6262   88.004   14.808   88.839   12.668   65.049   5.5193   65.434   4.6940 -0.3844757 7.245459 
1 1 1   17   16   21 o  112.134   2.9601  260.165   13.659  267.530   20.114  253.863   18.607  113.589   4.2934  110.679   4.0761 2.909737 5.920156 
1 1 1   17   16   22 o   50.161   5.1731   51.652   10.380   48.257   12.994   57.641   17.258   48.022   6.5603   52.300   8.0004 -4.277924 10.34617 
1 1 1   17   16   23 o   31.614   5.9540   21.227   8.2035   31.049   12.135   12.961   11.133   37.616   8.0641   25.612   8.7620 12.00343 11.90806 
1 1 1   17   16   24 o   62.589   3.7061   81.919   9.5480   80.018   13.852   83.639   13.179   61.868   5.4285   63.311   5.0471 -1.442146 7.412237 
1 1 1   17   16   25 o  135.822   3.1436  384.421   17.586  383.302   24.233  385.665   25.562  135.650   4.3314  135.994   4.5572 -0.3445435 6.287208 
1 1 1   17   16   26 o  118.234   3.2420  295.471   15.192  305.755   19.208  278.291   24.827  121.233   3.8414  115.235   5.2236 5.997910 6.483994 
1 1 1   17   16   27 o   41.002   5.0897   36.777   8.2784   33.217   12.476   39.577   11.065   38.704   8.0765   43.299   6.1962 -4.594887 10.17947 
1 1 1   17   16   28 o   34.787   5.7752   26.972   8.2382   34.892   12.066   20.055   11.276   39.641   7.6569   29.933   8.6477 9.708027 11.55034 
1 1 1   17   16   29 o   86.164   3.1800  156.057   11.269  144.877   16.091  166.819   15.788   83.063   4.6968   89.264   4.2883 -6.201469 6.359950 
1 1 1   17   16   30 o   35.507   7.3991   24.996   10.020   38.811   21.567   21.193   11.316   40.385   12.041   30.628   8.6028 9.756861 14.79811 
1 1 1   17   16   31 o  101.458   3.7074  220.917   14.720  229.049   18.359  206.279   24.631  104.533   4.2583   98.383   6.0702 6.150185 7.414893 
1 1 1   17   16   32 o   28.126   6.2178   17.678   8.9665   3.8604   14.311   26.606   11.504   22.153   9.2908   34.099   8.2660 -11.94603 12.43566 
1 1 1   17   16   33 o   28.844   6.2603   19.312   8.5202   11.390   13.485   24.576   10.992   24.976   9.4867   32.712   8.1712 -7.735983 12.52063 
1 1 1   17   16   34 o   92.521   3.5814  181.527   13.568  153.672   18.678  212.646   19.742   84.873   5.3358  100.170   4.7785 -15.29709 7.162775 
1 1 1   17   16   35 o   67.064   3.9051   96.739   10.801   95.653   15.210   97.844   15.341   66.681   5.5304   67.448   5.5148 -0.7671509 7.810171 
1 1 1   17   16   36 o   38.412   6.3246   35.222   9.8428   38.659   14.175   32.021   13.678   40.352   8.7677   36.471   9.1177 3.880669 12.64927 
1 1 1   17   16   37 o   25.799   6.5216   14.479   8.7654   18.350   13.279   11.490   11.669   27.898   9.5691   23.700   8.8634 4.198484 13.04324 
1 1 1   17   16   38 o   32.887   7.1239   30.164   11.631   37.630   13.413   7.5293   23.355   39.531   8.4807   26.243   11.449 13.28772 14.24784 
1 1 1   17   16   39 o   32.933   8.3711   22.774   16.728  -2.6271   22.699   52.967   24.748   23.254   10.621   42.612   12.942 -19.35852 16.74215 
1 1 1   17   16   40 o   21.745   6.7487   2.8965   11.870   10.350   13.635 -20.4194   24.117   23.220   9.3242   20.270   9.7591 2.950239 13.49743 
1 1 1   17   16   41 o   22.732   6.7378   5.3725   12.390   17.831   14.067 -37.7331   26.166   26.688   9.7767   18.775   9.2742 7.912296 13.47567 
1 1 1   17   16   42 o   46.824   7.9023   48.095   13.836   29.898   15.749  109.661   28.969   32.436   10.397   61.212   11.903 -28.77571 15.80462 
1 1 1   17   17    0 o   61.629   2.5785   79.223   9.1946   79.223   9.1946   79.223   9.1946   61.629   3.6465   61.629   3.6465 0.000000 0.000000 
1 1 1   17   17    1 o  240.113   2.3196  1190.81   22.970  1199.07   32.691  1182.76   32.283  240.934   3.2897  239.292   3.2710 1.642319 4.639149 
1 1 1   17   17    2 o  114.832   2.0895  272.131   9.8931  263.577   13.811  281.146   14.178  112.979   2.9640  116.684   2.9460 -3.705643 4.178977 
1 1 1   17   17    3 f  158.928   2.0832  521.566   13.655  525.605   19.327  517.542   19.294  159.543   2.9371  158.313   2.9549 1.229736 4.166313 
1 1 1   17   17    4 o   84.305   2.2334  146.876   7.7610  149.965   10.863  143.656   11.092   85.214   3.0909   83.397   3.2247 1.817131 4.466787 
1 1 1   17   17    5 o  339.256   2.9948  2381.81   41.569  2393.98   55.467  2366.21   62.785  340.306   3.9518  338.206   4.5010 2.099823 5.989676 
1 1 1   17   17    6 o  138.755   2.3075  398.142   13.088  394.335   19.829  401.080   17.422  138.151   3.4801  139.359   3.0310 -1.208527 4.614989 
1 1 1   17   17    7 o  189.497   2.2789  742.766   17.363  737.164   27.800  746.349   22.232  188.875   3.5687  190.119   2.8352 -1.244095 4.557846 
1 1 1   17   17    8 o  135.393   2.2290  377.352   12.113  384.204   19.607  373.122   15.404  136.360   3.4863  134.427   2.7783 1.932632 4.457948 
1 1 1   17   17    9 o  135.674   2.4657  380.010   13.785  357.723   19.206  403.689   19.797  131.571   3.5393  139.777   3.4340 -8.206268 4.931417 
1 1 1   17   17   10 o   88.653   2.5215  164.867   8.9660  151.011   14.118  174.234   11.608   85.460   4.0053   91.847   3.0642 -6.386589 5.042937 
1 1 1   17   17   11 o  106.553   2.3451  234.534   10.026  234.737   16.175  234.407   12.777  106.568   3.6800  106.539   2.9078 0.2929688E-01 4.690176 
1 1 1   17   17   12 o  106.646   2.7672  246.993   11.130  204.275   19.319  268.213   13.616   99.332   4.7156  113.959   2.8970 -14.62782 5.534361 
1 1 1   17   17   13 o  241.483   2.8302  1212.59   25.816  1189.80   46.947  1222.47   30.909  239.704   4.7486  243.262   3.0807 -3.557816 5.660412 
1 1 1   17   17   14 o  114.127   2.4401  271.775   11.269  254.805   17.422  283.984   14.777  111.007   3.8051  117.247   3.0557 -6.239937 4.880223 
1 1 1   17   17   15 o  264.052   2.6824  1446.72   29.017  1397.01   43.203  1487.57   39.166  259.858   4.0310  268.246   3.5400 -8.387878 5.364776 
1 1 1   17   17   16 o  198.366   2.9485  828.383   23.480  747.295   36.693  884.608   30.554  189.908   4.6846  206.824   3.5818 -16.91664 5.897063 
1 1 1   17   17   17 f  136.564   3.0778  386.333   17.335  381.763   24.497  390.917   24.534  135.752   4.3752  137.376   4.3300 -1.624252 6.155585 
1 1 1   17   17   18 o   59.016   3.5745   72.519   8.6666   69.329   12.656   75.336   11.893   57.770   5.3115   60.262   4.7849 -2.492100 7.148903 
1 1 1   17   17   19 o   69.048   3.2532   97.769   9.1831  118.174   13.755   81.362   12.334   75.489   4.4180   62.608   4.7766 12.88078 6.506492 
1 1 1   17   17   20 o   61.618   3.7268   79.361   9.3196   62.196   12.971   97.674   13.399   54.646   5.7552   68.590   4.7362 -13.94372 7.453501 
1 1 1   17   17   21 f   53.224   4.2696   60.133   9.2150   51.588   13.661   67.269   12.483   49.622   6.6747   56.826   5.3259 -7.204029 8.539170 
1 1 1   17   17   22 o  118.415   2.6599  291.050   12.979  276.470   18.339  305.679   18.370  115.425   3.8523  121.404   3.6687 -5.979485 5.319768 
1 1 1   17   17   23 o  104.946   2.8149  228.485   12.144  232.818   17.992  224.859   16.458  105.831   4.1220  104.061   3.8346 1.769150 5.629891 
1 1 1   17   17   24 o  102.671   3.1593  216.590   12.970  232.391   21.436  207.464   16.291  105.464   4.9280   99.878   3.9547 5.585564 6.318579 
1 1 1   17   17   25 o  122.408   3.2950  317.984   15.721  329.271   19.503  297.041   26.566  125.832   3.7579  118.984   5.4135 6.848701 6.589986 
1 1 1   17   17   26 o   52.695   4.4903   59.691   9.5766   68.930   13.130   49.190   13.998   57.276   5.5582   48.114   7.0540 9.162579 8.980651 
1 1 1   17   17   27 o   78.282   3.2250  128.757   10.382  120.195   14.889  136.860   14.485   75.685   4.7696   80.880   4.3421 -5.195724 6.450050 
1 1 1   17   17   28 f   34.240   5.3422   25.502   8.1781   44.953   11.919   8.2015   11.241   45.947   6.2897   22.533   8.6369 23.41424 10.68443 
1 1 1   17   17   29 o   74.052   3.4550  115.055   10.536  122.059   15.423  108.927   14.427   76.152   4.9104   71.953   4.8615 4.198540 6.909916 
1 1 1   17   17   30 o   39.305   7.8048   34.693   11.053   36.853   26.475   34.237   12.163   39.509   13.512   39.101   7.8155 0.4085083 15.60966 
1 1 1   17   17   31 o   59.525   6.2602   93.604   12.048   52.614   22.101  110.937   14.372   46.567   11.561   72.484   4.8073 -25.91728 12.52034 
1 1 1   17   17   32 o   35.971   5.8346   30.225   8.6923   21.881   13.231   36.561   11.529   30.852   9.4809   41.090   6.8031 -10.23775 11.66920 
1 1 1   17   17   33 o   36.057   6.0251   34.632   9.7935   8.7036   17.115   47.254   11.942   25.304   10.342   46.809   6.1854 -21.50513 12.05028 
1 1 1   17   17   34 o   29.626   6.4835   20.167   8.6505   23.139   13.366   18.024   11.348   31.266   9.5143   27.986   8.8103 3.280268 12.96696 
1 1 1   17   17   35 o   33.937   6.1354   27.311   8.5615   27.858   13.075   26.901   11.328   34.047   9.1252   33.827   8.2037 0.2196121 12.27072 
1 1 1   17   17   36 o   19.325   5.8856   0.7882   8.6570  -3.9721   12.172   5.6603   12.315   17.460   7.8971   21.190   8.7290 -3.729349 11.77112 
1 1 1   17   17   37 o   46.833   4.9854   49.177   9.5950   54.630   14.276   44.684   12.958   49.192   7.0362   44.474   7.0645 4.718281 9.970705 
1 1 1   17   17   38 o   36.948   7.6110   26.604   11.315   15.935   12.909   61.977   23.506   26.234   9.3998   47.662   11.973 -21.42767 15.22201 
1 1 1   17   17   39 o   21.062   7.1753 -20.7894   18.269 -33.3200   30.265 -13.6061   22.915   21.210   10.375   20.915   9.9145 0.2951508 14.35053 
1 1 1   17   17   40 o   35.888   8.1689   38.008   13.469   40.100   15.392   31.170   27.826   39.251   9.5898   32.525   13.227 6.725906 16.33783 
1 1 1   17   17   41 o   31.297   8.2286   28.802   13.768   29.619   16.153   26.633   26.325   32.353   10.544   30.241   12.636 2.111408 16.45730 
1 1 1   17   17   42 o   30.008   7.5441   27.453   13.503   36.346   15.705   2.2390   26.444   35.939   10.149   24.078   11.165 11.86095 15.08817 
1 1 1   17   18    0 o  129.150   2.0624  344.736   15.518  344.736   15.518  344.736   15.518  129.150   2.9166  129.150   2.9166 0.000000 0.000000 
1 1 1   17   18    1 o  173.889   2.1170  624.073   15.178  609.303   21.134  639.807   21.813  171.767   2.9832  176.012   3.0047 -4.245316 4.234096 
1 1 1   17   18    2 o  280.480   2.5004  1625.59   28.925  1626.83   40.928  1624.36   40.885  280.586   3.5366  280.374   3.5356 0.2122498 5.000811 
1 1 1   17   18    3 o  299.149   2.5940  1849.29   32.002  1835.61   44.870  1863.44   45.656  298.027   3.6504  300.271   3.6865 -2.244171 5.188055 
1 1 1   17   18    4 o   64.164   2.5146   85.029   6.6527   82.397   9.2912   87.797   9.5299   63.145   3.5675   65.182   3.5448 -2.037083 5.029206 
1 1 1   17   18    5 o   64.746   2.6002   86.374   6.9247   83.244   9.3904   90.106   10.252   63.468   3.5873   66.025   3.7649 -2.556980 5.200300 
1 1 1   17   18    6 o  302.721   2.8420  1895.46   35.194  1889.86   53.242  1899.80   46.903  302.273   4.2706  303.170   3.7511 -0.8967590 5.684044 
1 1 1   17   18    7 o  150.201   2.2305  464.111   13.427  473.966   21.835  458.118   17.027  151.449   3.4956  148.952   2.7716 2.497879 4.461059 
1 1 1   17   18    8 o  259.434   2.6170  1395.97   27.873  1332.47   40.872  1451.17   38.110  253.867   3.9035  265.001   3.4868 -11.13425 5.233995 
1 1 1   17   18    9 o  357.788   3.1531  2650.13   46.183  2639.76   69.614  2658.27   61.721  357.086   4.7267  358.489   4.1744 -1.402222 6.306106 
1 1 1   17   18   10 o  110.879   2.3538  255.132   10.506  248.915   16.689  259.214   13.522  109.731   3.6874  112.028   2.9265 -2.297523 4.707582 
1 1 1   17   18   11 f   76.915   2.7564  127.163   8.3484  102.929   13.179  143.406   10.789   70.515   4.5313   83.315   3.1398 -12.79959 5.512837 
1 1 1   17   18   12 f   37.335   5.0675   30.977   6.8057   26.470   12.800   32.754   8.0358   34.906   8.8718   39.764   4.8997 -4.858013 10.13490 
1 1 1   17   18   13 f  236.941   2.5550  1165.20   24.795  1118.79   36.898  1203.41   33.482  232.582   3.8464  241.300   3.3642 -8.717484 5.110094 
1 1 1   17   18   14 o   82.353   2.7062  141.947   8.9108  133.238   14.254  147.533   11.416   80.221   4.3082   84.485   3.2763 -4.264427 5.412463 
1 1 1   17   18   15 o   66.936   3.7809   92.279   10.301   88.738   13.406   97.383   16.094   65.410   4.9693   68.461   5.6996 -3.050835 7.561716 
1 1 1   17   18   16 f  215.519   2.8814  977.913   24.152  912.122   41.025  1012.81   29.879  209.721   4.7428  221.318   3.2733 -11.59673 5.762715 
1 1 1   17   18   17 o   64.150   3.9794   85.245   9.8142   86.594   17.428   84.619   11.876   64.420   6.5592   63.879   4.5078 0.5417061 7.958825 
1 1 1   17   18   18 o   45.805   4.2641   44.504   7.9089   37.631   11.713   50.265   10.722   42.440   6.6914   49.169   5.2873 -6.729218 8.528243 
1 1 1   17   18   19 o   22.396   5.8541   8.3864   7.1864   5.5388   11.226   10.364   9.3545   21.539   8.5223   23.252   8.0283 -1.713049 11.70823 
1 1 1   17   18   20 o   89.795   2.9283  167.341   10.843  162.579   15.245  172.216   15.424   88.498   4.1767   91.093   4.1054 -2.595268 5.856579 
1 1 1   17   18   21 o  104.971   3.2424  227.857   13.978  214.555   18.742  244.530   20.983  101.563   4.4741  108.379   4.6942 -6.816124 6.484859 
1 1 1   17   18   22 o   39.223   5.2158   34.131   8.0855   26.752   12.105   40.076   10.865   34.746   8.5136   43.701   6.0278 -8.955467 10.43152 
1 1 1   17   18   23 o   45.549   4.7381   45.141   8.5104   36.817   12.353   52.662   11.741   41.010   7.5826   50.088   5.6835 -9.078739 9.476155 
1 1 1   17   18   24 o   37.615   5.6447   31.148   8.3862   32.408   13.058   30.264   10.941   38.131   8.5179   37.100   7.4093 1.030415 11.28947 
1 1 1   17   18   25 o   72.233   3.7522  109.282   10.996  108.441   14.297  110.501   17.205   72.002   4.8142   72.463   5.7567 -0.4614029 7.504409 
1 1 1   17   18   26 o   68.911   3.7749   98.483   10.639   87.514   13.994  113.504   16.376   64.458   5.2639   73.365   5.4120 -8.906281 7.549741 
1 1 1   17   18   27 o   63.868   3.6818   86.014   9.6624   85.771   14.277   86.220   13.125   63.723   5.4323   64.013   4.9711 -0.2899055 7.363568 
1 1 1   17   18   28 o   77.616   3.2649  126.330   10.437  129.570   15.240  123.468   14.323   78.525   4.7055   76.707   4.5273 1.818329 6.529789 
1 1 1   17   18   29 o  108.326   2.8899  245.705   12.892  241.589   18.659  249.465   17.834  107.409   4.2119  109.243   3.9580 -1.833954 5.779839 
1 1 1   17   18   30 o   99.739   4.3928  212.439   17.853  218.656   27.605  207.968   23.408  100.714   6.6455   98.763   5.7465 1.950645 8.785535 
1 1 1   17   18   31 o   42.974   5.3481   41.644   9.0428   37.105   13.887   44.986   11.915   40.203   8.6329   45.746   6.3151 -5.543190 10.69613 
1 1 1   17   18   32 o   36.974   5.8685   32.088   8.7649   25.468   12.921   37.731   11.929   32.970   9.1688   40.977   7.3275 -8.006927 11.73708 
1 1 1   17   18   33 o   35.568   5.9973   30.298   9.3684   15.721   13.882   42.490   12.696   27.126   9.7445   44.011   6.9940 -16.88527 11.99460 
1 1 1   17   18   34 o   16.485   5.2875  -5.0957   7.9065  -9.7587   11.544  -0.9762   10.851   15.368   7.2081   17.601   7.7378 -2.232851 10.57499 
1 1 1   17   18   35 o   31.031   6.3473   23.067   8.5525   23.807   12.782   22.468   11.508   31.391   9.2473   30.671   8.6971 0.7191544 12.69461 
1 1 1   17   18   36 o   66.704   4.1112   96.247   11.229   85.897   14.849  110.070   17.161   62.618   5.7496   70.790   5.8779 -8.171642 8.222386 
1 1 1   17   18   37 o   39.354   7.3169   42.665   11.914   46.992   13.699   29.232   24.136   45.445   7.3085   33.263   12.678 12.18203 14.63371 
1 1 1   17   18   38 f   23.886   6.7347   10.426   10.859   18.044   12.240 -17.7281   23.529   27.157   9.1880   20.615   9.8491 6.542170 13.46938 
1 1 1   17   18   39 o   30.644   9.0603   17.942   19.282   46.510   31.400   0.6493   24.430   37.154   14.384   24.134   11.021 13.02003 18.12066 
1 1 1   17   18   40 o   33.466   8.4118   30.243   13.038   26.216   14.932   43.165   26.750   30.984   10.140   35.948   13.424 -4.964090 16.82358 
1 1 1   17   18   41 o   29.150   8.2874   17.889   12.767   10.934   14.331   44.648   28.109   23.071   9.4499   35.229   13.617 -12.15821 16.57483 
1 1 1   17   19    0 f   85.916   2.2166  152.956   11.075  152.956   11.075  152.956   11.075   85.916   3.1348   85.916   3.1348 0.000000 0.000000 
1 1 1   17   19    1 o   57.230   2.6589   67.753   6.2698   64.370   8.8784   71.118   8.8553   55.800   3.8577   58.659   3.6601 -2.859161 5.317784 
1 1 1   17   19    2 o  195.753   2.1718  791.438   17.534  796.922   24.907  786.050   24.688  196.425   3.0744  195.081   3.0683 1.343994 4.343554 
1 1 1   17   19    3 o   83.452   2.5231  146.210   8.4941  131.332   13.069  157.091   11.176   79.696   3.9760   87.207   3.1073 -7.511124 5.046194 
1 1 1   17   19    4 o   71.383   2.5303  106.384   7.3712  120.093   10.216   91.496   10.646   76.243   3.2488   66.523   3.8802 9.719368 5.060689 
1 1 1   17   19    5 f  170.604   2.4299  601.699   17.091  584.431   24.254  618.727   24.086  168.166   3.4969  173.042   3.3748 -4.876465 4.859792 
1 1 1   17   19    6 o   71.556   2.6659  104.584   7.6816  111.602   12.448  100.267   9.7622   73.454   4.1087   69.657   3.3979 3.796989 5.331727 
1 1 1   17   19    7 o   70.993   2.6881  102.584   7.6421  110.838   12.604   97.786   9.6098   73.197   4.1751   68.789   3.3871 4.407646 5.376236 
1 1 1   17   19    8 o  126.031   2.3742  329.268   12.282  316.268   18.071  340.427   16.743  123.697   3.5421  128.365   3.1624 -4.667427 4.748407 
1 1 1   17   19    9 o   66.612   3.0529   92.909   8.2872   81.272   12.159  103.007   11.326   62.649   4.7055   70.576   3.8908 -7.927246 6.105731 
1 1 1   17   19   10 o  204.072   2.3487  862.716   19.305  850.820   30.707  870.491   24.824  202.859   3.6700  205.286   2.9319 -2.426819 4.697348 
1 1 1   17   19   11 o  176.583   2.6297  640.894   17.538  654.611   32.224  635.120   20.906  177.820   4.3937  175.346   2.8908 2.474640 5.259406 
1 1 1   17   19   12 o  260.241   2.9337  1390.37   28.393  1428.50   53.623  1375.52   33.470  262.494   4.9529  257.988   3.1455 4.505707 5.867332 
1 1 1   17   19   13 o   36.076   4.7081   28.284   6.4548   25.581   10.952   29.722   7.9901   34.303   7.9035   37.849   5.1184 -3.546490 9.416104 
1 1 1   17   19   14 o  243.645   2.5878  1223.35   25.559  1254.49   40.256  1202.32   33.083  246.163   3.9650  241.128   3.3265 5.034424 5.175630 
1 1 1   17   19   15 o  111.167   2.6090  257.001   11.902  239.046   17.316  273.082   16.387  107.444   3.9074  114.889   3.4582 -7.445465 5.217970 
1 1 1   17   19   16 o  127.103   2.7855  329.656   13.021  345.712   25.162  323.783   15.218  129.060   4.7270  125.145   2.9483 3.914726 5.571043 
1 1 1   17   19   17 o   90.578   3.2077  170.680   11.491  168.676   19.133  171.811   14.372   90.081   5.1497   91.076   3.8260 -0.9946136 6.415393 
1 1 1   17   19   18 o   64.968   3.2927   87.242   8.7825   92.240   13.195   83.266   11.768   66.615   4.8025   63.321   4.5060 3.293411 6.585421 
1 1 1   17   19   19 o   80.673   3.0855  135.496   10.245  144.732   14.426  126.100   14.551   83.476   4.1901   77.871   4.5305 5.605347 6.171092 
1 1 1   17   19   20 o   31.704   5.7973   22.521   7.7536   16.907   11.591   27.067   10.431   28.238   8.9061   35.169   7.4240 -6.930742 11.59463 
1 1 1   17   19   21 o   39.452   5.8514   35.488   9.0382   40.010   11.381   27.764   14.873   43.610   6.3274   35.295   9.8447 8.315147 11.70272 
1 1 1   17   19   22 o   67.076   3.9743   94.042   10.942   81.917   14.991  107.867   16.007   62.425   5.8226   71.726   5.4109 -9.301140 7.948623 
1 1 1   17   19   23 o   48.472   4.9427   45.295   9.3548   65.526   16.908   36.370   11.230   55.476   7.3896   41.467   6.5662 14.00842 9.885455 
1 1 1   17   19   24 o  139.010   2.6571  401.613   15.225  386.495   21.128  417.946   21.960  136.292   3.7586  141.729   3.7567 -5.437454 5.314136 
1 1 1   17   19   25 o   59.370   3.7119   74.833   8.9996   69.164   13.373   79.524   12.167   57.195   5.6691   61.546   4.7931 -4.350658 7.423785 
1 1 1   17   19   26 o   66.066   3.5368   91.861   9.6282   97.166   13.717   86.709   13.518   67.975   4.8926   64.157   5.1087 3.818016 7.073617 
1 1 1   17   19   27 f   85.475   4.2420  153.076   14.513  164.551   23.909  146.381   18.262   87.702   6.6097   83.249   5.3187 4.453140 8.483950 
1 1 1   17   19   28 o   25.906   5.8254   13.762   7.9261   1.7199   12.067   22.901   10.512   19.965   8.4601   31.847   8.0104 -11.88220 11.65079 
1 1 1   17   19   29 o   16.123   5.1524  -6.6732   7.4346   0.8215   11.228 -12.5246   9.9211   18.876   8.0845   13.369   6.3897 5.507030 10.30476 
1 1 1   17   19   30 o   33.807   7.9566   25.230   13.182   35.692   19.957   17.133   17.558   38.420   11.611   29.195   10.881 9.224133 15.91314 
1 1 1   17   19   31 o   66.923   3.7478   96.876   10.158   78.822   14.678  113.470   14.072   60.601   5.8725   73.244   4.6583 -12.64333 7.495683 
1 1 1   17   19   32 o   39.922   5.9027   38.294   9.4201   27.011   14.596   46.349   12.333   33.652   9.8725   46.193   6.4732 -12.54070 11.80548 
1 1 1   17   19   33 o   31.182   6.2392   22.012   8.7508   33.129   13.156   13.190   11.719   37.419   8.6907   24.946   8.9543 12.47305 12.47833 
1 1 1   17   19   34 o   23.246   6.2259   9.2763   8.3591   15.913   12.628   4.1001   11.152   26.617   9.3200   19.874   8.2574 6.743198 12.45179 
1 1 1   17   19   35 o   36.068   6.1399   31.381   9.0263   35.192   13.234   28.067   12.343   38.188   8.6081   33.947   8.7576 4.241375 12.27983 
1 1 1   17   19   36 o   61.079   3.9285   81.208   9.8792   86.377   14.499   76.729   13.497   62.865   5.5919   59.293   5.5192 3.571217 7.856956 
1 1 1   17   19   37 o   17.933   6.1372 -14.6969   10.082 -16.9186   11.240  -5.5485   22.809   13.247   6.4451   22.619   10.446 -9.372458 12.27435 
1 1 1   17   19   38 o   31.156   6.9071   28.070   11.119   35.287   12.682   4.0885   23.118   37.807   8.3554   24.505   11.001 13.30203 13.81412 
1 1 1   17   19   39 o   31.885   9.4098   30.108   20.894   22.632   31.536   35.957   27.895   30.126   13.219   33.644   13.395 -3.517857 18.81962 
1 1 1   17   19   40 o   26.473   7.8757   15.012   12.893   12.460   14.746   23.301   26.571   23.878   9.6583   29.068   12.443 -5.190603 15.75137 
1 1 1   17   20    0 o  158.791   2.0796  520.930   19.247  520.930   19.247  520.930   19.247  158.791   2.9410  158.791   2.9410 0.000000 0.000000 
1 1 1   17   20    1 o  201.784   2.1858  841.141   18.191  842.494   25.729  839.789   25.724  201.946   3.0890  201.621   3.0934 0.3249512 4.371625 
1 1 1   17   20    2 o  123.367   2.0824  314.323   10.595  317.558   15.086  311.174   14.883  123.993   2.9500  122.741   2.9400 1.252037 4.164838 
1 1 1   17   20    3 f  241.591   2.3399  1206.06   23.315  1210.04   33.050  1202.11   32.897  241.988   3.3114  241.194   3.3069 0.7934113 4.679840 
1 1 1   17   20    4 o   85.403   2.5235  150.411   8.7864  153.081   13.544  148.470   11.546   86.042   3.8164   84.765   3.3025 1.277237 5.046956 
1 1 1   17   20    5 o  215.670   2.5866  960.851   22.998  923.343   32.054  1000.64   33.014  211.333   3.6775  220.007   3.6383 -8.673752 5.173120 
1 1 1   17   20    6 o  245.689   2.5601  1251.19   25.749  1219.54   38.586  1276.59   34.573  242.841   3.8525  248.537   3.3727 -5.696320 5.120217 
1 1 1   17   20    7 o  209.159   2.3540  899.228   19.676  923.701   32.279  884.758   24.820  211.358   3.7028  206.960   2.9077 4.397720 4.708041 
1 1 1   17   20    8 o   72.387   3.3211  107.646   9.8384  101.811   12.991  115.494   15.065   70.120   4.4921   74.654   4.8927 -4.534920 6.642119 
1 1 1   17   20    9 o  185.759   2.4350  713.909   18.581  707.699   27.471  719.146   25.228  184.992   3.6004  186.526   3.2793 -1.534348 4.869951 
1 1 1   17   20   10 o   95.903   2.4409  188.689   9.4121  196.779   15.245  183.706   11.964   97.525   3.7902   94.282   3.0768 3.243156 4.881808 
1 1 1   17   20   11 f  184.256   2.6531  701.198   18.410  705.636   33.869  699.337   21.933  184.544   4.4497  183.968   2.8906 0.5753021 5.306181 
1 1 1   17   20   12 o   58.017   3.2346   70.045   7.3380   68.944   12.510   70.622   9.0605   57.619   5.2640   58.415   3.7606 -0.7969322 6.469296 
1 1 1   17   20   13 o   24.466   4.9817   13.269   6.1749  -0.9809   10.653   20.479   7.5778   18.114   7.8177   30.818   6.1769 -12.70427 9.963464 
1 1 1   17   20   14 o   60.760   3.2008   77.832   7.5979   72.554   12.783   80.715   9.4479   59.080   5.2461   62.440   3.6686 -3.360191 6.401583 
1 1 1   17   20   15 o  138.345   2.3376  395.507   12.958  398.007   21.008  393.971   16.463  138.645   3.6737  138.046   2.8915 0.5991669 4.675143 
1 1 1   17   20   16 o   95.716   3.2464  190.465   11.974  189.618   21.068  190.869   14.553   95.440   5.3523   95.992   3.6757 -0.5519485 6.492883 
1 1 1   17   20   17 o   92.587   3.1906  178.956   11.614  175.600   19.552  180.785   14.437   91.800   5.1639   93.374   3.7488 -1.573425 6.381130 
1 1 1   17   20   18 o   82.897   3.2660  145.430   10.957  160.233   14.668  126.741   16.481   87.838   4.0487   77.955   5.1260 9.882309 6.532070 
1 1 1   17   20   19 o   89.967   2.9521  168.114   10.948  161.241   15.210  175.503   15.771   88.058   4.1879   91.875   4.1620 -3.816467 5.904237 
1 1 1   17   20   20 o   97.056   3.3331  197.017   13.267  201.276   17.956  191.896   19.689   98.280   4.4298   95.832   4.9814 2.448631 6.666151 
1 1 1   17   20   21 o  119.133   2.6146  295.522   12.819  274.517   18.182  316.286   18.077  114.880   3.8373  123.386   3.5522 -8.506180 5.229110 
1 1 1   17   20   22 o   99.231   3.3680  204.195   13.689  193.128   18.135  218.852   20.870   96.181   4.5716  102.280   4.9472 -6.098663 6.736060 
1 1 1   17   20   23 o  155.468   4.4044  504.983   28.242   0.0000   0.0000  504.983   28.242  ?   ?   155.468   4.4044      ?      ? 
1 1 1   17   20   24 o   66.681   4.6084   94.458   11.221   95.577   21.636   94.046   13.123   66.436   7.8959   66.927   4.7542 -0.4903259 9.216750 
1 1 1   17   20   25 o  120.474   2.7166  301.855   13.468  276.029   18.470  331.177   19.681  114.971   3.8951  125.976   3.7878 -11.00510 5.433151 
1 1 1   17   20   26 o   28.722   5.9766   18.561   7.5982   15.940   11.344   20.694   10.233   27.138   8.8359   30.306   8.0502 -3.167624 11.95317 
1 1 1   17   20   27 o  101.285   3.1820  212.175   13.103  197.824   16.930  233.610   20.691   97.182   4.2239  105.387   4.7601 -8.205048 6.363985 
1 1 1   17   20   28 o   84.552   3.1245  150.560   10.882  145.618   15.616  155.226   15.173   83.150   4.5533   85.954   4.2799 -2.803673 6.249018 
1 1 1   17   20   29 o   64.949   3.7042   89.530   9.9156   89.087   14.273   89.943   13.785   64.756   5.3440   65.141   5.1309 -0.3847580 7.408440 
1 1 1   17   20   30 o   65.523   3.7866   91.893   10.143   88.462   15.209   94.642   13.613   64.258   5.7388   66.789   4.9417 -2.530739 7.573204 
1 1 1   17   20   31 o   36.448   7.1205   32.310   10.124   28.635   21.165   33.400   11.529   34.566   12.068   38.331   7.5609 -3.764961 14.24099 
1 1 1   17   20   32 o   64.359   5.1940   95.675   12.596  102.655   15.432   81.746   21.801   69.089   5.4158   59.629   8.8645 9.459637 10.38800 
1 1 1   17   20   33 o   66.426   3.7654   95.674   10.234   87.992   15.022  102.326   13.979   63.705   5.7174   69.148   4.9016 -5.442558 7.530884 
1 1 1   17   20   34 o   25.347   5.3394   10.675   8.3070 -12.6366   12.383   29.748   11.201   15.201   7.2299   35.493   7.8589 -20.29201 10.67871 
1 1 1   17   20   35 o   51.436   4.5797   58.295   9.6582   67.561   14.474   50.858   12.967   55.147   6.3634   47.724   6.5880 7.423225 9.159377 
1 1 1   17   20   36 o   22.770   5.7482   8.0461   8.2456  -7.3253   12.183   21.038   11.201   16.266   7.5548   29.274   8.6655 -13.00763 11.49638 
1 1 1   17   20   37 o   25.425   7.4202   13.167   12.342   19.679   12.787 -75.5983   47.209   27.947   9.3914   22.903   11.491 5.044014 14.84049 
1 1 1   17   20   38 f   21.955   6.6380   5.8129   10.919   11.998   12.653 -12.2277   21.610   23.566   9.1285   20.345   9.6397 3.220762 13.27600 
1 1 1   17   20   39 o   43.074   7.6545   58.224   14.074   65.633   16.555   38.908   26.731   52.187   7.6914   33.962   13.237 18.22466 15.30901 
1 1 1   17   20   40 f   22.570   7.1797   4.9393   12.496   4.6688   14.379   5.7745   25.262   20.666   9.0004   24.474   11.189 -3.808159 14.35932 
1 1 1   17   21    0 o  142.580   2.0717  420.128   17.213  420.128   17.213  420.128   17.213  142.580   2.9299  142.580   2.9299 0.000000 0.000000 
1 1 1   17   21    1 o   90.155   2.1945  167.942   8.1595  165.407   11.509  170.504   11.570   89.470   3.1188   90.840   3.0880 -1.369743 4.388947 
1 1 1   17   21    2 o  152.817   2.0947  482.441   13.202  486.208   18.745  478.732   18.598  153.409   2.9625  152.225   2.9622 1.184021 4.189376 
1 1 1   17   21    3 o   26.802   5.2518   14.824   5.9380   19.015   9.4713   12.110   7.6220   29.634   7.6846   23.969   7.1605 5.664904 10.50360 
1 1 1   17   21    4 o  149.934   2.3172  462.196   14.169  480.640   21.911  448.940   18.576  152.468   3.4843  147.399   3.0555 5.069656 4.634317 
1 1 1   17   21    5 o   56.601   3.1321   67.778   7.0213   60.843   11.337   72.093   8.9430   54.164   5.0747   59.039   3.6727 -4.874245 6.264252 
1 1 1   17   21    6 o   21.929   5.3665   8.8517   5.6569   9.8726   9.8287   8.3460   6.9176   23.228   8.2148   20.629   6.9076 2.598492 10.73302 
1 1 1   17   21    7 o   54.249   3.2621   61.538   6.9777   59.087   11.608   62.925   8.7310   53.354   5.2752   55.144   3.8389 -1.789532 6.524121 
1 1 1   17   21    8 o   92.366   2.6339  177.683   9.9548  165.166   14.709  188.262   13.523   89.322   3.9925   95.410   3.4364 -6.088211 5.267711 
1 1 1   17   21    9 o  312.491   2.8971  2024.41   36.997  2006.66   56.120  2038.05   49.204  311.186   4.3725  313.796   3.8018 -2.609406 5.794182 
1 1 1   17   21   10 o  149.054   2.6073  464.744   14.667  447.524   26.579  472.284   17.587  146.935   4.3858  151.172   2.8208 -4.237000 5.214548 
1 1 1   17   21   11 o  117.967   2.6607  286.507   11.717  291.964   21.945  284.331   13.858  118.650   4.4845  117.285   2.8648 1.364944 5.321420 
1 1 1   17   21   12 o  112.273   2.3570  258.368   10.566  270.323   17.443  251.440   13.279  114.263   3.7013  110.283   2.9193 3.979752 4.714036 
1 1 1   17   21   13 o   56.263   3.2245   60.459   7.1779   88.754   12.370   46.095   8.8135   65.396   4.5862   47.131   4.5339 18.26421 6.448964 
1 1 1   17   21   14 o   85.482   2.7796  148.718   9.6975  171.163   15.106  132.982   12.648   90.858   4.0310   80.107   3.8281 10.75118 5.559101 
1 1 1   17   21   15 o   73.961   3.0620  115.909   9.1398   98.991   13.764  129.251   12.224   68.970   4.8387   78.952   3.7538 -9.981415 6.124034 
1 1 1   17   21   16 o  118.136   3.9135  301.503   15.440  274.409   33.040  309.074   17.464  114.162   7.0170  122.111   3.4677 -7.948418 7.827030 
1 1 1   17   21   17 o   64.972   4.2946  100.098   10.004   59.731   16.718  122.615   12.486   53.109   7.6322   76.834   3.9401 -23.72475 8.589231 
1 1 1   17   21   18 o   80.995   3.7557  138.987   11.844  142.809   14.645  131.758   20.139   82.827   4.2868   79.163   6.1680 3.664070 7.511389 
1 1 1   17   21   19 o   54.943   3.7860   63.972   8.4698   57.474   12.603   69.325   11.438   52.285   5.8441   57.600   4.8146 -5.314854 7.571918 
1 1 1   17   21   20 o   86.177   3.4514  155.688   12.096  157.611   15.898  153.043   18.640   86.915   4.4348   85.438   5.2897 1.477539 6.902815 
1 1 1   17   21   21 o   83.079   3.5117  143.428   11.202  147.353   19.979  141.628   13.529   83.681   5.7886   82.476   3.9773 1.205437 7.023340 
1 1 1   17   21   22 o   34.586   5.8862   24.480   8.2362   38.908   13.811   16.518   10.260   41.734   8.3158   27.438   8.3330 14.29564 11.77248 
1 1 1   17   21   23 o   56.185   4.0098   67.786   9.0816   61.269   14.001   72.519   11.933   53.643   6.3279   58.726   4.9265 -5.082260 8.019552 
1 1 1   17   21   24 o   53.140   4.1130   60.602   8.8932   53.806   13.189   66.267   12.043   50.229   6.3662   56.050   5.2095 -5.820309 8.226019 
1 1 1   17   21   25 o   35.278   5.4920   28.182   7.7280   25.781   11.725   30.027   10.276   33.711   8.4492   36.845   7.0185 -3.133255 10.98399 
1 1 1   17   21   26 o   33.511   5.6935   25.940   7.8779   19.272   11.640   31.576   10.701   29.300   8.8706   37.721   7.1397 -8.420473 11.38696 
1 1 1   17   21   27 o   30.437   6.3981   21.095   8.6044   19.771   11.706   22.650   12.690   29.493   8.8883   31.380   9.2056 -1.886242 12.79626 
1 1 1   17   21   28 o   76.887   4.2910  122.715   12.728  115.800   15.304  138.227   22.923   73.947   5.0180   79.828   6.9621 -5.881584 8.582033 
1 1 1   17   21   29 o   65.300   4.4805   92.936   11.547   95.205   14.510   89.018   19.070   66.857   5.2619   63.743   7.2534 3.114391 8.961015 
1 1 1   17   21   30 o   30.246   5.8222   21.534   8.1737   9.3248   12.169   31.571   11.033   23.204   8.9620   37.289   7.4347 -14.08574 11.64441 
1 1 1   17   21   31 o   34.726   8.1047   26.243   10.419   34.734   29.002   24.985   11.165   36.844   13.932   32.609   8.2847 4.235600 16.20932 
1 1 1   17   21   32 o   60.033   4.1257   79.316   10.029   63.968   14.379   93.854   13.994   53.956   6.4611   66.110   5.1323 -12.15393 8.251487 
1 1 1   17   21   33 o   28.159   6.2894   18.238   8.2073   24.361   12.617   13.747   10.806   31.553   9.1568   24.765   8.6243 6.788300 12.57883 
1 1 1   17   21   34 o   53.635   4.6463   65.577   9.9487   56.673   15.385   71.976   13.042   49.828   7.4863   57.441   5.5051 -7.613625 9.292534 
1 1 1   17   21   35 o   38.957   5.8458   36.784   9.0462   34.809   13.646   38.333   12.082   37.527   8.9436   40.388   7.5303 -2.860912 11.69159 
1 1 1   17   21   36 o   43.630   6.9556   52.686   11.714   58.304   13.946   39.224   21.589   50.611   6.6809   36.649   12.202 13.96111 13.91124 
1 1 1   17   21   37 o   31.679   9.6993   10.967   11.969   6.2674   12.358   82.073   48.068   20.838   8.6780   42.521   17.349 -21.68311 19.39857 
1 1 1   17   21   38 o   22.267   6.8159   5.1443   12.258   13.882   14.896 -13.1855   21.574   24.658   9.7978   19.875   9.4778 4.783236 13.63178 
1 1 1   17   21   39 o   31.249   8.2858   24.091   12.642   16.940   14.435   47.629   26.189   25.739   9.8060   36.759   13.359 -11.02088 16.57167 
1 1 1   17   22    0 o  152.315   2.4700  479.896   21.918  479.896   21.918  479.896   21.918  152.315   3.4930  152.315   3.4930 0.000000 0.000000 
1 1 1   17   22    1 o  101.331   2.4037  214.734   9.8876  196.745   15.009  228.527   13.143   97.510   3.7319  105.151   3.0304 -7.641747 4.807340 
1 1 1   17   22    2 o   24.185   5.2712   10.859   5.7249   17.638   9.5995   7.1175   7.1319   28.588   7.8854   19.782   6.9975 8.806141 10.54248 
1 1 1   17   22    3 o  105.249   2.4506  223.566   10.508  271.959   16.414  189.958   13.679  114.666   3.4707   95.833   3.4607 18.83289 4.901225 
1 1 1   17   22    4 o   74.274   2.7020  114.100   8.1625  114.702   12.655  113.670   10.681   74.419   4.1229   74.128   3.4937 0.2904282 5.404078 
1 1 1   17   22    5 o  145.207   2.3063  437.927   13.643  423.174   20.803  449.062   18.073  143.017   3.5268  147.396   2.9728 -4.378616 4.612566 
1 1 1   17   22    6 o   69.641   2.7937  102.512   7.7047   92.451   12.461  108.738   9.8030   66.772   4.5249   72.510   3.2779 -5.737885 5.587423 
1 1 1   17   22    7 o   94.941   2.4975  189.589   9.5744  168.817   14.640  205.112   12.656   90.283   3.9317   99.599   3.0809 -9.315666 4.995004 
1 1 1   17   22    8 f   52.077   3.5538   56.562   7.5761   54.265   11.295   58.440   10.215   51.086   5.3608   53.067   4.6669 -1.981239 7.107573 
1 1 1   17   22    9 o   65.533   2.8486   85.038   7.4576  105.072   12.604   74.246   9.2507   71.188   4.2927   59.879   3.7457 11.30860 5.697168 
1 1 1   17   22   10 o   40.466   5.4092   41.646   7.8093   20.840   14.057   50.932   9.3919   31.392   9.7934   49.540   4.5966 -18.14787 10.81848 
1 1 1   17   22   11 o  126.980   2.3616  336.818   12.009  320.130   19.199  347.544   15.392  124.314   3.7446  129.646   2.8786 -5.332474 4.723142 
1 1 1   17   22   12 o  126.177   2.6647  326.703   12.675  338.174   23.432  321.957   15.071  127.599   4.4525  124.755   2.9290 2.844254 5.329473 
1 1 1   17   22   13 o  186.921   2.4084  724.193   18.284  722.292   28.426  725.535   23.880  186.635   3.6928  187.207   3.0927 -0.5719147 4.816829 
1 1 1   17   22   14 o  118.560   2.3896  291.330   11.313  291.201   18.470  291.407   14.312  118.466   3.7801  118.654   2.9245 -0.1881027 4.779289 
1 1 1   17   22   15 o   77.225   2.6959  122.119   8.2181  129.617   13.977  118.158   10.160   78.942   4.2928   75.508   3.2623 3.434601 5.391776 
1 1 1   17   22   16 o   35.547   5.3707   29.523   7.6657   17.974   12.135   37.191   9.8884   28.973   9.1092   42.120   5.6920 -13.14787 10.74136 
1 1 1   17   22   17 o  102.700   3.0638  221.696   12.433  212.992   20.579  226.699   15.602  100.937   4.9431  104.463   3.6213 -3.525726 6.127649 
1 1 1   17   22   18 f  130.513   3.0805  356.782   16.498  319.777   23.540  392.506   23.128  123.745   4.6122  137.281   4.0848 -13.53684 6.161011 
1 1 1   17   22   19 o   28.365   5.8362   17.131   7.1957   21.368   11.188   14.142   9.3970   31.022   8.4949   25.708   8.0050 5.313757 11.67235 
1 1 1   17   22   20 o  142.515   3.1450  424.506   18.457  393.833   25.892  456.193   26.316  137.226   4.5747  147.804   4.3169 -10.57825 6.290009 
1 1 1   17   22   21 o   55.726   3.7428   66.031   8.5049   60.803   12.698   70.285   11.454   53.600   5.7439   57.852   4.8002 -4.251614 7.485568 
1 1 1   17   22   22 o  136.965   2.7535  391.029   15.280  395.216   24.015  388.181   19.806  137.425   4.2369  136.505   3.5178 0.9197998 5.506948 
1 1 1   17   22   23 o   86.818   3.1325  159.116   11.107  148.894   16.583  167.432   14.957   84.155   4.7776   89.480   4.0528 -5.325256 6.265037 
1 1 1   17   22   24 o   86.016   3.2539  157.533   11.273  143.678   17.491  167.379   14.744   82.547   5.1373   89.485   3.9947 -6.938400 6.507702 
1 1 1   17   22   25 o   65.289   3.5015   91.420   9.2625   78.812   13.787  101.793   12.505   60.949   5.4845   69.628   4.3544 -8.679752 7.002933 
1 1 1   17   22   26 o   62.492   4.4491   85.496   11.022   90.955   14.095   76.904   17.685   65.495   5.2177   59.488   7.2078 6.007061 8.898159 
1 1 1   17   22   27 o   31.986   5.8957   23.617   7.8430   22.164   11.793   24.769   10.502   31.014   8.8076   32.959   7.8399 -1.945551 11.79142 
1 1 1   17   22   28 o   15.029   4.9696  -9.5795   7.7298  -5.9994   10.466 -13.8762   11.466   15.661   7.1752   14.397   6.8777 1.264101 9.939157 
1 1 1   17   22   29 o   74.341   3.9523  114.806   11.787  103.366   14.762  134.933   19.580   69.617   5.1411   79.065   6.0043 -9.448204 7.904621 
1 1 1   17   22   30 o   38.270   5.5223   34.750   8.5062   23.513   12.508   44.417   11.602   31.404   9.1185   45.137   6.2320 -13.73375 11.04466 
1 1 1   17   22   31 o   64.434   7.6805  114.115   17.164   71.229   29.942  135.106   20.948   50.476   13.928   78.393   6.4788 -27.91769 15.36108 
1 1 1   17   22   32 o   58.578   4.0642   74.146   9.7443   88.134   14.550   62.770   13.121   63.650   5.5425   53.506   5.9458 10.14359 8.128435 
1 1 1   17   22   33 o   25.203   6.2569   14.281   7.9876   16.144   12.227   12.895   10.550   26.335   9.1737   24.071   8.5111 2.264393 12.51382 
1 1 1   17   22   34 o   31.952   6.1701   24.611   8.4186   31.383   12.704   19.309   11.241   35.754   8.6979   28.151   8.7537 7.602839 12.34017 
1 1 1   17   22   35 o   41.695   5.6474   42.244   9.3629   36.916   14.093   46.453   12.527   38.228   9.0743   45.162   6.7254 -6.933517 11.29484 
1 1 1   17   22   36 o   29.820   7.4673   23.475   11.041   24.300   12.942   21.268   21.163   30.625   9.3712   29.014   11.628 1.611715 14.93457 
1 1 1   17   22   37 o   36.543   7.2713   40.161   11.726   45.015   13.715   26.971   22.608   42.628   8.0964   30.457   12.080 12.17121 14.54263 
1 1 1   17   22   38 o   26.134   9.8352   17.723   14.412   17.723   14.412   0.0000   0.0000   26.134   9.8352  ?   ?       ?      ? 
1 1 1   17   23    0 o   24.671   5.9051   16.321   7.6065   16.321   7.6065   16.321   7.6065   24.671   8.3510   24.671   8.3510 0.000000 0.000000 
1 1 1   17   23    1 o   85.706   2.4680  151.080   8.5109  156.224   13.732  147.872   10.845   86.852   3.8334   84.560   3.1096 2.292099 4.936038 
1 1 1   17   23    2 o  118.481   2.3663  291.242   11.470  283.708   17.235  297.233   15.367  117.075   3.5692  119.886   3.1079 -2.811577 4.732692 
1 1 1   17   23    3 o   47.123   3.5010   45.323   6.6630   49.960   10.763   42.441   8.4841   49.017   5.3238   45.229   4.5481 3.788471 7.002010 
1 1 1   17   23    4 o  107.002   2.3366  239.572   10.053  223.914   15.819  250.180   13.021  103.993   3.6882  110.010   2.8697 -6.017067 4.673104 
1 1 1   17   23    5 o   47.103   3.6410   48.151   6.6704   39.101   10.830   53.682   8.4670   43.308   6.0630   50.898   4.0333 -7.590187 7.282053 
1 1 1   17   23    6 o  111.273   2.5169  257.199   11.511  240.054   16.589  273.120   15.986  107.663   3.7358  114.883   3.3737 -7.220840 5.033735 
1 1 1   17   23    7 o  145.662   2.9261  441.284   17.525  413.040   25.219  467.659   24.370  141.103   4.3333  150.221   3.9333 -9.118454 5.852250 
1 1 1   17   23    8 o  140.902   2.9633  410.965   17.141  421.017   25.635  402.837   23.052  142.422   4.3640  139.383   4.0099 3.039017 5.926546 
1 1 1   17   23    9 o  115.519   2.8358  279.760   12.916  266.630   21.445  287.233   16.179  113.263   4.5907  117.775   3.3306 -4.512299 5.671664 
1 1 1   17   23   10 o  144.877   2.6310  439.461   14.389  424.747   26.082  445.898   17.252  142.950   4.4238  146.804   2.8492 -3.854263 5.261970 
1 1 1   17   23   11 o  158.111   2.3522  517.339   15.100  521.552   23.566  514.405   19.667  158.592   3.6028  157.630   3.0251 0.9622955 4.704366 
1 1 1   17   23   12 o   78.329   2.8368  132.150   8.6693  111.262   14.163  144.665   10.963   73.091   4.6980   83.566   3.1808 -10.47495 5.673555 
1 1 1   17   23   13 o  189.914   2.7237  739.777   19.213  770.724   36.464  727.883   22.605  192.342   4.5964  187.485   2.9233 4.856705 5.447304 
1 1 1   17   23   14 o   71.351   3.0671  105.109   8.9784  114.935   13.578   97.475   11.969   74.273   4.4324   68.429   4.2407 5.844345 6.134281 
1 1 1   17   23   15 o   48.496   4.1803   56.315   6.9105   36.346   12.200   65.750   8.3855   40.735   7.5391   56.256   3.6140 -15.52101 8.360612 
1 1 1   17   23   16 o  157.218   2.4110  513.278   15.626  512.438   22.445  514.068   21.768  157.075   3.4645  157.360   3.3540 -0.2846985 4.822047 
1 1 1   17   23   17 o   44.763   5.5131   47.372   8.8780   34.148   15.583   53.727   10.803   38.883   9.7379   50.643   5.1719 -11.75990 11.02612 
1 1 1   17   23   18 o   31.580   5.8178   24.997   8.1803   5.9825   16.046   31.675   9.5088   24.412   9.9994   38.748   5.9499 -14.33540 11.63569 
1 1 1   17   23   19 o   47.572   4.9143   50.890   8.9620   58.675   11.766   40.130   13.832   52.748   5.4080   42.396   8.2070 10.35217 9.828583 
1 1 1   17   23   20 o   44.785   4.2990   42.815   7.8348   41.193   11.961   44.034   10.369   43.921   6.6027   45.649   5.5074 -1.727924 8.598045 
1 1 1   17   23   21 o   87.380   3.1611  160.719   11.015  157.639   17.936  162.585   13.956   86.514   5.0266   88.247   3.8345 -1.732277 6.322196 
1 1 1   17   23   22 o   51.712   3.9192   56.938   8.2790   53.646   12.370   59.609   11.142   50.244   5.9694   53.180   5.0800 -2.936241 7.838380 
1 1 1   17   23   23 o   66.167   3.5547   93.775   9.5202   75.668   13.748  110.458   13.196   59.764   5.5774   72.571   4.4088 -12.80622 7.109498 
1 1 1   17   23   24 o   99.639   3.0656  205.040   12.263  224.062   20.116  193.790   15.470  103.076   4.7317   96.202   3.8990 6.873245 6.131198 
1 1 1   17   23   25 o   32.418   5.7558   24.010   7.5686   23.657   12.089   24.237   9.7060   32.050   8.8527   32.786   7.3585 -0.7360039 11.51164 
1 1 1   17   23   26 o  100.402   3.3682  215.620   13.489  223.508   17.231  203.134   21.680  103.150   4.0502   97.654   5.3827 5.496078 6.736303 
1 1 1   17   23   27 o   45.449   4.6280   44.775   8.6557   45.037   12.680   44.547   11.845   45.500   6.7567   45.397   6.3261 0.1024628 9.255959 
1 1 1   17   23   28 o   72.415   5.8777  113.348   13.117  110.914   14.372  125.496   32.103   72.218   4.8250   72.612   10.720 -0.3940353 11.75540 
1 1 1   17   23   29 o   69.208   3.5232  103.370   9.9431   88.087   14.284  117.739   13.850   63.976   5.4132   74.441   4.5110 -10.46520 7.046411 
1 1 1   17   23   30 o   38.780   5.8120   35.537   8.8737   33.959   13.931   36.614   11.511   37.534   9.0945   40.026   7.2392 -2.491592 11.62400 
1 1 1   17   23   31 o   49.506   6.5679   72.294   11.385   32.910   21.234   88.187   13.488   35.123   12.097   63.889   5.1188 -28.76626 13.13580 
1 1 1   17   23   32 o   56.914   4.1165   70.960   9.5772   72.310   14.581   69.936   12.701   57.167   6.1840   56.661   5.4350 0.5061226 8.232972 
1 1 1   17   23   33 o   24.127   6.2146   12.546   7.8722   14.892   12.585   11.038   10.090   25.550   9.2645   22.705   8.2858 2.844572 12.42925 
1 1 1   17   23   34 f   30.105   6.2867   22.678   8.2979   24.552   12.547   21.221   11.063   31.041   9.1668   29.169   8.6059 1.871367 12.57342 
1 1 1   17   23   35 o   38.858   5.9772   38.126   9.4476   30.249   14.262   44.286   12.612   33.903   9.7057   43.814   6.9791 -9.910969 11.95443 
1 1 1   17   23   36 o   27.076   7.2410   18.822   10.682   20.104   12.477   15.302   20.673   27.772   9.2769   26.381   11.120 1.391397 14.48190 
1 1 1   17   23   37 o   23.275   7.0458   9.3052   11.519   8.4144   14.093   11.099   19.995   21.972   9.2175   24.578   10.659 -2.605829 14.09158 
1 1 1   17   24    0 o   13.241   5.7693   2.8572   8.6971   2.8572   8.6971   2.8572   8.6971   13.241   8.1590   13.241   8.1590 0.000000 0.000000 
1 1 1   17   24    1 o   79.281   2.8178  130.789   9.1828  122.522   13.247  138.436   12.740   76.838   4.1800   81.723   3.7799 -4.884262 5.635614 
1 1 1   17   24    2 o  121.256   2.7434  304.759   13.138  305.268   22.020  304.478   16.371  121.239   4.4036  121.272   3.2730 -0.3379059E-01 5.486711 
1 1 1   17   24    3 o  126.112   2.7912  335.708   13.889  308.827   22.786  351.600   17.520  121.908   4.5318  130.316   3.2597 -8.408089 5.582391 
1 1 1   17   24    4 o  161.514   2.3229  538.520   15.222  549.477   23.879  531.019   19.757  162.836   3.5555  160.191   2.9903 2.644455 4.645800 
1 1 1   17   24    5 o  182.635   2.3639  692.342   17.605  681.402   26.891  700.548   23.289  181.306   3.5961  183.964   3.0694 -2.658340 4.727894 
1 1 1   17   24    6 o  135.633   2.5136  381.182   14.054  364.373   19.662  398.739   20.095  132.569   3.5960  138.697   3.5129 -6.127777 5.027112 
1 1 1   17   24    7 o  123.443   2.8791  314.863   14.326  309.057   18.329  323.981   22.967  122.075   3.6404  124.812   4.4615 -2.736694 5.758217 
1 1 1   17   24    8 o   61.602   3.9184   79.652   9.9109   74.174   14.369   84.624   13.688   59.525   5.8527   63.679   5.2118 -4.153236 7.836854 
1 1 1   17   24    9 o   34.767   6.4510   27.016   9.3485   24.490   14.251   28.924   12.386   33.367   9.7457   36.167   8.4547 -2.800117 12.90193 
1 1 1   17   24   10 o   66.155   3.0950   90.549   8.3711   95.102   12.835   87.180   11.043   67.560   4.6063   64.749   4.1351 2.810730 6.190054 
1 1 1   17   24   11 o  103.191   2.6002  222.116   11.017  205.044   15.912  237.832   15.268   99.324   3.8843  107.058   3.4578 -7.733582 5.200410 
1 1 1   17   24   12 o   47.803   3.6076   47.686   6.7193   48.179   11.604   47.437   8.2415   47.877   5.8765   47.729   4.1866 0.1477585 7.215290 
1 1 1   17   24   13 o   57.699   3.4194   74.756   7.3395   56.284   12.612   84.215   9.0252   51.715   5.9130   63.684   3.4361 -11.96913 6.838862 
1 1 1   17   24   14 o  128.122   2.3768  346.716   12.180  314.161   19.247  368.460   15.730  122.901   3.7969  133.344   2.8601 -10.44329 4.753631 
1 1 1   17   24   15 o  138.777   2.4037  406.267   13.518  355.316   20.273  447.054   18.139  130.711   3.7604  146.842   2.9949 -16.13118 4.807348 
1 1 1   17   24   16 o   24.199   5.7614   11.880   6.6980   12.415   10.671   11.533   8.6038   24.867   8.5755   23.530   7.6967 1.336937 11.52289 
1 1 1   17   24   17 o   38.801   5.7984   39.637   8.7478   16.627   15.635   50.124   10.555   28.817   10.343   48.785   5.2455 -19.96752 11.59677 
1 1 1   17   24   18 o   58.939   4.2878   77.089   9.3671   65.632   16.808   82.250   11.281   55.207   7.3820   62.671   4.3644 -7.464825 8.575618 
1 1 1   17   24   19 o   30.712   6.3930   20.252   8.6992   14.699   11.367   28.101   13.515   26.376   8.8547   35.049   9.2237 -8.673647 12.78600 
1 1 1   17   24   20 o   74.418   3.1330  116.529   9.5745  110.628   13.977  121.746   13.142   72.568   4.6699   76.267   4.1779 -3.698845 6.266053 
1 1 1   17   24   21 o   66.659   3.5246   92.227   9.4370   99.477   15.420   87.886   11.932   68.587   5.4512   64.731   4.4694 3.855873 7.049195 
1 1 1   17   24   22 o   67.425   3.2788   95.726   9.0885   95.118   13.374   96.247   12.389   67.169   4.8277   67.681   4.4380 -0.5120316 6.557627 
1 1 1   17   24   23 o   28.510   5.8556   18.715   7.4221   14.034   11.439   22.119   9.7541   25.787   8.8794   31.232   7.6360 -5.444996 11.71117 
1 1 1   17   24   24 o   31.693   5.8645   21.406   7.7585   32.120   12.615   14.887   9.8395   37.440   8.3785   25.947   8.2079 11.49318 11.72897 
1 1 1   17   24   25 o   55.171   4.1360   65.553   9.1629   64.066   14.618   66.516   11.760   54.397   6.5157   55.946   5.0964 -1.548389 8.272088 
1 1 1   17   24   26 o   76.272   3.2132  124.212   9.9988  107.094   14.444  139.963   13.855   71.009   4.9319   81.536   4.1200 -10.52755 6.426347 
1 1 1   17   24   27 o   53.119   4.2334   61.787   9.1413   51.566   13.152   71.340   12.715   48.562   6.5664   57.675   5.3450 -9.113209 8.466807 
1 1 1   17   24   28 o   45.475   5.6660   45.846   10.054   41.624   12.534   53.464   16.838   43.343   7.0112   47.606   8.9027 -4.262238 11.33204 
1 1 1   17   24   29 o   47.493   5.0508   51.594   9.4359   60.904   13.098   41.548   13.605   52.820   6.0123   42.166   8.1176 10.65422 10.10161 
1 1 1   17   24   30 o   68.999   3.9035  105.213   10.746   97.007   17.089  110.580   13.821   66.213   6.2577   71.784   4.6681 -5.570969 7.807070 
1 1 1   17   24   31 o   82.105   3.3917  146.134   11.394  129.947   16.457  161.036   15.790   77.441   5.1524   86.769   4.4121 -9.327599 6.783329 
1 1 1   17   24   32 o   21.537   6.5075   5.3502   9.0413   2.0630   19.332   6.2705   10.229   23.009   10.211   20.065   8.0694 2.943386 13.01491 
1 1 1   17   24   33 o   61.887   3.8529   84.212   9.8066   87.413   14.517   81.525   13.300   62.853   5.6000   60.921   5.2932 1.932652 7.705712 
1 1 1   17   24   34 o   28.248   6.3899   19.382   8.7037   27.999   12.974   12.331   11.737   32.941   9.1973   23.555   8.8733 9.386196 12.77989 
1 1 1   17   24   35 o   54.517   6.1693   71.762   12.713   66.546   15.418   82.842   22.471   53.319   7.0108   55.714   10.153 -2.394104 12.33862 
1 1 1   17   24   36 o   34.003   6.3625   18.157   10.948  -3.7943   13.098   69.064   19.946   17.379   7.9861   50.627   9.9071 -33.24762 12.72504 
1 1 1   17   25    0 o   56.494   3.3244   67.494   10.780   67.494   10.780   67.494   10.780   56.494   4.7014   56.494   4.7014 0.000000 0.000000 
1 1 1   17   25    1 o  120.075   2.6724  295.756   12.979  282.312   16.626  316.731   20.767  116.687   3.4547  123.464   4.0782 -6.777550 5.344746 
1 1 1   17   25    2 o   22.736   5.3562   10.423   5.7790   9.6559   9.4998   10.873   7.2812   22.751   8.0729   22.722   7.0417 0.2826309E-01 10.71249 
1 1 1   17   25    3 o  102.748   2.7767  218.888   11.541  221.270   18.233  217.296   14.907  103.144   4.2859  102.353   3.5313 0.7908936 5.553327 
1 1 1   17   25    4 o  159.023   3.0349  525.904   19.898  519.904   27.725  532.277   28.575  158.101   4.2518  159.945   4.3317 -1.844254 6.069715 
1 1 1   17   25    5 o  119.510   2.7555  298.596   13.414  310.102   17.839  283.623   20.350  122.254   3.5379  116.767   4.2255 5.487152 5.511018 
1 1 1   17   25    6 o  126.248   2.4410  331.100   12.672  324.629   18.553  336.760   17.350  125.058   3.5970  127.439   3.3009 -2.380470 4.882012 
1 1 1   17   25    7 o   65.305   3.4709   88.419   9.3059   82.630   12.453   95.739   14.004   62.920   4.7986   67.690   5.0162 -4.769814 6.941815 
1 1 1   17   25    8 o   57.686   3.3880   69.993   7.9168   66.607   12.246   72.424   10.376   56.404   5.2642   58.967   4.2665 -2.563347 6.776062 
1 1 1   17   25    9 o   86.855   3.1954  164.194   10.715  135.872   17.768  180.378   13.432   80.512   5.3508   93.198   3.4943 -12.68671 6.390704 
1 1 1   17   25   10 o  101.092   2.6054  213.835   10.790  191.736   15.584  234.186   14.954   95.985   3.9365  106.199   3.4141 -10.21418 5.210759 
1 1 1   17   25   11 o  158.249   2.5247  519.954   16.467  493.430   22.971  547.992   23.617  154.086   3.6146  162.412   3.5257 -8.326324 5.049316 
1 1 1   17   25   12 o   63.906   3.1802   84.588   8.3270   90.643   12.674   79.989   11.046   65.874   4.6647   61.937   4.3239 3.936756 6.360495 
1 1 1   17   25   13 f   95.015   2.6276  185.787   10.200  201.994   15.770  174.132   13.373   98.502   3.8818   91.529   3.5426 6.973396 5.255288 
1 1 1   17   25   14 o   67.367   2.8565   92.623   7.5359  101.262   13.117   88.366   9.2070   69.550   4.5728   65.184   3.4246 4.366066 5.712986 
1 1 1   17   25   15 o   16.653   5.1001  -1.5482   6.3522   2.9088   10.234  -4.3410   8.1015   19.193   7.9370   14.114   6.4071 5.079215 10.20029 
1 1 1   17   25   16 o   65.371   3.3228   90.568   8.8673   78.590   12.826  101.534   12.273   61.091   5.0906   69.651   4.2721 -8.560772 6.645651 
1 1 1   17   25   17 o   66.874   3.8414   94.610   9.6905   94.232   17.676   94.772   11.587   66.447   6.4498   67.301   4.1743 -0.8533020 7.682744 
1 1 1   17   25   18 o   58.982   4.1794   74.782   9.3303   71.510   16.725   76.261   11.242   57.679   7.0303   60.286   4.5214 -2.606792 8.358746 
1 1 1   17   25   19 o  170.497   3.0336  608.541   21.323  583.184   29.807  635.114   30.514  166.835   4.3318  174.158   4.2481 -7.322067 6.067207 
1 1 1   17   25   20 o   99.820   3.0288  209.736   12.092  205.784   19.548  212.186   15.390   98.844   4.7949  100.796   3.7018 -1.952538 6.057636 
1 1 1   17   25   21 o   81.498   3.0530  140.416   10.174  132.177   15.136  147.209   13.743   79.187   4.6342   83.809   3.9757 -4.621620 6.105960 
1 1 1   17   25   22 o  174.233   2.7127  635.167   19.484  607.855   27.178  664.047   27.947  170.360   3.8679  178.105   3.8045 -7.744858 5.425409 
1 1 1   17   25   23 o   29.919   5.2937   21.024   7.4634   6.3289   11.510   31.686   9.8040   21.468   8.5857   38.369   6.1952 -16.90104 10.58747 
1 1 1   17   25   24 o   34.341   5.5658   27.127   7.6572   26.118   11.732   27.875   10.107   33.551   8.4755   35.130   7.2166 -1.579353 11.13162 
1 1 1   17   25   25 o   18.305   5.4101   1.2094   7.3112  -8.7231   11.831   7.3455   9.2992   15.972   7.4270   20.639   7.8687 -4.667248 10.82018 
1 1 1   17   25   26 f   26.861   5.5840   15.080   7.9127   0.1544   11.456   28.698   10.942   18.506   8.0467   35.216   7.7444 -16.70981 11.16806 
1 1 1   17   25   27 o   43.566   4.7588   41.819   8.5164   42.631   12.663   41.148   11.508   43.833   7.0043   43.299   6.4439 0.5340614 9.517549 
1 1 1   17   25   28 o   39.004   5.4679   35.525   8.4752   33.231   12.202   37.662   11.780   37.537   8.1179   40.470   7.3274 -2.933205 10.93574 
1 1 1   17   25   29 o   39.771   6.2295   38.402   9.9810   45.152   14.427   32.205   13.823   43.506   8.3437   36.037   9.2525 7.469849 12.45899 
1 1 1   17   25   30 o   96.451   3.5030  199.276   13.565  193.857   17.223  208.128   22.012   95.208   4.3861   97.693   5.4631 -2.484566 7.005907 
1 1 1   17   25   31 o   29.617   6.1722   21.960   8.2000   17.343   12.424   25.524   10.915   26.843   9.2531   32.391   8.1710 -5.547821 12.34447 
1 1 1   17   25   32 o   53.242   6.4376   85.924   11.394   38.846   20.838  106.005   13.609   36.601   11.978   69.884   4.7216 -33.28345 12.87527 
1 1 1   17   25   33 o   29.703   5.8791   22.454   8.4350   8.9325   12.516   33.706   11.417   22.081   8.9098   37.326   7.6726 -15.24550 11.75815 
1 1 1   17   25   34 o   30.352   6.5982   24.403   9.0302   25.332   13.469   23.645   12.171   30.699   9.5877   30.005   9.0675 0.6943016 13.19636 
1 1 1   17   25   35 o   22.513   6.7699   8.7782   10.723   11.130   12.830   3.3291   19.528   22.735   9.0742   22.290   10.049 0.4441929 13.53979 
1 1 1   17   26    0 o   34.254   5.6044   28.073   9.7428   28.073   9.7428   28.073   9.7428   34.254   7.9258   34.254   7.9258 0.000000 0.000000 
1 1 1   17   26    1 o   63.212   3.6277   84.357   9.2900   79.466   14.318   87.913   12.209   61.518   5.6429   64.907   4.5606 -3.388786 7.255446 
1 1 1   17   26    2 o  108.025   2.6638  242.019   11.850  232.337   16.215  253.117   17.360  105.723   3.7187  110.327   3.8152 -4.603729 5.327675 
1 1 1   17   26    3 o   52.676   3.0161   54.974   6.3553   70.077   10.710   46.764   7.8960   57.956   4.4803   47.396   4.0392 10.56070 6.032263 
1 1 1   17   26    4 o  104.048   2.3107  223.290   9.6476  230.515   15.673  218.883   12.242  105.324   3.6079  102.772   2.8880 2.551529 4.621448 
1 1 1   17   26    5 o   78.266   2.8101  128.434   9.0021  116.546   13.143  138.940   12.356   74.775   4.2615   81.757   3.6641 -6.982185 5.620173 
1 1 1   17   26    6 o  115.078   2.4881  274.590   11.776  281.813   17.409  268.496   15.990  116.445   3.6248  113.711   3.4093 2.733551 4.976211 
1 1 1   17   26    7 o   71.921   3.2571  106.949   9.6065   98.328   12.778  118.154   14.568   68.638   4.5139   75.203   4.6968 -6.565155 6.514208 
1 1 1   17   26    8 o  123.133   2.8758  321.009   14.215  289.875   22.209  342.615   18.501  117.834   4.5697  128.432   3.4926 -10.59817 5.751556 
1 1 1   17   26    9 o   61.752   3.2331   80.677   8.1125   71.795   12.125   87.875   10.915   58.554   5.0207   64.949   4.0748 -6.394535 6.466165 
1 1 1   17   26   10 o   43.666   4.5339   40.247   8.1503   38.137   11.120   42.697   11.980   42.444   6.3523   44.888   6.4710 -2.444328 9.067857 
1 1 1   17   26   11 o   85.775   3.1506  153.915   11.012  153.792   14.498  154.082   16.930   85.831   4.0956   85.720   4.7886 0.1103058 6.301154 
1 1 1   17   26   12 o  121.711   2.5590  308.687   12.827  308.154   18.646  309.166   17.672  121.576   3.7185  121.845   3.5166 -0.2692947 5.117932 
1 1 1   17   26   13 o   80.080   2.8747  137.541   9.2355  112.442   13.896  157.399   12.360   73.215   4.6018   86.946   3.4468 -13.73146 5.749495 
1 1 1   17   26   14 o   41.660   4.2314   37.235   7.0559   35.120   11.243   38.609   9.0631   40.516   6.7279   42.805   5.1335 -2.289307 8.462729 
1 1 1   17   26   15 o  100.368   3.0117  207.266   12.236  193.001   15.647  229.727   19.633   96.107   3.9473  104.629   4.5497 -8.521751 6.023378 
1 1 1   17   26   16 o   66.273   3.2370   91.749   8.8263   99.855   13.016   84.848   12.010   68.970   4.5755   63.576   4.5800 5.394833 6.473957 
1 1 1   17   26   17 o   78.400   2.9355  127.862   9.4321  135.209   14.310  122.219   12.542   80.332   4.3191   76.468   3.9767 3.864716 5.871004 
1 1 1   17   26   18 o   22.941   6.4123   3.6801   9.0818   16.778   15.267  -3.4930   11.298   28.542   10.223   17.340   7.7438 11.20183 12.82468 
1 1 1   17   26   19 o   71.785   3.7812  109.588   10.482  108.788   18.304  109.979   12.786   71.222   6.2312   72.347   4.2849 -1.125099 7.562311 
1 1 1   17   26   20 o   89.435   3.1798  169.595   11.372  163.326   18.291  173.546   14.519   87.838   5.0489   91.032   3.8670 -3.193077 6.359640 
1 1 1   17   26   21 o   40.000   4.8648   33.982   7.7244   44.422   12.218   27.030   9.9698   45.348   6.5323   34.651   7.2107 10.69751 9.729585 
1 1 1   17   26   22 o   31.749   5.8098   22.775   7.6084   27.069   11.788   19.710   9.9610   34.186   8.4166   29.312   8.0110 4.874548 11.61960 
1 1 1   17   26   23 o   50.782   4.7196   62.220   8.5034   32.979   12.702   85.970   11.447   37.745   8.3776   63.820   4.3489 -26.07453 9.439112 
1 1 1   17   26   24 o   84.035   3.0104  149.873   10.369  143.634   15.345  155.115   14.066   82.286   4.5215   85.783   3.9756 -3.496948 6.020701 
1 1 1   17   26   25 o   56.680   3.9658   71.098   8.9842   60.036   13.787   79.263   11.845   52.373   6.3824   60.987   4.7089 -8.613533 7.931523 
1 1 1   17   26   26 o   83.302   3.5049  150.852   11.778  136.070   18.081  161.747   15.523   79.323   5.5265   87.280   4.3123 -7.956528 7.009885 
1 1 1   17   26   27 o   19.094   5.8368  -0.6726   9.0536   7.5875   11.604 -13.5233   14.474   21.619   8.6295   16.569   7.8617 5.049658 11.67365 
1 1 1   17   26   28 o   47.590   4.5163   50.236   8.7947   51.251   13.333   49.455   11.701   47.807   6.7622   47.374   5.9885 0.4329071 9.032673 
1 1 1   17   26   29 o   19.012   5.8026   2.0626   8.0014   0.9339   13.643   2.6544   9.8787   19.876   8.7087   18.149   7.6707 1.727732 11.60522 
1 1 1   17   26   30 o   54.969   4.8096   69.315   10.724   74.513   14.367   62.778   16.113   57.867   6.0198   52.071   7.5028 5.796600 9.619215 
1 1 1   17   26   31 o   24.853   6.2068   14.731   8.0025   11.869   12.345   16.805   10.510   23.530   9.0433   26.176   8.5040 -2.645449 12.41365 
1 1 1   17   26   32 o   34.104   6.8838   32.497   9.9647   24.550   19.872   35.166   11.517   30.040   11.491   38.168   7.5836 -8.127878 13.76762 
1 1 1   17   26   33 o   78.197   3.5849  135.860   11.475  118.843   16.318  152.503   16.138   72.947   5.4238   83.446   4.6891 -10.49864 7.169741 
1 1 1   17   26   34 o   21.769   6.5978   0.4097   10.492 -10.0155   12.820   21.556   18.258   15.594   7.3989   27.945   10.926 -12.35160 13.19561 
1 1 1   17   27    0 o  186.774   3.0330  724.579   33.003  724.579   33.003  724.579   33.003  186.774   4.2893  186.774   4.2893 0.000000 0.000000 
1 1 1   17   27    1 o   57.655   3.2624   69.120   7.7387   63.336   10.557   75.837   11.377   55.055   4.6493   60.255   4.5780 -5.200760 6.524850 
1 1 1   17   27    2 o  188.807   2.5643  740.943   19.966  729.924   27.931  752.457   28.551  187.377   3.6142  190.237   3.6388 -2.859756 5.128662 
1 1 1   17   27    3 f   48.627   3.5471   49.588   7.0889   48.895   10.431   50.183   9.6637   48.277   5.2386   48.978   4.7839 -0.7009735 7.094227 
1 1 1   17   27    4 o  109.749   2.4167  250.451   10.931  244.257   15.641  256.365   15.282  108.402   3.4982  111.096   3.3352 -2.694305 4.833315 
1 1 1   17   27    5 o  162.127   2.5108  546.726   16.789  544.210   23.717  549.252   23.770  161.751   3.5550  162.502   3.5466 -0.7508392 5.021598 
1 1 1   17   27    6 o  110.319   2.4934  252.853   11.303  257.507   16.788  248.995   15.286  111.208   3.6602  109.430   3.3869 1.778107 4.986780 
1 1 1   17   27    7 o   21.961   5.9684   7.3537   7.8014   1.0739   12.671   11.187   9.9002   20.220   8.6223   23.703   8.2549 -3.482698 11.93680 
1 1 1   17   27    8 o   19.513   5.3310   6.1198   5.7148  -1.8353   12.517   8.2146   6.4234   18.988   8.3300   20.038   6.6549 -1.049713 10.66192 
1 1 1   17   27    9 f   33.126   4.6990   21.494   5.7556   32.092   10.935   17.433   6.7692   38.092   7.2243   28.161   6.0110 9.930157 9.398031 
1 1 1   17   27   10 o   42.074   3.7377   35.146   6.0340   43.425   11.185   31.747   7.1662   45.228   5.9960   38.920   4.4642 6.308113 7.475354 
1 1 1   17   27   11 o   59.521   2.9724   68.737   6.9161   91.721   12.440   58.456   8.3204   66.120   4.5618   52.922   3.8119 13.19835 5.944790 
1 1 1   17   27   12 o   36.559   4.5242   29.278   5.9952   28.315   11.109   29.674   7.1213   35.520   7.7965   37.598   4.5923 -2.077290 9.048453 
1 1 1   17   27   13 o   29.910   5.0167   21.826   6.4462   9.3718   10.781   28.756   8.0422   22.916   8.5294   36.903   5.2838 -13.98726 10.03338 
1 1 1   17   27   14 o   76.178   2.8998  121.223   8.9927  122.396   13.906  120.380   11.790   76.410   4.4125   75.947   3.7638 0.4630585 5.799699 
1 1 1   17   27   15 o   53.220   4.5510   60.100   9.6508   58.817   12.124   62.318   15.943   52.684   5.5797   53.755   7.1911 -1.071159 9.101923 
1 1 1   17   27   16 o   47.679   4.9255   50.760   9.1589   56.098   12.084   43.554   14.040   51.343   5.7065   44.016   8.0297 7.326542 9.850904 
1 1 1   17   27   17 f   29.718   5.8716   19.528   7.4218   24.352   11.599   16.184   9.6578   32.561   8.5334   26.875   8.0674 5.685198 11.74317 
1 1 1   17   27   18 o   40.152   6.2863   37.818   10.053   32.866   15.532   41.389   13.189   37.368   9.9143   42.936   7.7318 -5.568352 12.57269 
1 1 1   17   27   19 o   45.045   6.1729   46.758   10.974   42.641   17.198   49.585   14.253   42.435   9.9918   47.656   7.2516 -5.221546 12.34588 
1 1 1   17   27   20 o   80.126   3.5147  136.892   11.471  140.597   15.211  132.007   17.466   81.586   4.5205   78.666   5.3831 2.920090 7.029475 
1 1 1   17   27   21 o   95.241   3.4229  188.970   13.065  178.400   16.435  207.120   21.537   91.953   4.3334   98.529   5.2997 -6.575386 6.845848 
1 1 1   17   27   22 o   69.698   3.3244  103.057   9.5323  105.339   14.048  101.109   12.977   70.350   4.8416   69.045   4.5570 1.304497 6.648831 
1 1 1   17   27   23 o   86.997   3.0007  161.397   10.683  145.424   15.538  175.716   14.712   82.713   4.5547   91.281   3.9078 -8.567337 6.001367 
1 1 1   17   27   24 o   71.233   3.2336  107.698   9.4645  112.034   14.109  104.150   12.762   72.458   4.7211   70.008   4.4198 2.450676 6.467105 
1 1 1   17   27   25 o   24.728   5.9116   13.524   7.6932   5.2898   11.872   19.486   10.101   20.760   8.5635   28.695   8.1521 -7.934776 11.82330 
1 1 1   17   27   26 o   68.027   3.6944  103.447   10.002   81.165   15.019  121.205   13.408   60.705   5.9985   75.350   4.3143 -14.64477 7.388846 
1 1 1   17   27   27 o   16.693   5.5007  -8.3487   9.0753  -9.3811   11.820  -6.8664   14.164   15.507   7.2798   17.879   8.2482 -2.372341 11.00130 
1 1 1   17   27   28 o   20.243   5.7886   5.1634   8.0516  -5.4995   13.264   11.385   10.132   17.564   8.0582   22.923   8.3125 -5.359007 11.57723 
1 1 1   17   27   29 o   28.181   6.3203   19.225   8.1759   24.029   12.782   15.898   10.637   30.693   9.2961   25.669   8.5655 5.023855 12.64068 
1 1 1   17   27   30 o   27.811   6.1846   17.245   8.3517   30.378   13.137   8.3369   10.819   34.450   9.1073   21.171   8.3698 13.27900 12.36920 
1 1 1   17   27   31 o   19.682   5.9398   3.1238   8.7623   8.9164   12.315  -2.8154   12.470   21.879   8.8345   17.485   7.9419 4.393740 11.87950 
1 1 1   17   27   32 o   21.727   6.0605   9.5249   8.2642   3.7502   12.945   13.497   10.737   19.799   8.5813   23.655   8.5603 -3.856094 12.12092 
1 1 1   17   27   33 o   25.596   6.7867   17.168   10.055   5.1542   19.812   21.337   11.670   22.818   10.218   28.374   8.9350 -5.555630 13.57337 
1 1 1   17   28    0 o   79.158   3.0316  131.301   13.904  131.301   13.904  131.301   13.904   79.158   4.2874   79.158   4.2874 0.000000 0.000000 
1 1 1   17   28    1 f   92.066   2.6724  177.428   10.094  183.792   13.743  169.975   14.874   93.927   3.5476   90.205   3.9978 3.722153 5.344882 
1 1 1   17   28    2 o  118.043   2.3558  289.948   11.469  289.104   16.268  290.783   16.171  117.868   3.3465  118.219   3.3166 -0.3511505 4.711570 
1 1 1   17   28    3 o   40.113   4.4038   36.004   6.8094   26.071   10.029   44.500   9.2749   34.219   7.3270   46.007   4.8878 -11.78817 8.807698 
1 1 1   17   28    4 o   60.699   3.2165   77.632   8.0064   72.885   11.734   81.767   10.952   58.890   4.8309   62.508   4.2481 -3.617847 6.433024 
1 1 1   17   28    5 o   40.976   4.1124   35.140   6.9058   40.296   10.475   31.176   9.1841   43.599   5.8255   38.353   5.8060 5.246101 8.224743 
1 1 1   17   28    6 o   14.353   4.5770  -5.6304   5.7783   0.6781   8.9929 -10.0663   7.5410   17.105   7.2782   11.601   5.5518 5.503848 9.153913 
1 1 1   17   28    7 o   77.481   3.0987  118.952   9.1562  144.002   17.118  108.913   10.837   82.690   5.0191   72.271   3.6356 10.41897 6.197451 
1 1 1   17   28    8 o   62.574   3.4968   82.691   7.6270   81.907   15.705   82.933   8.7250   62.034   6.1381   63.114   3.3518 -1.080204 6.993662 
1 1 1   17   28    9 o   81.105   2.5630  134.415   8.1677  146.210   14.102  128.462   10.019   83.605   4.0896   78.605   3.0905 5.000069 5.125978 
1 1 1   17   28   10 o   29.652   4.9562   17.526   5.4101   24.848   10.699   15.011   6.2708   33.211   7.9220   26.092   5.9579 7.118402 9.912382 
1 1 1   17   28   11 o   73.119   2.6913  110.327   7.7244  115.837   13.261  107.497   9.5032   74.355   4.3240   71.884   3.2053 2.470970 5.382509 
1 1 1   17   28   12 o   48.915   3.4770   49.500   6.3795   52.625   11.946   48.253   7.5457   49.769   5.8195   48.062   3.8066 1.706970 6.953907 
1 1 1   17   28   13 o   97.636   2.4742  195.997   9.4581  208.244   16.369  189.859   11.588   99.722   3.9799   95.549   2.9406 4.173264 4.948351 
1 1 1   17   28   14 o   20.912   5.6920   7.2588   6.8262  -0.8735   13.389   10.115   7.9351   19.800   8.6525   22.024   7.3981 -2.223845 11.38406 
1 1 1   17   28   15 o   63.515   3.7092   83.265   9.4129   94.776   15.744   76.861   11.743   66.671   5.7256   60.359   4.7169 6.311996 7.418353 
1 1 1   17   28   16 o   25.440   6.5397   12.452   9.1688   6.4015   13.524   17.598   12.473   22.713   9.2274   28.168   9.2697 -5.455328 13.07944 
1 1 1   17   28   17 o   22.822   6.1418   9.1218   8.0338   10.724   11.090   7.3529   11.654   23.593   8.6751   22.052   8.6965 1.540648 12.28356 
1 1 1   17   28   18 o   55.636   4.3874   68.644   9.7495   79.834   13.090   54.702   14.611   61.245   5.1820   50.027   7.0812 11.21824 8.774802 
1 1 1   17   28   19 o   44.761   6.8941   46.219   9.3130   47.658   24.230   45.970   10.088   43.101   12.742   46.421   5.2689 -3.319649 13.78827 
1 1 1   17   28   20 o   27.235   6.2659   17.429   7.9102   10.437   15.589   19.853   9.1797   25.111   10.009   29.359   7.5412 -4.248260 12.53183 
1 1 1   17   28   21 o   35.930   5.4104   29.010   7.7017   35.857   12.057   24.290   10.010   39.481   7.6807   32.380   7.6221 7.100918 10.82077 
1 1 1   17   28   22 o   46.171   4.2119   45.171   7.9041   53.906   12.550   39.428   10.176   49.706   6.1214   42.635   5.7870 7.071182 8.423805 
1 1 1   17   28   23 o   37.156   5.1762   32.296   7.5977   27.109   11.781   35.989   9.9412   33.700   8.4822   40.613   5.9349 -6.913315 10.35234 
1 1 1   17   28   24 o   39.332   5.0061   35.572   7.7585   33.811   12.109   36.798   10.105   37.757   8.0233   40.908   5.9892 -3.150127 10.01216 
1 1 1   17   28   25 o   25.827   5.7983   13.354   7.6933   26.306   11.665   3.3828   10.235   32.902   8.5264   18.752   7.8602 14.14986 11.59664 
1 1 1   17   28   26 o   43.383   5.2918   45.652   8.7869   33.278   13.473   54.810   11.591   36.740   8.9696   50.026   5.6177 -13.28620 10.58363 
1 1 1   17   28   27 o   28.656   6.3601   19.517   8.3071   25.816   13.150   15.334   10.716   31.890   9.3754   25.422   8.5969 6.468630 12.72027 
1 1 1   17   28   28 o   40.159   6.1472   38.474   9.3850   45.723   16.597   35.066   11.379   41.985   9.7682   38.333   7.4657 3.651966 12.29447 
1 1 1   17   28   29 o   24.756   6.2835   14.285   8.1078   17.050   12.369   12.201   10.736   26.281   9.2226   23.232   8.5366 3.048517 12.56705 
1 1 1   17   28   30 o   40.215   5.4945   39.139   8.6832   42.647   13.524   36.679   11.326   41.403   8.2096   39.028   7.3049 2.374619 10.98901 
1 1 1   17   28   31 o   27.744   6.5350   19.311   9.4594   9.0159   13.098   30.535   13.676   21.911   9.0114   33.578   9.4667 -11.66732 13.06999 
1 1 1   17   28   32 o   23.935   6.6723   13.189   9.6606   11.263   13.003   15.562   14.433   22.805   9.1238   25.066   9.7383 -2.260260 13.34458 
1 1 1   17   29    0 o   41.204   4.7281   38.231   10.466   38.231   10.466   38.231   10.466   41.204   6.6866   41.204   6.6866 0.000000 0.000000 
1 1 1   17   29    1 o  104.687   2.6617  228.594   11.485  224.874   15.902  232.651   16.605  103.813   3.7140  105.560   3.8138 -1.746498 5.323470 
1 1 1   17   29    2 o   31.010   4.8982   20.783   6.3763   30.255   9.4021   12.716   8.6765   37.718   6.0438   24.301   7.7097 13.41693 9.796326 
1 1 1   17   29    3 f   32.986   4.9808   23.901   6.5612   28.551   9.8107   20.138   8.8253   35.954   6.8664   30.018   7.2172 5.935930 9.961686 
1 1 1   17   29    4 o   77.415   2.7992  124.739   8.9103  131.450   13.241  119.185   12.046   79.287   4.0490   75.544   3.8661 3.743561 5.598332 
1 1 1   17   29    5 o   74.409   2.9165  116.554   8.8704  109.427   13.212  122.403   11.969   72.242   4.4343   76.576   3.7896 -4.333374 5.833019 
1 1 1   17   29    6 o   26.109   5.0543   15.252   6.4717   2.6820   9.9233   24.555   8.5371   18.812   7.8003   33.406   6.4295 -14.59428 10.10858 
1 1 1   17   29    7 o   41.535   4.5640   36.882   6.6901   38.493   13.052   36.308   7.7914   41.484   7.9174   41.585   4.5427 -0.1012688 9.128016 
1 1 1   17   29    8 o   32.183   4.7046   21.346   5.5027   25.669   10.856   19.851   6.3835   33.695   7.9414   30.670   5.0463 3.024986 9.409104 
1 1 1   17   29    9 o  115.326   2.4599  280.072   11.556  257.841   17.337  297.851   15.503  111.046   3.7853  119.606   3.1427 -8.560837 4.919824 
1 1 1   17   29   10 o   54.407   3.2541   64.070   6.6275   58.090   11.941   66.733   7.9672   52.264   5.5397   56.550   3.4159 -4.286648 6.508221 
1 1 1   17   29   11 o   50.676   3.3429   52.324   6.4730   59.190   11.895   49.436   7.7153   52.763   5.4660   48.589   3.8499 4.174114 6.685723 
1 1 1   17   29   12 o   72.283   2.7871  111.343   7.7744  103.983   13.391  115.085   9.5482   70.235   4.6229   74.331   3.1145 -4.095665 5.574131 
1 1 1   17   29   13 o   29.856   4.9667   21.256   5.6057   15.369   11.049   23.297   6.5051   26.500   8.7247   33.213   4.7488 -6.713093 9.933312 
1 1 1   17   29   14 o   65.835   3.1357   92.217   8.3920   85.560   12.712   97.359   11.172   63.569   4.8486   68.101   3.9777 -4.532063 6.271445 
1 1 1   17   29   15 o   57.787   3.6164   72.759   8.3805   56.593   12.272   86.885   11.472   51.375   5.7917   64.199   4.3326 -12.82411 7.232871 
1 1 1   17   29   16 o  161.600   2.6448  546.634   17.604  508.512   24.368  588.242   25.458  155.678   3.7952  167.521   3.6846 -11.84279 5.289593 
1 1 1   17   29   17 o   31.259   6.1970   22.607   8.3321   19.280   11.320   26.540   12.308   28.888   8.7483   33.630   8.7795 -4.741114 12.39408 
1 1 1   17   29   18 o   64.726   3.8535   88.244   10.186   75.818   13.373  105.415   15.720   59.401   5.4584   70.052   5.4410 -10.65023 7.706988 
1 1 1   17   29   19 o   39.580   5.6376   35.837   9.0377   29.858   12.495   42.398   13.088   35.503   8.6195   43.658   7.2687 -8.154797 11.27519 
1 1 1   17   29   20 o   18.175   5.6471   0.7202   7.1706  -4.3265   15.289   2.1435   8.1189   19.575   8.8523   16.775   7.0139 2.800415 11.29417 
1 1 1   17   29   21 o   32.931   6.0469   27.654   8.2151   17.614   16.053   31.217   9.5621   28.110   10.419   37.752   6.1411 -9.642567 12.09387 
1 1 1   17   29   22 o   30.457   5.8324   21.343   7.3617   27.155   11.995   17.831   9.3245   33.461   8.6336   27.452   7.8441 6.009420 11.66487 
1 1 1   17   29   23 o   48.263   4.2317   52.639   8.1172   44.714   12.632   58.213   10.594   44.597   6.8675   51.929   4.9463 -7.332542 8.463404 
1 1 1   17   29   24 f   54.193   4.1423   66.331   8.9598   52.390   13.347   77.765   12.088   48.348   6.6934   60.037   4.8818 -11.68919 8.284522 
1 1 1   17   29   25 o   18.820   5.5102   3.5286   7.3407  -5.1909   12.224   8.4471   9.1805   16.891   7.7443   20.750   7.8405 -3.859184 11.02036 
1 1 1   17   29   26 o   21.294   6.3621   5.6454   9.6116   4.6396   13.887   6.5702   13.316   21.052   9.0031   21.536   8.9916 -0.4831314 12.72416 
1 1 1   17   29   27 o   23.435   6.0207   12.400   8.2089  -0.0098   14.684   18.041   9.9005   19.807   8.8382   27.063   8.1782 -7.255726 12.04148 
1 1 1   17   29   28 o   57.541   4.7602   80.838   10.353   58.409   16.574   95.191   13.258   49.138   8.1778   65.944   4.8746 -16.80600 9.520423 
1 1 1   17   29   29 o   31.386   6.5078   24.836   10.877   4.0129   15.429   45.405   15.335   21.058   9.2430   41.714   9.1635 -20.65590 13.01550 
1 1 1   17   29   30 o   21.720   6.5952   6.8974   10.567   7.2860   15.861   6.5874   14.169   22.154   9.5504   21.286   9.0981 0.8676395 13.19036 
1 1 1   17   30    0 o   18.935   6.7321   11.366   9.1543   11.366   9.1543   11.366   9.1543   18.935   9.5206   18.935   9.5206 0.000000 0.000000 
1 1 1   17   30    1 o   41.657   4.4941   39.059   7.2150   28.409   10.606   48.234   9.8439   35.545   7.4715   47.769   4.9964 -12.22404 8.988195 
1 1 1   17   30    2 o   89.477   2.5537  167.317   9.4215  164.527   13.401  170.044   13.248   88.722   3.6623   90.231   3.5598 -1.508400 5.107326 
1 1 1   17   30    3 o  125.098   2.5503  326.987   13.157  320.978   18.548  333.073   18.668  123.931   3.6287  126.264   3.5846 -2.333580 5.100661 
1 1 1   17   30    4 o   68.846   2.9643  100.096   8.3637   91.955   12.187  107.346   11.500   66.100   4.4701   71.592   3.8945 -5.492004 5.928613 
1 1 1   17   30    5 f   64.835   3.0204   88.459   8.0631   85.201   11.602   91.503   11.214   63.636   4.4202   66.034   4.1175 -2.398136 6.040891 
1 1 1   17   30    6 o  105.233   2.4834  231.373   10.766  217.308   15.158  245.688   15.293  101.969   3.6042  108.496   3.4174 -6.526894 4.966823 
1 1 1   17   30    7 o   41.018   5.3262   37.057   8.5746   41.789   13.448   33.815   11.131   43.105   7.8534   38.932   7.1971 4.172043 10.65238 
1 1 1   17   30    8 o   68.327   2.9103   95.983   8.1053  119.100   12.435   78.905   10.688   75.367   4.0003   61.286   4.2282 14.08134 5.820663 
1 1 1   17   30    9 o   37.623   4.1658   29.436   5.7688   33.876   10.804   27.665   6.8228   39.023   6.9685   36.223   4.5668 2.799595 8.331641 
1 1 1   17   30   10 o   80.720   2.6822  140.575   8.3902  123.821   14.085  149.789   10.446   76.638   4.4561   84.803   2.9865 -8.164909 5.364326 
1 1 1   17   30   11 f   54.307   3.3399   64.597   6.8147   56.715   12.077   68.280   8.2545   51.480   5.6878   57.134   3.5029 -5.653679 6.679892 
1 1 1   17   30   12 o   46.138   4.1716   51.806   6.4325   34.685   11.782   59.077   7.6779   39.141   7.5720   53.135   3.5034 -13.99486 8.343189 
1 1 1   17   30   13 o   15.768   4.6935  -1.0334   5.9091 -15.7087   10.440   5.8846   7.1679   13.063   6.3218   18.473   6.9392 -5.409928 9.387095 
1 1 1   17   30   14 o   49.794   3.7295   52.237   7.5883   58.147   11.744   48.001   9.9425   52.117   5.4635   47.471   5.0782 4.646210 7.459069 
1 1 1   17   30   15 o   46.116   4.4225   49.983   7.5232   33.838   11.714   61.318   9.8149   38.427   7.6598   53.805   4.4228 -15.37873 8.844956 
1 1 1   17   30   16 o   37.183   4.6653   29.407   6.8517   36.799   11.364   25.186   8.5881   40.906   6.7358   33.461   6.4569 7.445774 9.330689 
1 1 1   17   30   17 o   93.876   3.1264  186.487   12.080  177.169   16.454  197.384   17.793   91.375   4.3659   96.378   4.4762 -5.002831 6.252757 
1 1 1   17   30   18 o   18.056   5.5205   1.4726   6.8458  -1.2389   13.520   2.4075   7.9388   19.353   8.5667   16.759   6.9653 2.594629 11.04098 
1 1 1   17   30   19 o   47.943   5.0337   51.258   9.3461   34.993   12.503   71.857   14.070   38.542   8.1215   57.343   5.9492 -18.80153 10.06733 
1 1 1   17   30   20 o   41.213   6.4026   40.772   10.529   48.020   16.102   35.358   13.915   44.417   9.0958   38.009   9.0132 6.407269 12.80513 
1 1 1   17   30   21 o   28.412   6.4045   19.449   9.8242   2.3422   15.763   30.315   12.563   21.566   9.4071   35.259   8.6936 -13.69318 12.80905 
1 1 1   17   30   22 o   23.319   5.9504   11.355   7.1015   14.071   11.838   9.8282   8.8758   25.033   8.9981   21.605   7.7886 3.427391 11.90076 
1 1 1   17   30   23 o   50.273   4.2718   57.278   8.5987   48.627   13.110   63.808   11.391   46.357   6.8569   54.188   5.0968 -7.830936 8.543653 
1 1 1   17   30   24 o   38.356   5.4823   35.221   8.2297   35.656   13.019   34.932   10.621   38.012   8.5157   38.701   6.9070 -0.6892586 10.96470 
1 1 1   17   30   25 o   39.270   5.3729   37.210   8.3211   33.592   12.994   39.726   10.834   36.571   8.7348   41.968   6.2590 -5.397156 10.74577 
1 1 1   17   30   26 o   20.068   6.4633  -0.8469   11.055   5.9504   11.986 -39.5741   28.609   20.490   8.5408   19.647   9.7032 0.8436394 12.92660 
1 1 1   17   30   27 f   19.621   6.0774  -0.2156   10.232 -16.0476   16.337   10.002   13.125   16.719   8.0451   22.524   9.1114 -5.805119 12.15489 
1 1 1   17   30   28 f   24.468   6.7015   14.280   9.6751   12.229   13.696   16.322   13.670   23.494   9.3760   25.442   9.5777 -1.948212 13.40303 
1 1 1   17   30   29 o   24.409   6.6427   14.474   9.4479   15.747   13.215   13.143   13.512   25.024   9.4178   23.794   9.3705 1.229454 13.28534 
1 1 1   17   31    0 o  117.426   2.6677  287.465   18.229  287.465   18.229  287.465   18.229  117.426   3.7727  117.426   3.7727 0.000000 0.000000 
1 1 1   17   31    1 o   85.364   2.7501  152.124   9.6428  159.931   14.431  145.825   12.961   87.291   4.0083   83.438   3.7663 3.852913 5.500124 
1 1 1   17   31    2 o   44.316   3.8649   41.610   6.9899   50.527   10.286   33.959   9.5281   48.793   5.1112   39.839   5.7987 8.953522 7.729747 
1 1 1   17   31    3 o   62.143   3.1737   82.688   8.0027   69.619   11.710   94.143   10.962   57.313   4.9536   66.972   3.9687 -9.659100 6.347361 
1 1 1   17   31    4 o   92.634   3.0182  182.967   11.113  190.124   14.130  171.364   17.993   95.315   3.5944   89.954   4.8497 5.361053 6.036496 
1 1 1   17   31    5 o   52.796   3.4752   60.166   7.3522   44.385   10.427   75.771   10.368   45.585   5.5458   60.007   4.1894 -14.42139 6.950305 
1 1 1   17   31    6 o   90.931   2.9486  177.238   10.730  158.742   16.838  189.883   13.922   86.609   4.7138   95.254   3.5438 -8.645172 5.897300 
1 1 1   17   31    7 o   33.911   5.8764   27.588   8.2149   20.404   12.954   32.421   10.625   29.789   9.4171   38.034   7.0319 -8.245573 11.75284 
1 1 1   17   31    8 o  114.816   2.4195  275.736   11.453  266.404   16.175  285.119   16.219  112.842   3.4754  116.790   3.3670 -3.947739 4.838910 
1 1 1   17   31    9 o   65.989   3.0705   92.213   8.2832   89.067   12.443   94.716   11.100   64.865   4.6509   67.113   4.0102 -2.247971 6.141037 
1 1 1   17   31   10 o   85.295   2.5513  157.031   8.6699  130.255   13.385  176.386   11.380   78.630   4.1273   91.960   3.0003 -13.33020 5.102637 
1 1 1   17   31   11 o   66.702   2.9485   94.488   7.4584   92.344   13.416   95.446   8.9726   65.843   4.9404   67.561   3.2200 -1.718460 5.897089 
1 1 1   17   31   12 o   21.678   5.2675   9.7168   5.1258   8.7311   10.875   9.9984   5.8119   22.150   8.4939   21.206   6.2323 0.9436054 10.53506 
1 1 1   17   31   13 o   56.013   3.5482   67.844   7.9156   63.995   12.760   70.251   10.092   54.423   5.6845   57.603   4.2479 -3.180283 7.096367 
1 1 1   17   31   14 o   26.869   5.2783   17.775   6.5261   7.5854   10.931   23.418   8.1349   21.489   8.4391   32.248   6.3422 -10.75915 10.55660 
1 1 1   17   31   15 o   25.257   5.4781   11.583   6.3427   24.521   11.136   5.3715   7.7166   32.183   8.3265   18.332   7.1210 13.85079 10.95619 
1 1 1   17   31   16 o   32.310   5.2900   23.694   6.7218   26.904   11.132   21.852   8.4325   33.746   8.1010   30.875   6.8053 2.871441 10.58004 
1 1 1   17   31   17 o   35.485   5.4891   30.594   8.2175   16.326   11.926   43.495   11.339   26.534   9.0687   44.436   6.1871 -17.90137 10.97824 
1 1 1   17   31   18 o   31.505   5.8215   25.294   7.4195   18.582   13.978   27.927   8.7547   27.924   9.8039   35.086   6.2804 -7.161785 11.64303 
1 1 1   17   31   19 o   14.125   4.6558  -6.0527   6.3268  -9.4466   11.054  -4.3993   7.7156   14.870   6.9995   13.379   6.1410 1.491120 9.311553 
1 1 1   17   31   20 o   31.470   5.6893   24.030   7.2831   22.405   11.988   24.980   9.1693   30.179   8.9721   32.762   6.9983 -2.583284 11.37870 
1 1 1   17   31   21 o   65.774   4.4638   95.838   12.058  106.825   18.059   86.999   16.198   69.130   6.3338   62.418   6.2918 6.711681 8.927658 
1 1 1   17   31   22 o   84.301   3.9263  157.612   13.565  146.690   19.811  167.253   18.613   81.161   5.9183   87.441   5.1612 -6.280090 7.852651 
1 1 1   17   31   23 o   19.896   6.0249   3.7325   8.7804   4.4552   11.686   2.7955   13.307   19.783   8.3511   20.010   8.6865 -0.2271652 12.04974 
1 1 1   17   31   24 o   65.272   4.2668   95.220   11.436   83.937   15.573  108.422   16.846   60.955   6.1945   69.588   5.8694 -8.633198 8.533562 
1 1 1   17   31   25 o   21.044   7.0182  -4.8588   11.677  -6.9346   12.833   5.1369   28.160   16.503   7.6943   25.585   11.740 -9.082748 14.03633 
1 1 1   17   31   26 o   63.998   5.0438   98.508   12.977   83.522   19.365  110.725   17.484   58.382   8.0423   69.614   6.0895 -11.23227 10.08768 
1 1 1   17   31   27 o   33.573   8.3157   28.212   12.279   54.515   26.268   20.858   13.889   39.413   13.459   27.733   9.7700 11.67955 16.63144 
1 1 1   17   32    0 f  110.226   2.7039  253.754   17.337  253.754   17.337  253.754   17.337  110.226   3.8240  110.226   3.8240 0.000000 0.000000 
1 1 1   17   32    1 o   34.887   4.8019   26.500   6.7229   37.752   10.179   17.793   8.9538   41.878   5.8930   27.895   7.5833 13.98285 9.603811 
1 1 1   17   32    2 o  115.356   2.4853  279.479   11.781  268.019   17.188  289.634   16.179  113.030   3.6870  117.682   3.3334 -4.652008 4.970504 
1 1 1   17   32    3 o   62.827   3.1075   83.006   8.0283   88.892   11.933   78.139   10.851   64.827   4.4629   60.826   4.3254 4.001122 6.215093 
1 1 1   17   32    4 o   69.779   2.9316  103.056   8.3983   92.854   11.962  112.975   11.794   66.272   4.3762   73.285   3.9020 -7.013329 5.863107 
1 1 1   17   32    5 o   66.120   2.9119   91.878   7.9236  100.575   11.585   84.233   10.862   69.068   4.0667   63.173   4.1687 5.894844 5.823724 
1 1 1   17   32    6 o   24.846   5.7778   14.005   6.7973   9.5994   12.209   15.984   8.1828   23.252   8.9779   26.440   7.2751 -3.187553 11.55555 
1 1 1   17   32    7 o   79.047   3.0058  130.529   9.6922  121.702   12.642  143.117   15.096   75.944   4.0360   82.151   4.4553 -6.207176 6.011629 
1 1 1   17   32    8 f   45.230   4.2356   47.393   7.1505   30.923   10.628   61.017   9.6655   36.808   7.2584   53.652   4.3679 -16.84409 8.471260 
1 1 1   17   32    9 o   51.793   3.7900   57.599   7.7057   57.968   13.055   57.401   9.5459   51.591   6.1355   51.996   4.4512 -0.4055862 7.580070 
1 1 1   17   32   10 o   19.357   5.2423   5.8531   6.3506  -5.5533   11.636   10.692   7.5789   16.629   7.5989   22.085   7.2237 -5.455250 10.48453 
1 1 1   17   32   11 o   20.676   5.3566   2.9926   5.9422   18.314   11.473  -2.6236   6.9464   27.974   8.8647   13.378   6.0158 14.59650 10.71323 
1 1 1   17   32   12 o   42.647   4.4212   40.666   6.2719   39.528   12.973   41.013   7.1648   41.243   7.9144   44.052   3.9435 -2.808807 8.842429 
1 1 1   17   32   13 o   62.366   3.5319   83.881   8.7059   82.387   14.442   84.734   10.911   61.555   5.6887   63.176   4.1875 -1.621437 7.063700 
1 1 1   17   32   14 o   40.113   5.3067   43.464   7.7122   21.855   13.401   54.164   9.4302   29.903   9.5918   50.323   4.5435 -20.42007 10.61345 
1 1 1   17   32   15 o   24.930   5.1948   15.794   6.6183  -0.4621   12.514   22.107   7.7983   18.731   8.2689   31.129   6.2904 -12.39801 10.38957 
1 1 1   17   32   16 f   43.062   4.5280   38.469   7.5615   49.776   13.781   33.599   9.0445   46.912   7.1227   39.211   5.5926 7.700840 9.055922 
1 1 1   17   32   17 o   63.414   5.3938  101.016   11.949   68.336   20.134  118.784   14.846   52.597   9.6362   74.230   4.8492 -21.63235 10.78760 
1 1 1   17   32   18 o   25.844   5.2248   16.928   6.8393   1.6585   11.880   24.497   8.3645   19.018   8.2319   32.670   6.4366 -13.65164 10.44957 
1 1 1   17   32   19 f   23.015   6.3024   10.633   8.5165   10.683   11.681   10.577   12.443   22.911   8.7990   23.120   9.0254 -0.2081966 12.60476 
1 1 1   17   32   20 o   23.858   6.0659   8.4339   9.2277   25.018   12.997  -8.4248   13.104   31.209   9.3565   16.507   7.7224 14.70190 12.13174 
1 1 1   17   32   21 o   88.828   3.5382  170.992   12.856  143.339   17.410  204.151   19.065   80.768   5.2263   96.888   4.7708 -16.12002 7.076375 
1 1 1   17   32   22 o   35.059   6.9265   24.502   10.733   60.577   20.039   9.9885   12.710   47.507   10.506   22.611   9.0296 24.89568 13.85296 
1 1 1   17   32   23 o   49.850   6.9073   69.562   13.325   47.289   21.172   84.172   17.147   39.601   11.958   60.098   6.9178 -20.49721 13.81462 
1 1 1   17   32   24 o   39.148   7.1825   47.927   12.725   26.193   24.169   56.263   14.967   29.861   12.256   48.436   7.4922 -18.57479 14.36498 
1 1 1   17   32   25 o   27.641   8.4998   12.787   18.258  -4.7658   23.439   39.874   29.117   21.877   10.264   33.405   13.551 -11.52769 16.99953 
1 1 1   17   33    0 o   33.080   5.9861   27.470   9.9845   27.470   9.9845   27.470   9.9845   33.080   8.4656   33.080   8.4656 0.000000 0.000000 
1 1 1   17   33    1 o   31.982   5.2773   23.222   6.7708   27.046   10.526   20.523   8.8432   34.143   7.6627   29.822   7.2582 4.320230 10.55456 
1 1 1   17   33    2 o   53.782   3.4485   61.515   7.6223   65.355   11.376   58.386   10.268   55.252   4.9919   52.311   4.7592 2.941547 6.897036 
1 1 1   17   33    3 o   47.843   3.7418   50.031   7.2054   38.381   10.277   61.295   10.105   42.020   5.9297   53.666   4.5655 -11.64532 7.483681 
1 1 1   17   33    4 o   56.957   3.3011   69.192   7.7458   65.269   10.928   73.153   10.981   55.284   4.7926   58.630   4.5410 -3.346687 6.602193 
1 1 1   17   33    5 o   54.708   3.3672   64.398   7.5325   58.291   11.019   69.756   10.320   52.105   5.1274   57.312   4.3660 -5.206291 6.734409 
1 1 1   17   33    6 o   79.717   3.1718  138.208   9.9829  123.588   16.155  147.240   12.697   75.829   5.1653   83.605   3.6823 -7.776001 6.343504 
1 1 1   17   33    7 o   55.467   4.0952   66.759   9.3374   74.414   13.488   59.713   12.940   58.618   5.5787   52.316   5.9968 6.302368 8.190474 
1 1 1   17   33    8 o   33.299   5.4016   23.565   6.9815   35.059   12.303   18.106   8.4788   38.687   7.9755   27.912   7.2868 10.77537 10.80311 
1 1 1   17   33    9 o   66.764   3.3298   95.621   8.8402   94.722   14.504   96.152   11.151   66.177   5.3138   67.351   4.0142 -1.173965 6.659622 
1 1 1   17   33   10 o   25.596   5.0691   15.747   6.5053   2.5299   10.360   24.352   8.3588   18.501   7.8395   32.690   6.4286 -14.18923 10.13823 
1 1 1   17   33   11 o   16.153   4.9276   0.7817   5.8844  -3.5716   10.255   2.9186   7.1849   15.989   7.2384   16.317   6.6882 -0.3282948 9.855260 
1 1 1   17   33   12 o   26.102   6.1646   14.895   8.0376   8.6756   10.708   22.921   12.164   21.667   8.3964   30.536   9.0282 -8.869144 12.32910 
1 1 1   17   33   13 o   26.280   6.4536   15.629   8.3640   13.745   10.623   18.703   13.567   24.616   8.5520   27.945   9.6675 -3.328341 12.90725 
1 1 1   17   33   14 o   45.385   4.0455   45.516   7.2114   43.898   12.035   46.422   9.0073   44.311   6.5854   46.460   4.7006 -2.148838 8.090922 
1 1 1   17   33   15 o   46.643   5.0143   50.615   9.2063   56.552   12.449   43.449   13.677   50.577   5.9677   42.709   8.0598 7.867641 10.02869 
1 1 1   17   33   16 o   20.006   6.5723  -4.2284   11.307  -1.2046   12.699 -15.7969   24.840   18.439   8.2241   21.572   10.254 -3.133371 13.14468 
1 1 1   17   33   17 o   31.335   7.3178   26.023   10.936   24.127   17.669   27.201   13.923   30.291   10.978   32.379   9.6788 -2.087864 14.63561 
1 1 1   17   33   18 o   51.847   4.8931   62.458   10.294   70.278   14.113   53.569   15.046   55.938   6.1173   47.757   7.6387 8.181168 9.786283 
1 1 1   17   33   19 o   68.839   4.2768  104.854   12.008   96.369   15.643  117.026   18.736   65.753   5.7682   71.925   6.3159 -6.171928 8.553544 
1 1 1   17   33   20 f   27.556   7.1186   19.922   10.871   9.0310   20.517   24.174   12.818   24.699   10.754   30.412   9.3296 -5.712881 14.23716 
1 1 1   17   33   21 o   24.135   7.1743   10.872   11.106   12.534   21.613   10.275   12.946   25.689   11.111   22.581   9.0790 3.107849 14.34867 
1 1 1   17   33   22 f   23.127   7.1477   7.8224   11.910   7.8153   22.969   7.8251   13.928   24.519   10.989   21.735   9.1431 2.783964 14.29533 
1 1 1   17   33   23 o   37.400   8.0376   42.022   12.827   43.107   25.736   41.663   14.796   35.190   13.162   39.611   9.2282 -4.420654 16.07512 
1 1 1   17   34    0 o   44.096   4.3923   43.681   10.653   43.681   10.653   43.681   10.653   44.096   6.2116   44.096   6.2116 0.000000 0.000000 
1 1 1   17   34    1 o   26.369   5.0699   16.409   6.5928   3.5110   9.9635   26.455   8.7932   18.675   7.7857   34.063   6.4959 -15.38878 10.13976 
1 1 1   17   34    2 o   71.468   2.8857  108.597   8.5023  107.689   12.173  109.462   11.880   71.140   4.1488   71.795   4.0120 -0.6550827 5.771421 
1 1 1   17   34    3 o   44.090   3.8983   42.267   6.9949   51.706   10.197   33.877   9.6135   48.921   5.0537   39.260   5.9370 9.660316 7.796637 
1 1 1   17   34    4 o  106.747   2.5726  239.512   11.294  222.851   15.284  259.550   16.761  102.702   3.6082  110.792   3.6680 -8.089943 5.145220 
1 1 1   17   34    5 o   70.714   2.9463  107.312   8.5183   93.678   12.238  120.123   11.864   66.144   4.4861   75.283   3.8208 -9.138710 5.892682 
1 1 1   17   34    6 o   57.075   5.9563   84.725   11.992   49.040   19.000  108.352   15.460   43.543   10.664   70.607   5.3089 -27.06356 11.91255 
1 1 1   17   34    7 o   44.732   4.7209   44.744   8.6673   45.088   12.907   44.462   11.697   44.714   6.9988   44.749   6.3375 -0.3443146E-01 9.441723 
1 1 1   17   34    8 o   58.408   3.2827   73.360   7.8414   72.289   11.820   74.202   10.480   57.868   4.9523   58.949   4.3103 -1.081013 6.565309 
1 1 1   17   34    9 o   47.748   3.8359   50.574   7.3262   45.121   11.446   54.358   9.5351   45.165   6.1447   50.330   4.5934 -5.165112 7.671766 
1 1 1   17   34   10 o   47.609   3.8934   50.332   7.4564   44.714   11.451   54.467   9.8244   44.916   6.1814   50.301   4.7355 -5.384834 7.786831 
1 1 1   17   34   11 o   85.805   2.7621  157.888   9.6810  140.449   14.123  173.346   13.296   81.079   4.2233   90.531   3.5610 -9.452576 5.524203 
1 1 1   17   34   12 o   79.729   3.8312  138.955   12.442  137.695   16.351  140.686   19.175   79.663   4.9764   79.794   5.8265 -0.1310043 7.662416 
1 1 1   17   34   13 o   71.337   3.9301  111.193   11.481   94.548   15.559  131.090   17.012   65.342   5.7734   77.331   5.3338 -11.98818 7.860136 
1 1 1   17   34   14 o   24.856   6.0261   11.528   8.7617   26.246   12.530  -2.5546   12.256   32.118   9.0638   17.594   7.9438 14.52388 12.05223 
1 1 1   17   34   15 o   21.387   5.8124   2.5729   8.5397   20.424   12.721 -12.0703   11.522   28.355   9.3629   14.419   6.8900 13.93592 11.62484 
1 1 1   17   34   16 o   34.248   8.5231   35.309   16.303   45.441   20.383   17.315   27.162   39.811   11.663   28.685   12.432 11.12642 17.04620 
1 1 1   17   34   17 o   41.782   6.9802   52.602   12.312   27.940   22.655   62.938   14.667   31.304   12.190   52.260   6.8044 -20.95660 13.96045 
1 1 1   17   34   18 o   31.396   7.5928   26.952   11.214   29.232   21.021   26.045   13.259   31.509   11.874   31.283   9.4664 0.2260284 15.18569 
1 1 1   17   34   19 o   24.080   7.1425   10.553   11.179   16.679   20.144   7.8269   13.439   26.548   11.070   21.612   9.0289 4.936792 14.28495 
1 1 1   17   34   20 o   48.003   7.0576   55.731   12.481   82.763   23.858   45.545   14.645   53.959   11.091   42.046   8.7309 11.91357 14.11522 
1 1 1   17   34   21 o   18.459   6.2234  -8.7219   10.590  -1.6429   22.263 -10.7922   12.040   22.059   10.234   14.859   7.0842 7.200008 12.44670 
1 1 1   17   35    0 o   17.153   6.6492   9.5125   9.5485   9.5125   9.5485   9.5125   9.5485   17.153   9.4034   17.153   9.4034 0.000000 0.000000 
1 1 1   17   35    1 o   33.722   5.2360   26.542   7.0279   28.643   10.760   24.979   9.2809   34.739   7.7113   32.705   7.0852 2.033546 10.47200 
1 1 1   17   35    2 o   41.748   4.0950   38.471   7.0197   35.515   10.100   41.233   9.7637   40.041   6.1155   43.455   5.4477 -3.413883 8.190022 
1 1 1   17   35    3 o   34.457   4.9136   27.465   6.7300   29.412   9.9002   25.793   9.1764   35.591   6.9936   33.322   6.9038 2.269207 9.827219 
1 1 1   17   35    4 o   25.508   5.5182   15.506   6.5098   11.379   9.7020   18.885   8.7794   22.812   8.1516   28.205   7.4398 -5.392601 11.03631 
1 1 1   17   35    5 o   26.504   6.8240   13.599   7.7587   23.086   18.926   11.682   8.5063   30.291   11.296   22.717   7.6596 7.574293 13.64791 
1 1 1   17   35    6 o   27.192   5.8760   18.646   7.2060   12.317   13.492   21.172   8.5235   24.374   9.4305   30.011   7.0124 -5.636946 11.75193 
1 1 1   17   35    7 o   46.354   4.9374   48.538   9.2196   50.955   14.802   47.006   11.785   46.840   7.6618   45.868   6.2295 0.9718513 9.874701 
1 1 1   17   35    8 o   70.247   3.6664  112.073   9.7097   95.776   16.853  120.170   11.879   65.374   6.2505   75.120   3.8342 -9.746719 7.332797 
1 1 1   17   35    9 o   22.838   5.5916   12.256   6.9487   0.3492   13.335   16.694   8.1414   19.247   8.5143   26.429   7.2504 -7.181971 11.18312 
1 1 1   17   35   10 o   50.264   4.5684   58.164   8.6951   54.238   15.300   60.037   10.567   48.024   7.7245   52.505   4.8798 -4.481297 9.136720 
1 1 1   17   35   11 o   29.014   6.7838   21.501   9.3805   22.754   14.263   20.547   12.453   29.580   9.9187   28.448   9.2573 1.131851 13.56750 
1 1 1   17   35   12 o   29.750   7.3782   20.520   10.969   34.870   18.706   13.000   13.541   35.122   11.339   24.377   9.4431 10.74444 14.75640 
1 1 1   17   35   13 o   53.182   6.0579   68.315   11.947   71.928   21.291   66.654   14.434   52.254   10.245   54.110   6.4674 -1.856339 12.11588 
1 1 1   17   35   14 o   48.842   6.8435   61.112   12.344   63.060   22.649   60.289   14.723   46.772   11.755   50.912   7.0117 -4.139988 13.68700 
1 1 1   17   35   15 o   30.815   6.9008   27.682   11.481   5.4206   20.899   37.305   13.740   23.599   10.536   38.031   8.9150 -14.43231 13.80158 
1 1 1   17   35   16 o   21.958   10.474 -11.3865   26.388   0.0000   0.0000 -11.3865   26.388  ?   ?    21.958   10.474      ?      ? 
1 1 1   17   35   17 o   25.373   7.2668   12.139   10.856   26.766   20.432   6.3852   12.814   30.051   11.611   20.696   8.7412 9.355877 14.53370 
1 1 1   17   35   18 o   30.342   7.5896   20.714   10.978   44.854   21.421   12.117   12.784   37.520   12.136   23.164   9.1169 14.35641 15.17926 
1 1 1   17   36    0 o   12.057   5.5737   0.0152   9.6634   0.0152   9.6634   0.0152   9.6634   12.057   7.8824   12.057   7.8824 0.000000 0.000000 
1 1 1   17   36    1 o   16.040   4.9805  -1.4949   6.7304 -10.6736   10.839   4.2647   8.5862   14.207   6.7589   17.873   7.3171 -3.666667 9.961058 
1 1 1   17   36    2 o   33.613   5.5887   26.347   7.4034   33.245   12.383   22.510   9.2359   36.655   8.3740   30.571   7.4035 6.084106 11.17748 
1 1 1   17   36    3 o   32.247   5.2433   29.010   7.6183   8.0891   13.068   39.780   9.3763   22.001   9.0193   42.493   5.3499 -20.49234 10.48663 
1 1 1   17   36    4 o   22.567   5.6050   4.5999   6.9236   25.084   12.707  -4.0491   8.2569   31.239   9.2252   13.896   6.3688 17.34282 11.21008 
1 1 1   17   36    5 o   26.982   7.1000   16.537   8.2481   14.343   25.325   16.797   8.7237   27.638   11.991   26.326   7.6066 1.311804 14.20008 
1 1 1   17   36    6 o   36.416   7.0556   36.277   8.8939   28.674   26.725   37.224   9.4315   31.860   12.961   40.971   5.5813 -9.111607 14.11130 
1 1 1   17   36    7 o   32.751   7.6659   31.201   13.532   40.875   16.471   11.104   23.739   39.165   10.123   26.338   11.515 12.82703 15.33188 
1 1 1   17   36    8 o   27.905   6.8253   20.078   10.227   9.9266   16.201   26.803   13.186   23.761   9.9190   32.049   9.3783 -8.288134 13.65063 
1 1 1   17   36    9 o   32.218   7.2866   27.424   10.605   32.403   17.779   24.673   13.213   33.804   11.064   30.632   9.4847 3.172295 14.57325 
1 1 1   17   36   10 o   16.712   5.5970 -11.1509   10.047  -5.9184   15.649 -14.8205   13.105   18.519   8.5875   14.905   7.1806 3.613852 11.19398 
1 1 1   17   36   11 o   34.437   7.3618   30.667   10.861   43.371   18.968   24.471   13.248   38.622   11.233   30.252   9.5186 8.370119 14.72359 
1 1 1   17   36   12 o   31.878   7.5502   28.728   11.478   30.524   18.746   27.651   14.518   32.099   11.346   31.658   9.9648 0.4407673 15.10045 
1 1 1   17   36   13 o   19.126   6.1636  -1.0943   10.190  -2.9775   18.009  -0.2074   12.359   20.192   9.3101   18.059   8.0797 2.132963 12.32716 
1 1 1   17   36   14 o   24.289   6.9813   8.8316   10.550   26.531   18.855   0.7651   12.729   30.023   11.259   18.555   8.2577 11.46797 13.96260 
1 1 1   17   36   15 o   20.725   6.4581   3.9099   10.678  -5.6379   19.382   8.0714   12.796   20.119   9.4056   21.332   8.8524 -1.212690 12.91625 
1 1 1   17   37    0 o   15.892   6.9812   6.1166   12.996   6.1166   12.996   6.1166   12.996   15.892   9.8728   15.892   9.8728 0.000000 0.000000 
1 1 1   17   37    1 o   38.383   7.4447   47.778   14.019   56.864   15.979   17.413   29.213   48.452   7.9962   28.315   12.560 20.13795 14.88938 
1 1 1   17   37    2 o   17.357   5.9601 -14.4642   11.658  -7.8021   12.919 -43.6940   27.060   16.323   7.6462   18.392   9.1448 -2.068722 11.92022 
1 1 1   17   37    3 o   34.811   8.4347   37.829   14.450   39.803   16.479   31.258   30.063   37.968   10.274   31.654   13.380 6.313435 16.86950 
1 1 1   17   37    4 o   20.035   6.8312 -10.8396   12.844 -12.2038   14.318  -5.2210   29.058   16.207   7.7265   23.863   11.268 -7.655952 13.66239 
1 1 1   17   37    5 f   29.224   12.852   22.111   29.957   0.0000   0.0000   22.111   29.957  ?   ?    29.224   12.852      ?      ? 
1 1 1   17   37    6 o   34.161   8.9387   31.630   14.792   23.447   16.998   57.158   30.024   29.012   10.728   39.311   14.301 -10.29865 17.87745 
1 1 1   17   37    7 o   36.029   8.4386   42.864   15.010   46.131   16.905   30.686   32.634   40.994   10.071   31.064   13.543 9.930550 16.87711 
1 1 1   17   37    8 o   23.180   7.3144   3.5046   13.012  -2.6927   15.541   18.040   23.800   19.065   8.7380   27.295   11.732 -8.229986 14.62883 
1 1 1   17   37    9 o   46.436   6.7283   56.575   12.251   58.758   20.170   55.299   15.421   45.294   10.924   47.578   7.8585 -2.283493 13.45660 
1 1 1   17   37   10 o   24.168   6.6443   10.746   11.194  -9.4112   17.358   25.096   14.646   18.395   8.6929   29.941   10.051 -11.54594 13.28866 
1 1 1   17   37   11 o   23.959   6.9454   12.140   10.646   15.578   17.508   10.124   13.409   25.506   10.446   22.412   9.1561 3.093899 13.89081 
1 1 1   18    0    0 o  364.414   4.1239  2742.20   87.606  2742.20   87.606  2742.20   87.606  364.414   5.8321  364.414   5.8321 0.000000 0.000000 
1 1 1   18    0    1 o   41.135   3.9818   36.840   9.0458   36.840   9.0458   36.840   9.0458   41.135   5.6311   41.135   5.6311 0.000000 0.000000 
1 1 1   18    0    2 o   93.126   2.3164  179.572   12.547  179.572   12.547  179.572   12.547   93.126   3.2759   93.126   3.2759 0.000000 0.000000 
1 1 1   18    0    3 o  436.734   3.3137  3937.67   84.391  3937.67   84.391  3937.67   84.391  436.734   4.6863  436.734   4.6863 0.000000 0.000000 
1 1 1   18    0    4 o  154.708   2.1289  494.299   19.195  494.299   19.195  494.299   19.195  154.708   3.0108  154.708   3.0108 0.000000 0.000000 
1 1 1   18    0    5 o  340.086   2.7939  2387.44   55.405  2387.44   55.405  2387.44   55.405  340.086   3.9512  340.086   3.9512 0.000000 0.000000 
1 1 1   18    0    6 o  308.401   2.6386  1963.29   47.448  1963.29   47.448  1963.29   47.448  308.401   3.7315  308.401   3.7315 0.000000 0.000000 
1 1 1   18    0    7 o  624.619   4.4265  8060.53  161.234  8060.53  161.234  8060.53  161.234  624.619   6.2600  624.619   6.2600 0.000000 0.000000 
1 1 1   18    0    8 o   68.935   2.6271   98.904   10.493   98.904   10.493   98.904   10.493   68.935   3.7153   68.935   3.7153 0.000000 0.000000 
1 1 1   18    0    9 f   52.289   3.2429   57.723   9.7155   57.723   9.7155   57.723   9.7155   52.289   4.5862   52.289   4.5862 0.000000 0.000000 
1 1 1   18    0   10 o   93.629   2.3445  181.555   12.768  181.555   12.768  181.555   12.768   93.629   3.3156   93.629   3.3156 0.000000 0.000000 
1 1 1   18    0   11 o   14.667   6.4095   3.2211   10.810   3.2211   10.810   3.2211   10.810   14.667   9.0643   14.667   9.0643 0.000000 0.000000 
1 1 1   18    0   12 o   59.875   3.1799   75.255   10.962   75.255   10.962   75.255   10.962   59.875   4.4971   59.875   4.4971 0.000000 0.000000 
1 1 1   18    0   13 o  127.236   2.1608  334.601   16.015  334.601   16.015  334.601   16.015  127.236   3.0558  127.236   3.0558 0.000000 0.000000 
1 1 1   18    0   14 f  116.371   2.1917  280.010   14.853  280.010   14.853  280.010   14.853  116.371   3.0995  116.371   3.0995 0.000000 0.000000 
1 1 1   18    0   15 o  173.296   2.1652  620.237   21.870  620.237   21.870  620.237   21.870  173.296   3.0620  173.296   3.0620 0.000000 0.000000 
1 1 1   18    0   16 o   95.079   2.7382  187.531   15.128  187.531   15.128  187.531   15.128   95.079   3.8724   95.079   3.8724 0.000000 0.000000 
1 1 1   18    0   17 o  160.258   2.5462  530.890   23.774  530.890   23.774  530.890   23.774  160.258   3.6009  160.258   3.6009 0.000000 0.000000 
1 1 1   18    0   18 o   99.003   3.4495  203.933   19.810  203.933   19.810  203.933   19.810   99.003   4.8784   99.003   4.8784 0.000000 0.000000 
1 1 1   18    0   19 o  212.652   3.3884  935.582   41.980  935.582   41.980  935.582   41.980  212.652   4.7919  212.652   4.7919 0.000000 0.000000 
1 1 1   18    0   20 o  145.951   2.9855  440.987   25.368  440.987   25.368  440.987   25.368  145.951   4.2222  145.951   4.2222 0.000000 0.000000 
1 1 1   18    0   21 o   14.972   6.4811   3.8841   10.818   3.8841   10.818   3.8841   10.818   14.972   9.1657   14.972   9.1657 0.000000 0.000000 
1 1 1   18    0   22 o   91.089   2.9004  172.382   15.339  172.382   15.339  172.382   15.339   91.089   4.1018   91.089   4.1018 0.000000 0.000000 
1 1 1   18    0   23 o  134.493   2.5895  374.293   20.280  374.293   20.280  374.293   20.280  134.493   3.6620  134.493   3.6620 0.000000 0.000000 
1 1 1   18    0   24 o  193.756   2.5114  775.871   28.361  775.871   28.361  775.871   28.361  193.756   3.5516  193.756   3.5516 0.000000 0.000000 
1 1 1   18    0   25 o  156.642   3.2888  508.481   29.989  508.481   29.989  508.481   29.989  156.642   4.6511  156.642   4.6511 0.000000 0.000000 
1 1 1   18    0   26 o   20.583   7.8388   12.631   13.042   12.631   13.042   12.631   13.042   20.583   11.086   20.583   11.086 0.000000 0.000000 
1 1 1   18    0   27 o   52.734   4.6253   60.257   13.638   60.257   13.638   60.257   13.638   52.734   6.5411   52.734   6.5411 0.000000 0.000000 
1 1 1   18    0   28 o   25.287   7.7898   19.141   11.921   19.141   11.921   19.141   11.921   25.287   11.016   25.287   11.016 0.000000 0.000000 
1 1 1   18    0   29 o   44.409   5.7049   44.900   13.332   44.900   13.332   44.900   13.332   44.409   8.0679   44.409   8.0679 0.000000 0.000000 
1 1 1   18    0   30 o   97.693   6.4867  205.602   36.214  205.602   36.214  205.602   36.214   97.693   9.1736   97.693   9.1736 0.000000 0.000000 
1 1 1   18    0   31 o   15.071   6.5111   4.3109   10.869   4.3109   10.869   4.3109   10.869   15.071   9.2081   15.071   9.2081 0.000000 0.000000 
1 1 1   18    0   32 o   18.179   7.1846   9.6316   11.394   9.6316   11.394   9.6316   11.394   18.179   10.161   18.179   10.161 0.000000 0.000000 
1 1 1   18    0   33 o   56.828   4.9766   70.673   15.816   70.673   15.816   70.673   15.816   56.828   7.0380   56.828   7.0380 0.000000 0.000000 
1 1 1   18    0   34 o   13.877   6.3454   0.2236   12.055   0.2236   12.055   0.2236   12.055   13.877   8.9737   13.877   8.9737 0.000000 0.000000 
1 1 1   18    0   35 o   16.823   7.9107  -4.0912   20.804  -4.0912   20.804  -4.0912   20.804   16.823   11.187   16.823   11.187 0.000000 0.000000 
1 1 1   18    0   36 o   95.705   4.7008  195.370   25.951  195.370   25.951  195.370   25.951   95.705   6.6480   95.705   6.6480 0.000000 0.000000 
1 1 1   18    0   37 o   61.199   4.0801   80.554   14.267   80.554   14.267   80.554   14.267   61.199   5.7702   61.199   5.7702 0.000000 0.000000 
1 1 1   18    0   38 o   58.836   5.2201   76.780   17.150   76.780   17.150   76.780   17.150   58.836   7.3823   58.836   7.3823 0.000000 0.000000 
1 1 1   18    0   39 o   60.811   4.3096   80.280   14.934   80.280   14.934   80.280   14.934   60.811   6.0947   60.811   6.0947 0.000000 0.000000 
1 1 1   18    0   40 o   23.958   9.8954   18.751   23.016   18.751   23.016   18.751   23.016   23.958   13.994   23.958   13.994 0.000000 0.000000 
1 1 1   18    0   41 o   50.897   5.0772   58.582   14.209   58.582   14.209   58.582   14.209   50.897   7.1802   50.897   7.1802 0.000000 0.000000 
1 1 1   18    0   42 o   18.398   8.4825   3.1979   22.159   3.1979   22.159   3.1979   22.159   18.398   11.996   18.398   11.996 0.000000 0.000000 
1 1 1   18    0   43 o   14.701   7.3516 -24.1786   25.768 -24.1786   25.768 -24.1786   25.768   14.701   10.397   14.701   10.397 0.000000 0.000000 
1 1 1   18    0   44 o   17.263   8.3411  -6.7671   26.345  -6.7671   26.345  -6.7671   26.345   17.263   11.796   17.263   11.796 0.000000 0.000000 
1 1 1   18    1    0 o  257.962   2.4105  1373.54   36.256  1373.54   36.256  1373.54   36.256  257.962   3.4090  257.962   3.4090 0.000000 0.000000 
1 1 1   18    1    1 o  130.877   2.1186  353.172   11.431  339.555   15.935  367.608   16.408  128.280   3.0119  133.474   2.9805 -5.194656 4.237289 
1 1 1   18    1    2 o  454.989   3.4177  4275.51   64.132  4296.87   91.260  4254.68   90.143  456.109   4.8512  453.869   4.8154 2.239716 6.835368 
1 1 1   18    1    3 o  301.737   2.6100  1879.26   32.481  1876.35   45.803  1882.21   46.067  301.502   3.6833  301.971   3.6988 -0.4696350 5.219940 
1 1 1   18    1    4 o  185.520   2.1601  710.234   16.528  711.590   23.389  708.882   23.360  185.697   3.0537  185.344   3.0559 0.3537598 4.320138 
1 1 1   18    1    5 o  116.409   2.1591  279.642   10.366  282.973   14.684  276.333   14.636  117.101   3.0402  115.718   3.0666 1.382706 4.318261 
1 1 1   18    1    6 o  180.049   2.1559  668.991   16.010  672.070   22.655  665.919   22.627  180.463   3.0438  179.635   3.0540 0.8281250 4.311790 
1 1 1   18    1    7 o  182.150   2.1713  684.194   16.306  704.294   23.466  665.429   22.674  184.734   3.0799  179.565   3.0616 5.168640 4.342686 
1 1 1   18    1    8 f  125.939   2.1275  327.305   11.050  329.683   15.698  324.970   15.558  126.392   3.0113  125.485   3.0061 0.9064636 4.254920 
1 1 1   18    1    9 o   32.858   4.5417   23.110   5.9338   23.361   8.4700   22.868   8.3155   33.034   6.4480   32.683   6.3978 0.3514137 9.083481 
1 1 1   18    1   10 o   61.894   3.0460   79.198   7.6911   79.521   10.166   78.764   11.761   62.051   3.9725   61.738   4.6186 0.3123627 6.091933 
1 1 1   18    1   11 o  225.819   2.9489  1058.74   27.145  1090.43   36.064  1017.31   41.231  229.772   3.8055  221.865   4.5058 7.906662 5.897774 
1 1 1   18    1   12 o  265.385   4.8444  1456.16   53.025   0.0000   0.0000  1456.16   53.025  ?   ?   265.385   4.8444      ?      ? 
1 1 1   18    1   13 o  123.592   2.1665  314.585   11.031  333.404   16.053  297.751   15.183  127.085   3.0626  120.098   3.0651 6.987053 4.332936 
1 1 1   18    1   14 o  199.736   2.2379  823.607   18.435  817.874   26.031  829.376   26.112  199.038   3.1710  200.433   3.1586 -1.395538 4.475715 
1 1 1   18    1   15 o  239.121   2.3557  1180.46   23.229  1167.14   32.531  1194.31   33.181  237.747   3.3175  240.495   3.3452 -2.748611 4.711323 
1 1 1   18    1   16 o   96.371   3.1219  199.439   11.823  222.724   15.181  163.551   18.847  103.840   3.5447   88.903   5.1400 14.93642 6.243710 
1 1 1   18    1   17 o  314.565   3.1385  2045.58   40.714  2065.02   58.130  2026.87   57.042  316.028   4.4598  313.103   4.4171 2.925293 6.276991 
1 1 1   18    1   18 o  179.951   3.2050  669.737   23.787  663.118   33.639  676.357   33.641  179.059   4.5549  180.843   4.5102 -1.783722 6.410101 
1 1 1   18    1   19 o   90.908   2.9713  171.310   11.000  173.694   14.506  168.084   16.873   91.674   3.8365   90.141   4.5384 1.532356 5.942678 
1 1 1   18    1   20 o  162.724   2.4115  545.890   16.167  515.753   22.308  579.232   23.464  158.002   3.4231  167.446   3.3975 -9.443710 4.822957 
1 1 1   18    1   21 o  172.583   2.4270  615.209   17.272  631.275   24.656  599.727   24.204  174.796   3.4199  170.370   3.4446 4.426086 4.853964 
1 1 1   18    1   22 o  169.900   2.6630  596.690   18.660  595.300   26.491  598.059   26.289  169.702   3.7849  170.098   3.7473 -0.3967438 5.326096 
1 1 1   18    1   23 o   83.547   3.0635  144.365   10.554  148.360   15.097  140.546   14.760   84.677   4.3229   82.416   4.3421 2.261108 6.127061 
1 1 1   18    1   24 o  218.763   3.3312  983.901   29.642  950.229   38.541  1032.66   46.379  214.278   4.3609  223.248   5.0369 -8.969650 6.662442 
1 1 1   18    1   25 o   74.878   4.8851  116.771   15.080  116.297   20.998  117.276   21.670   74.731   6.8126   75.025   7.0032 -0.2931519 9.770152 
1 1 1   18    1   26 o   52.382   4.7552   57.355   10.084   72.279   14.633   43.860   13.915   58.945   6.0190   45.819   7.3633 13.12632 9.510365 
1 1 1   18    1   27 o  153.002   2.6412  484.665   16.664  486.024   23.367  483.259   23.772  153.226   3.6975  152.778   3.7726 0.4482574 5.282407 
1 1 1   18    1   28 o  126.742   2.7517  332.590   14.378  319.225   20.085  346.637   20.591  124.127   3.9232  129.357   3.8595 -5.229324 5.503378 
1 1 1   18    1   29 o   85.100   10.325  155.606   36.240  155.606   36.240   0.0000   0.0000   85.100   10.325  ?   ?       ?      ? 
1 1 1   18    1   30 o   57.199   4.6264   68.668   10.883   67.234   14.771   70.370   16.094   56.582   6.3295   57.816   6.7493 -1.233204 9.252857 
1 1 1   18    1   31 o   50.838   4.3209   54.375   9.0569   55.073   13.009   53.718   12.617   51.145   6.1671   50.531   6.0537 0.6138840 8.641812 
1 1 1   18    1   32 o   45.439   4.7994   43.900   8.9579   40.238   12.834   47.380   12.509   43.518   7.1504   47.360   6.4038 -3.842239 9.598747 
1 1 1   18    1   33 o   27.910   6.2949   16.761   8.3401   20.869   11.475   12.163   12.142   30.564   8.6909   25.256   9.1089 5.308599 12.58987 
1 1 1   18    1   34 o   41.988   5.4940   38.863   9.2208   48.442   13.318   30.044   12.779   47.579   6.7870   36.397   8.6414 11.18127 10.98804 
1 1 1   18    1   35 o   77.463   6.0191  131.200   19.089  152.822   27.645  111.497   26.390   83.821   7.9966   71.106   8.9984 12.71424 12.03814 
1 1 1   18    1   36 o   23.002   8.8363   8.7106   11.783   0.0000   0.0000   8.7106   11.783  ?   ?    23.002   8.8363      ?      ? 
1 1 1   18    1   37 o   97.690   4.1581  209.686   15.848  183.476   26.108  224.978   19.942   92.097   6.8733  103.283   4.6813 -11.18546 8.316116 
1 1 1   18    1   38 o   76.250   4.1110  123.883   12.774  129.587   19.816  119.827   16.709   77.545   6.1958   74.955   5.4049 2.590530 8.221933 
1 1 1   18    1   39 o   60.071   4.2745   78.123   10.558   84.169   14.843   71.933   15.020   62.557   5.7529   57.586   6.3238 4.971817 8.549068 
1 1 1   18    1   40 o   31.525   6.1684   22.746   8.8353   34.999   12.992   12.202   12.051   38.593   8.4004   24.458   9.0348 14.13461 12.33673 
1 1 1   18    1   41 o   33.163   6.3695   26.445   8.9864   31.468   13.188   22.090   12.278   36.075   8.9148   30.251   9.0998 5.824574 12.73897 
1 1 1   18    1   42 o   43.586   9.3538   55.845   18.420   59.764   23.216   49.185   30.261   46.990   11.951   40.181   14.392 6.808060 18.70756 
1 1 1   18    1   43 o   49.413   9.5017   71.222   20.971   45.745   28.361  101.953   31.148   38.640   13.923   60.186   12.933 -21.54602 19.00334 
1 1 1   18    1   44 o   23.878   7.8897  -7.8502   19.278 -19.7363   26.162   6.2707   28.516   21.223   10.204   26.534   12.036 -5.311434 15.77947 
1 1 1   18    2    0 o   56.171   3.0268   66.233   9.7845   66.233   9.7845   66.233   9.7845   56.171   4.2805   56.171   4.2805 0.000000 0.000000 
1 1 1   18    2    1 o  539.220   3.9105  6007.93   86.962  5977.85  122.079  6038.93  123.907  537.855   5.5031  540.585   5.5573 -2.730042 7.821035 
1 1 1   18    2    2 o  316.117   2.6738  2062.72   34.861  2070.00   49.483  2055.54   49.120  316.670   3.7886  315.563   3.7740 1.107208 5.347637 
1 1 1   18    2    3 o  229.537   2.2997  1087.25   21.770  1094.82   30.961  1079.84   30.618  230.327   3.2591  228.747   3.2453 1.580521 4.599310 
1 1 1   18    2    4 o   91.913   2.3052  174.401   8.7362  178.186   12.305  170.555   12.405   92.920   3.2108   90.907   3.3086 2.013557 4.610430 
1 1 1   18    2    5 o  211.417   2.2406  922.383   19.537  915.706   27.498  929.189   27.762  210.645   3.1651  212.189   3.1722 -1.544830 4.481169 
1 1 1   18    2    6 o  188.258   2.1748  731.399   16.886  734.492   23.928  728.331   23.834  188.655   3.0752  187.862   3.0760 0.7928772 4.349617 
1 1 1   18    2    7 o  186.764   2.1746  719.818   16.751  725.853   23.803  713.898   23.576  187.539   3.0773  185.989   3.0735 1.550644 4.349261 
1 1 1   18    2    8 o  381.010   3.0110  2998.18   47.316  3001.85   66.995  2994.52   66.835  381.242   4.2607  380.777   4.2556 0.4653931 6.021948 
1 1 1   18    2    9 o  143.264   2.1134  423.493   12.486  430.076   17.833  417.162   17.487  144.355   2.9953  142.172   2.9823 2.183304 4.226772 
1 1 1   18    2   10 o  193.967   2.6846  768.106   20.119  752.189   24.369  802.179   35.655  190.893   3.0952  197.041   4.3872 -6.147614 5.369165 
1 1 1   18    2   11 o  181.964   2.7794  685.350   20.576  692.640   27.042  675.327   31.708  183.141   3.5800  180.786   4.2525 2.354691 5.558792 
1 1 1   18    2   12 o  138.112   3.0179  393.760   17.191   0.0000   0.0000  393.760   17.191  ?   ?   138.112   3.0179      ?      ? 
1 1 1   18    2   13 o  217.358   2.4296  975.279   21.593  977.558   32.776  973.531   28.702  217.564   3.6526  217.152   3.2047 0.4121857 4.859179 
1 1 1   18    2   14 o   52.187   3.0364   56.319   6.5283   53.243   9.2304   59.398   9.2343   50.757   4.4092   53.617   4.1758 -2.859402 6.072738 
1 1 1   18    2   15 o  100.167   2.6195  207.023   10.780  209.777   16.015  204.741   14.577  100.769   3.8533   99.565   3.5496 1.203529 5.239074 
1 1 1   18    2   16 o  113.684   2.6084  266.865   12.226  271.753   17.575  262.281   17.019  114.690   3.7154  112.677   3.6622 2.013412 5.216883 
1 1 1   18    2   17 o  142.608   3.4062  443.118   18.468  357.903   31.342  488.441   22.857  131.449   5.7810  153.768   3.6041 -22.31894 6.812470 
1 1 1   18    2   18 o   47.797   4.1645   46.966   8.1607   54.870   12.102   40.374   11.052   51.463   5.7014   44.132   6.0718 7.331661 8.329001 
1 1 1   18    2   19 o  248.347   3.3540  1292.85   33.397  1354.28   43.086  1200.40   52.858  255.942   4.0816  240.752   5.3232 15.18990 6.707938 
1 1 1   18    2   20 f  221.782   2.4634  1016.19   22.533  1028.71   31.994  1003.87   31.739  223.138   3.4764  220.426   3.4912 2.712311 4.926813 
1 1 1   18    2   21 o  162.279   2.4178  543.971   16.181  554.109   23.095  534.197   22.676  163.764   3.4193  160.794   3.4193 2.969391 4.835610 
1 1 1   18    2   22 o  188.837   2.4663  736.868   19.208  737.891   27.109  735.837   27.221  188.970   3.4782  188.704   3.4974 0.2652740 4.932551 
1 1 1   18    2   23 o  126.768   2.7091  331.837   14.140  325.219   19.357  339.410   20.705  125.422   3.7419  128.114   3.9184 -2.691666 5.418107 
1 1 1   18    2   24 o  106.660   2.8280  235.107   12.435  228.508   17.273  242.207   17.916  105.108   3.9843  108.211   4.0144 -3.102539 5.655980 
1 1 1   18    2   25 o  165.469   5.7739  584.837   31.424  593.292   35.259  552.195   69.282  169.155   5.0539  161.782   10.383 7.372375 11.54773 
1 1 1   18    2   26 o  121.736   3.2170  292.291   15.275  352.773   27.307  264.747   18.428  130.382   5.0780  113.089   3.9509 17.29261 6.433993 
1 1 1   18    2   27 o   44.653   5.4499   43.545   9.4960   28.510   13.326   59.058   13.536   36.077   8.9885   53.230   6.1653 -17.15253 10.89978 
1 1 1   18    2   28 o   43.379   5.3573   41.182   9.1415   30.725   13.221   50.761   12.654   37.437   8.7238   49.320   6.2207 -11.88240 10.71456 
1 1 1   18    2   29 o   31.999   6.2783   22.284   9.2389   10.382   13.440   32.946   12.721   25.240   9.4980   38.757   8.2131 -13.51708 12.55654 
1 1 1   18    2   30 o   96.153   3.4190  193.338   13.430  197.456   17.918  188.058   20.289   97.402   4.4601   94.903   5.1833 2.498604 6.838060 
1 1 1   18    2   31 o   95.592   3.0676  190.268   12.090  197.158   17.377  183.804   16.831   97.270   4.3314   93.915   4.3451 3.354881 6.135270 
1 1 1   18    2   32 o  111.612   4.1739  261.885   19.105  264.983   28.646  259.403   25.641  112.091   6.1962  111.133   5.5940 0.9582138 8.347759 
1 1 1   18    2   33 o   20.397   6.4068  -2.5560   9.1696   0.1440   19.029  -3.3725   10.465   24.019   10.407   16.776   7.4751 7.242954 12.81365 
1 1 1   18    2   34 o   88.473   4.1356  175.731   13.822  195.969   17.137  138.060   23.381   96.753   4.2944   80.193   7.0689 16.55949 8.271099 
1 1 1   18    2   35 o   51.419   6.7426   64.055   12.397   49.381   22.682   70.305   14.803   45.401   11.950   57.437   6.2487 -12.03507 13.48518 
1 1 1   18    2   36 o   95.125   3.3781  189.691   13.186  199.607   19.857  181.870   17.635   97.264   4.9499   92.986   4.5983 4.277603 6.756160 
1 1 1   18    2   37 o   21.469   6.0891   5.9513   8.2591   3.6172   12.125   7.9717   11.281   20.682   8.6029   22.256   8.6198 -1.574238 12.17829 
1 1 1   18    2   38 o   34.366   6.3588   27.983   9.1524   23.939   13.913   31.067   12.152   31.984   9.7013   36.748   8.2231 -4.763706 12.71754 
1 1 1   18    2   39 o   54.069   4.6847   62.959   10.342   51.887   13.875   76.797   15.512   48.656   6.9142   59.482   6.3230 -10.82653 9.369447 
1 1 1   18    2   40 o   39.000   6.2996   35.679   9.8882   42.613   14.966   30.308   13.173   42.421   8.8407   35.580   8.9769 6.840923 12.59926 
1 1 1   18    2   41 o   41.963   5.6188   40.822   9.4972   46.095   13.514   35.676   13.350   45.299   7.2330   38.626   8.6005 6.672977 11.23767 
1 1 1   18    2   42 o   45.986   6.3240   75.375   12.857   97.589   14.523  -5.1226   27.646   67.050   5.2515   24.921   11.506 42.12914 12.64791 
1 1 1   18    2   43 o   24.596   7.9754  -7.3828   19.041 -27.3692   26.653   13.452   27.212   20.715   10.043   28.477   12.392 -7.762632 15.95086 
1 1 1   18    2   44 o   33.414   9.3063   32.075   20.715   49.209   27.111   8.0399   32.111   39.130   13.659   27.699   12.644 11.43084 18.61267 
1 1 1   18    2   45 o   32.213   13.708   32.448   31.909   0.0000   0.0000   32.448   31.909  ?   ?    32.213   13.708      ?      ? 
1 1 1   18    3    0 o  191.626   2.1862  758.094   24.421  758.094   24.421  758.094   24.421  191.626   3.0917  191.626   3.0917 0.000000 0.000000 
1 1 1   18    3    1 f  496.832   3.6595  5099.79   74.988  5104.65  106.205  5094.96  105.894  497.067   5.1804  496.596   5.1701 0.4702759 7.318925 
1 1 1   18    3    2 o  319.157   2.6892  2102.61   35.397  2091.73   49.759  2113.75   50.365  318.323   3.7900  319.991   3.8162 -1.668579 5.378377 
1 1 1   18    3    3 o  174.493   2.1496  628.250   15.470  620.035   21.756  636.651   22.001  173.339   3.0431  175.647   3.0370 -2.307587 4.299290 
1 1 1   18    3    4 o  326.329   2.7260  2198.33   36.688  2185.75   51.576  2211.22   52.198  325.385   3.8432  327.273   3.8670 -1.888275 5.451961 
1 1 1   18    3    5 o   74.839   2.4851  115.669   7.6669  118.250   10.754  113.001   10.933   75.690   3.4448   73.988   3.5829 1.701790 4.970264 
1 1 1   18    3    6 o  300.369   2.5969  1862.45   32.170  1872.63   45.735  1852.48   45.259  301.180   3.6818  299.557   3.6632 1.622925 5.193716 
1 1 1   18    3    7 o  177.827   2.1467  652.608   15.745  654.066   22.333  651.166   22.200  178.025   3.0416  177.630   3.0302 0.3945770 4.293415 
1 1 1   18    3    8 o   63.673   2.7309   83.716   7.1693   80.896   10.101   86.579   10.177   62.591   3.9127   64.755   3.8107 -2.163403 5.461729 
1 1 1   18    3    9 o  324.420   2.7213  2173.35   36.412  2181.63   51.721  2165.22   51.271  325.032   3.8581  323.809   3.8390 1.223083 5.442691 
1 1 1   18    3   10 o  194.647   2.6720  777.315   20.198  767.396   24.630  797.680   35.292  192.810   3.0972  196.483   4.3549 -3.673645 5.344007 
1 1 1   18    3   11 o  313.781   3.4304  2037.78   43.660  2047.43   56.884  2023.94   68.111  314.760   4.3817  312.802   5.2794 1.958771 6.860896 
1 1 1   18    3   12 o  185.622   2.6655  707.636   19.234  723.654   33.512  699.768   23.488  187.133   4.3419  184.112   3.0932 3.020950 5.331039 
1 1 1   18    3   13 o   46.719   3.5097   45.541   6.6821   41.996   10.022   48.379   8.9661   45.056   5.3929   48.382   4.4932 -3.326305 7.019430 
1 1 1   18    3   14 o   90.904   2.3225  170.497   8.7029  162.718   12.146  178.703   12.476   88.774   3.3174   93.034   3.2514 -4.260368 4.645020 
1 1 1   18    3   15 o  128.485   2.3081  338.303   11.880  351.587   19.419  330.356   15.019  130.467   3.6087  126.503   2.8785 3.963745 4.616170 
1 1 1   18    3   16 o   83.800   2.6287  143.047   8.8278  153.499   14.513  136.908   11.122   86.180   4.0829   81.420   3.3120 4.760040 5.257334 
1 1 1   18    3   17 o  339.430   3.3093  2377.06   46.183  2453.03   68.512  2313.78   62.523  344.359   4.8238  334.502   4.5318 9.856354 6.618656 
1 1 1   18    3   18 o  107.297   2.6846  237.516   11.850  243.219   17.478  232.665   16.121  108.480   3.9063  106.114   3.6835 2.366989 5.369135 
1 1 1   18    3   19 o  218.969   2.6704  985.305   23.762  959.403   30.874  1022.95   37.218  215.495   3.4737  222.444   4.0567 -6.948593 5.340702 
1 1 1   18    3   20 o  181.675   2.4061  681.841   18.028  690.668   25.596  673.152   25.396  182.843   3.3942  180.508   3.4112 2.335114 4.812143 
1 1 1   18    3   21 o   49.653   4.8110   53.408   9.3013   63.042   12.582   41.797   13.812   55.153   5.5311   44.153   7.8733 10.99942 9.621958 
1 1 1   18    3   22 o  189.185   2.6137  736.805   20.260  764.734   30.696  715.248   26.968  192.328   3.8697  186.042   3.5146 6.285919 5.227484 
1 1 1   18    3   23 o   41.772   5.2921   37.196   8.7962   46.865   12.676   28.217   12.216   47.491   6.4716   36.053   8.3753 11.43761 10.58427 
1 1 1   18    3   24 o  102.548   2.8545  217.488   12.066  228.053   17.206  207.265   16.926  105.003   3.9729  100.093   4.0999 4.909752 5.709037 
1 1 1   18    3   25 o   65.989   5.1586   89.163   12.069   87.588   13.836   94.179   24.683   64.981   5.1623   66.996   8.9328 -2.014214 10.31716 
1 1 1   18    3   26 o   64.021   4.9249   92.875   11.622   67.243   20.017  105.910   14.275   56.587   8.5766   71.455   4.8436 -14.86883 9.849768 
1 1 1   18    3   27 o  134.138   2.8408  371.919   15.570  378.955   23.794  366.649   20.591  135.206   4.2668  133.071   3.7517 2.134964 5.681556 
1 1 1   18    3   28 o   57.410   4.1523   68.703   9.8300   69.085   14.066   68.337   13.743   57.561   5.9248   57.260   5.8192 0.3013420 8.304630 
1 1 1   18    3   29 o  220.080   4.0327  1005.52   36.605   0.0000   0.0000  1005.52   36.605  ?   ?   220.080   4.0327      ?      ? 
1 1 1   18    3   30 o   16.503   5.3265  -6.9150   8.0217  -7.2304   11.934  -6.6550   10.834   16.905   7.7137   16.100   7.3475 0.8054008 10.65298 
1 1 1   18    3   31 o   94.016   3.9907  187.195   15.208  175.856   23.368  195.527   20.031   91.350   6.2022   96.681   5.0234 -5.330658 7.981343 
1 1 1   18    3   32 o   67.965   3.6927   96.878   10.277  112.278   14.772   82.433   14.307   73.271   4.8883   62.659   5.5362 10.61193 7.385417 
1 1 1   18    3   33 o   52.049   4.4516   58.287   9.4003   47.589   13.508   68.335   13.090   47.194   6.9395   56.904   5.5775 -9.710796 8.903105 
1 1 1   18    3   34 o   34.124   6.2370   29.774   10.653   42.693   12.595  -2.7055   19.970   44.646   6.8400   23.603   10.432 21.04238 12.47403 
1 1 1   18    3   35 f   58.715   4.2784   74.304   9.9679   50.776   13.833   99.715   14.376   48.643   6.8951   68.786   5.0671 -20.14373 8.556755 
1 1 1   18    3   36 o   21.626   5.9017   6.1886   7.8472  -0.4239   11.141   12.700   11.055   18.338   7.9546   24.913   8.7204 -6.574547 11.80346 
1 1 1   18    3   37 o   48.432   4.7337   50.525   9.4272   45.370   13.035   56.177   13.650   45.779   6.9038   51.085   6.4785 -5.306072 9.467494 
1 1 1   18    3   38 o   50.233   4.5799   54.731   9.4677   51.616   13.536   57.714   13.247   48.734   6.7345   51.731   6.2087 -2.997448 9.159781 
1 1 1   18    3   39 o   48.502   5.0999   52.093   10.141   54.173   13.818   49.665   14.929   49.759   6.7331   47.245   7.6616 2.513828 10.19973 
1 1 1   18    3   40 o   17.245   5.4115  -3.3822   7.8909   2.8457   11.304  -9.3013   11.020   19.457   8.2135   15.032   7.0481 4.424540 10.82302 
1 1 1   18    3   41 o   33.672   6.1816   31.341   11.813   47.797   13.692 -16.5905   23.368   46.109   7.1997   21.235   10.051 24.87404 12.36325 
1 1 1   18    3   42 o   26.134   7.7041   10.750   11.417   9.5852   12.672   15.777   26.320   22.961   9.0641   29.306   12.460 -6.345200 15.40812 
1 1 1   18    3   43 o   31.735   9.4824   22.869   21.169   35.809   32.742   13.576   27.748   34.914   14.290   28.555   12.468 6.358351 18.96480 
1 1 1   18    3   44 o   23.501   8.0193 -22.8936   23.868 -88.2543   48.355  -1.8397   27.444   22.374   11.278   24.627   11.403 -2.253098 16.03860 
1 1 1   18    3   45 o   29.451   13.072   21.054   31.693   0.0000   0.0000   21.054   31.693  ?   ?    29.451   13.072      ?      ? 
1 1 1   18    4    0 o  317.721   2.6846  2083.72   49.735  2083.72   49.735  2083.72   49.735  317.721   3.7966  317.721   3.7966 0.000000 0.000000 
1 1 1   18    4    1 o   96.051   2.2523  190.395   8.9227  189.632   12.610  191.160   12.627   95.858   3.1895   96.244   3.1810 -0.3854218 4.504649 
1 1 1   18    4    2 o  157.006   2.1270  508.654   13.773  504.751   19.366  512.650   19.593  156.397   3.0022  157.615   3.0139 -1.218536 4.254029 
1 1 1   18    4    3 o  205.977   2.2198  875.516   18.857  871.198   26.494  879.950   26.845  205.463   3.1264  206.491   3.1521 -1.028244 4.439638 
1 1 1   18    4    4 o  300.609   2.6010  1865.45   32.249  1870.63   45.694  1860.31   45.520  301.024   3.6804  300.194   3.6765 0.8308105 5.202087 
1 1 1   18    4    5 o  357.069   2.8798  2632.15   42.402  2606.47   59.238  2659.13   60.720  355.287   4.0425  358.852   4.1025 -3.564270 5.759603 
1 1 1   18    4    6 o  273.297   2.4753  1541.82   27.902  1540.26   39.371  1543.39   39.548  273.159   3.4946  273.435   3.5067 -0.2762756 4.950670 
1 1 1   18    4    7 o  197.833   2.2025  807.636   17.970  819.072   25.609  796.543   25.221  199.213   3.1168  196.454   3.1127 2.758636 4.404930 
1 1 1   18    4    8 o  292.388   2.5660  1765.01   30.943  1757.11   43.586  1773.04   43.937  291.728   3.6225  293.047   3.6352 -1.318024 5.131958 
1 1 1   18    4    9 o   58.634   3.0498   71.676   7.2917   76.437   9.8158   65.814   10.892   60.836   3.9120   56.432   4.6798 4.403988 6.099530 
1 1 1   18    4   10 o  196.431   2.6635  801.926   20.556  813.748   25.556  780.257   34.599  198.541   3.1208  194.320   4.3170 4.221207 5.326914 
1 1 1   18    4   11 f  247.716   2.7555  1266.74   28.141  1294.50   40.531  1240.91   39.102  250.332   3.9256  245.101   3.8680 5.230865 5.511065 
1 1 1   18    4   12 o  169.879   2.3407  596.918   16.239  587.999   24.662  603.745   21.577  168.742   3.5436  171.016   3.0591 -2.274185 4.681374 
1 1 1   18    4   13 o  163.202   2.2776  551.513   15.248  532.779   22.557  567.274   20.691  160.631   3.4048  165.772   3.0262 -5.140610 4.555263 
1 1 1   18    4   14 o  157.636   2.2927  514.906   14.805  495.628   22.029  530.790   19.995  154.922   3.4475  160.349   3.0233 -5.426483 4.585398 
1 1 1   18    4   15 o  179.420   2.3194  666.567   16.698  656.915   26.831  672.669   21.333  178.328   3.6479  180.512   2.8654 -2.184097 4.638730 
1 1 1   18    4   16 o   25.119   5.8308   12.642   6.7206   10.699   12.056   13.517   8.0952   24.972   9.0656   25.265   7.3354 -0.2929306 11.66161 
1 1 1   18    4   17 o  244.138   3.1864  1230.04   31.605  1218.21   41.187  1246.97   49.286  242.770   4.1134  245.506   4.8674 -2.736465 6.372743 
1 1 1   18    4   18 o  153.415   2.4941  486.102   15.742  488.445   23.125  484.079   21.489  153.749   3.6468  153.080   3.4035 0.6693115 4.988269 
1 1 1   18    4   19 o  176.494   5.2852  645.103   38.473   0.0000   0.0000  645.103   38.473  ?   ?   176.494   5.2852      ?      ? 
1 1 1   18    4   20 o  228.736   3.4508  1063.41   31.077  1020.00   38.228  1148.01   53.365  222.093   4.1733  235.380   5.4970 -13.28665 6.901698 
1 1 1   18    4   21 o  247.093   2.5552  1261.75   26.040  1269.39   36.918  1254.19   36.736  247.838   3.6116  246.348   3.6156 1.489334 5.110414 
1 1 1   18    4   22 o  322.541   2.8572  2150.94   38.003  2174.19   54.336  2128.69   53.171  324.241   4.0630  320.840   4.0181 3.400879 5.714335 
1 1 1   18    4   23 o   38.121   5.4666   31.393   8.4955   46.883   12.279   17.169   11.767   47.509   6.2662   28.734   8.9593 18.77593 10.93319 
1 1 1   18    4   24 o  103.687   3.9277  231.376   15.104  243.478   18.082  203.438   27.474  108.486   4.0412   98.887   6.7361 9.598709 7.855359 
1 1 1   18    4   25 o   37.135   6.3834   33.201   10.447   10.627   17.948   44.769   12.848   27.912   10.855   46.357   6.7197 -18.44574 12.76672 
1 1 1   18    4   26 o  187.952   2.9738  732.896   22.838  723.599   34.628  740.055   30.384  186.835   4.4936  189.069   3.8963 -2.233429 5.947624 
1 1 1   18    4   27 o   83.340   3.3270  145.249   11.340  133.097   16.699  155.648   15.447   80.040   5.0586   86.641   4.3227 -6.601730 6.653945 
1 1 1   18    4   28 o   89.424   5.5807  195.738   15.843  124.314   32.427  218.135   18.158   76.312   10.303  102.535   4.2937 -26.22327 11.16143 
1 1 1   18    4   29 o   63.302   3.8305   83.612   9.9976   86.538   14.325   80.834   13.959   64.384   5.3946   62.220   5.4396 2.164261 7.660982 
1 1 1   18    4   30 o   28.470   6.1244   17.081   8.2324   9.5107   11.798   24.265   11.493   23.833   8.9124   33.107   8.4025 -9.273315 12.24878 
1 1 1   18    4   31 o  107.472   3.2168  243.059   14.027  253.644   18.504  228.760   21.508  110.374   4.0648  104.570   4.9869 5.804878 6.433599 
1 1 1   18    4   32 o   76.130   3.3273  121.184   10.437  127.328   14.757  115.036   14.763   78.088   4.5821   74.172   4.8258 3.915283 6.654592 
1 1 1   18    4   33 o   58.406   5.9589   81.459   11.741   62.005   22.193   89.019   13.835   51.780   10.744   65.031   5.1582 -13.25162 11.91776 
1 1 1   18    4   34 o   54.137   6.8502   70.317   11.993   73.670   13.595   58.555   25.467   59.006   5.5862   49.268   12.510 9.737663 13.70037 
1 1 1   18    4   35 o   64.142   3.8623   87.182   10.187   79.953   14.452   94.322   14.363   61.421   5.7047   66.863   5.2082 -5.441769 7.724553 
1 1 1   18    4   36 o   27.836   6.8648   16.471   10.709  -5.6592   20.714   24.545   12.511   23.023   10.367   32.649   9.0009 -9.625841 13.72954 
1 1 1   18    4   37 o   54.324   4.8751   61.868   10.745   77.191   17.119   51.909   13.801   59.672   6.9559   48.976   6.8325 10.69650 9.750228 
1 1 1   18    4   38 o   37.126   6.0822   31.997   9.1299   31.681   13.070   32.297   12.759   36.893   8.7262   37.359   8.4751 -0.4662628 12.16444 
1 1 1   18    4   39 o   16.914   5.3713  -3.7750   7.8616  -6.7611   11.154  -0.8272   11.082   15.933   7.3394   17.895   7.8447 -1.962220 10.74268 
1 1 1   18    4   40 o   45.522   5.4319   48.007   9.6861   60.582   13.641   35.219   13.756   52.619   6.2857   38.425   8.8608 14.19373 10.86382 
1 1 1   18    4   41 o   27.303   7.1255   17.329   10.633   21.678   11.950   0.8094   23.292   29.897   8.9740   24.709   11.071 5.187553 14.25108 
1 1 1   18    4   42 o   27.195   7.1569   17.243   11.550   24.124   12.807 -12.7425   26.734   31.206   9.2727   23.183   10.904 8.022354 14.31384 
1 1 1   18    4   43 o   38.955   8.9714   41.628   17.517   22.744   23.135   67.002   26.817   30.309   12.154   47.601   13.199 -17.29176 17.94274 
1 1 1   18    4   44 f   32.981   10.334   30.063   25.656   33.960   53.422   28.894   29.250   33.936   15.781   32.026   13.345 1.909924 20.66719 
1 1 1   18    4   45 o   31.415   10.131   7.7256   24.403   86.302   50.349 -16.3999   27.899   40.950   17.313   21.879   10.525 19.07104 20.26114 
1 1 1   18    5    0 o  104.404   2.2212  225.479   13.499  225.479   13.499  225.479   13.499  104.404   3.1413  104.404   3.1413 0.000000 0.000000 
1 1 1   18    5    1 o  124.344   2.1328  319.033   10.937  316.249   15.356  321.899   15.581  123.793   3.0077  124.894   3.0247 -1.100525 4.265531 
1 1 1   18    5    2 o  234.425   2.3191  1134.22   22.422  1131.45   31.651  1137.01   31.769  234.138   3.2776  234.712   3.2817 -0.5738678 4.638141 
1 1 1   18    5    3 o  120.394   2.1507  299.108   10.679  303.584   15.170  294.712   15.036  121.287   3.0325  119.501   3.0506 1.785973 4.301398 
1 1 1   18    5    4 o  496.919   3.6621  5102.36   75.042  5066.33  105.019  5139.95  107.269  495.134   5.1425  498.703   5.2151 -3.569336 7.324158 
1 1 1   18    5    5 o  118.562   2.1453  290.011   10.489  283.390   14.693  296.892   14.979  117.182   3.0401  119.942   3.0279 -2.759377 4.290697 
1 1 1   18    5    6 o  434.307   3.3021  3895.97   59.134  3857.74   82.529  3936.31   84.772  432.125   4.6305  436.490   4.7088 -4.364777 6.604154 
1 1 1   18    5    7 o  354.461   2.8693  2594.80   41.947  2594.84   59.293  2594.76   59.352  354.464   4.0557  354.457   4.0598 0.6286621E-02 5.738530 
1 1 1   18    5    8 o  100.189   2.2204  207.171   9.1746  204.244   12.894  210.173   13.058   99.472   3.1428  100.906   3.1375 -1.433601 4.440822 
1 1 1   18    5    9 o  108.443   2.3213  241.730   10.304  234.643   13.664  251.072   15.688  106.614   3.1074  110.271   3.4494 -3.656319 4.642607 
1 1 1   18    5   10 o  155.831   2.5666  504.444   15.665  511.066   19.397  492.026   26.561  157.347   2.9889  154.316   4.1732 3.030685 5.133116 
1 1 1   18    5   11 o  161.751   2.3247  540.562   15.347  537.583   23.428  542.801   20.312  161.347   3.5205  162.156   3.0370 -0.8092041 4.649456 
1 1 1   18    5   12 o   90.237   2.5267  168.479   9.2927  165.985   14.225  170.336   12.274   89.643   3.8474   90.830   3.2763 -1.187431 5.053326 
1 1 1   18    5   13 o   88.608   2.6234  162.038   9.5811  153.853   13.367  170.686   13.740   86.307   3.7552   90.909   3.6645 -4.602356 5.246874 
1 1 1   18    5   14 o  135.097   2.7109  376.780   14.703  378.221   23.702  375.878   18.747  135.280   4.2480  134.914   3.3690 0.3652802 5.421790 
1 1 1   18    5   15 o  208.234   2.7755  900.085   22.615  883.021   38.477  909.091   27.953  206.651   4.5144  209.816   3.2302 -3.164902 5.550994 
1 1 1   18    5   16 o  129.264   2.7032  345.883   13.325  343.574   23.905  346.923   16.050  128.903   4.4963  129.625   3.0021 -0.7225494 5.406450 
1 1 1   18    5   17 o  144.597   2.7294  429.282   15.860  419.999   20.164  444.344   25.684  142.593   3.4286  146.602   4.2477 -4.009552 5.458765 
1 1 1   18    5   18 o  238.757   2.5019  1176.84   24.627  1145.68   34.214  1210.33   35.475  235.482   3.5227  242.032   3.5537 -6.549744 5.003825 
1 1 1   18    5   19 o  159.827   2.7982  530.367   18.361  562.896   25.323  494.309   26.662  165.039   3.7202  154.615   4.1809 10.42424 5.596418 
1 1 1   18    5   20 o  212.938   3.0433  937.731   26.165  937.258   33.719  938.447   41.480  212.935   3.8394  212.941   4.7229 -0.5706787E-02 6.086601 
1 1 1   18    5   21 o  236.015   2.9474  1152.33   28.571  1148.45   42.346  1155.57   38.709  235.619   4.3575  236.411   3.9699 -0.7918243 5.894751 
1 1 1   18    5   22 o  144.690   2.5297  432.710   15.093  419.912   21.271  445.686   21.419  142.531   3.6184  146.848   3.5364 -4.316757 5.059495 
1 1 1   18    5   23 o   54.974   4.0099   62.644   9.0835   66.525   13.030   58.973   12.670   56.634   5.5781   53.313   5.7620 3.321529 8.019712 
1 1 1   18    5   24 o  144.782   3.3138  417.929   17.788  398.526   20.762  471.474   34.490  138.830   3.6259  150.734   5.5477 -11.90414 6.627539 
1 1 1   18    5   25 o  127.924   3.2323  343.708   16.692  365.180   21.909  313.998   25.771  132.824   3.9993  123.024   5.0790 9.799286 6.464547 
1 1 1   18    5   26 o  154.225   2.9465  489.666   18.137  505.053   29.871  480.681   22.826  156.047   4.6412  152.404   3.6314 3.642624 5.893052 
1 1 1   18    5   27 o  238.557   2.9222  1179.49   28.751  1181.53   40.829  1177.49   40.494  238.757   4.1462  238.357   4.1191 0.4003754 5.844453 
1 1 1   18    5   28 f   59.187   4.5333   73.080   10.777   74.296   17.389   72.321   13.733   59.490   7.0872   58.883   5.6546 0.6068039 9.066589 
1 1 1   18    5   29 f   32.624   5.9655   23.614   8.2638   16.984   11.891   29.807   11.493   28.374   9.0280   36.875   7.8002 -8.501085 11.93103 
1 1 1   18    5   30 o   57.983   4.2435   72.326   9.8230   52.627   14.059   91.112   13.730   49.924   6.8279   66.041   5.0407 -16.11650 8.487032 
1 1 1   18    5   31 o  105.485   3.1816  231.709   13.743  228.069   18.307  236.409   20.803  104.607   4.2431  106.364   4.7420 -1.755959 6.363232 
1 1 1   18    5   32 o   93.549   3.0813  182.622   11.885  183.238   16.624  181.978   16.999   93.725   4.3004   93.374   4.4140 0.3512192 6.162556 
1 1 1   18    5   33 o   75.091   3.4462  118.270   10.655  108.985   14.751  128.400   15.407   71.987   4.9682   78.194   4.7774 -6.206650 6.892500 
1 1 1   18    5   34 o   38.083   5.8582   32.641   8.9338   30.801   12.316   34.684   12.979   36.930   8.2892   39.237   8.2802 -2.307751 11.71632 
1 1 1   18    5   35 o   80.207   4.2755  136.071   13.292  134.636   16.213  139.015   23.214   79.978   4.9149   80.436   6.9973 -0.4582596 8.550927 
1 1 1   18    5   36 o   66.275   4.9806   92.445   12.446  102.171   23.232   88.531   14.740   68.037   8.2789   64.514   5.5395 3.523430 9.961287 
1 1 1   18    5   37 o   43.817   5.5322   42.358   9.6057   45.200   15.201   40.468   12.394   44.457   8.6013   43.177   6.9597 1.280224 11.06434 
1 1 1   18    5   38 o   40.798   5.3188   37.267   8.7340   35.849   12.732   38.526   12.003   39.572   8.0744   42.024   6.9253 -2.451992 10.63752 
1 1 1   18    5   39 o   15.126   5.0192  -9.7097   7.8228  -7.8563   11.947 -11.1006   10.350   16.249   7.5238   14.003   6.6454 2.245748 10.03839 
1 1 1   18    5   40 o   36.843   6.2721   31.374   9.4460   23.500   12.341   42.515   14.679   31.297   9.0483   42.388   8.6881 -11.09115 12.54413 
1 1 1   18    5   41 o   23.588   7.3414   4.7511   11.097   5.1464   12.164   2.7906   27.090   20.737   8.6206   26.440   11.886 -5.702101 14.68277 
1 1 1   18    5   42 f   32.420   7.2785   29.343   11.599   35.111   12.967   6.2590   25.940   38.131   8.4660   26.708   11.842 11.42283 14.55702 
1 1 1   18    5   43 o   32.523   8.6388   18.506   17.469  -6.3554   22.273   58.244   28.160   22.073   10.239   42.972   13.917 -20.89884 17.27755 
1 1 1   18    5   44 o   48.804   9.0029   90.919   27.587 -13.8174   53.801  128.278   32.132   28.739   14.009   68.869   11.312 -40.13085 18.00575 
1 1 1   18    5   45 o   21.860   7.7868 -40.6459   23.275 -34.7526   51.189 -42.1818   26.132   25.623   12.713   18.096   8.9959 7.527100 15.57364 
1 1 1   18    6    0 o  535.235   3.8854  5916.77  121.272  5916.77  121.272  5916.77  121.272  535.235   5.4948  535.235   5.4948 0.000000 0.000000 
1 1 1   18    6    1 o  252.125   2.3846  1312.04   24.797  1304.64   34.931  1319.57   35.205  251.408   3.3688  252.842   3.3759 -1.434052 4.769222 
1 1 1   18    6    2 o  239.320   2.3340  1181.04   23.023  1152.42   31.871  1212.27   33.295  236.293   3.2703  242.347   3.3310 -6.054657 4.668032 
1 1 1   18    6    3 o  127.902   2.1268  337.541   11.218  330.894   15.748  344.389   15.984  126.624   3.0153  129.181   3.0001 -2.556686 4.253532 
1 1 1   18    6    4 o  264.330   2.4369  1442.22   26.566  1435.72   37.334  1448.89   37.810  263.727   3.4323  264.932   3.4603 -1.204498 4.873826 
1 1 1   18    6    5 o  220.094   2.2720  999.848   20.624  998.041   29.121  1001.67   29.213  219.895   3.2109  220.293   3.2152 -0.3987732 4.543909 
1 1 1   18    6    6 o  221.668   2.2716  1014.17   20.767  1005.26   29.204  1023.28   29.538  220.683   3.2085  222.652   3.2165 -1.968536 4.543196 
1 1 1   18    6    7 o  128.082   2.1410  338.608   11.310  338.568   16.017  338.649   15.973  128.074   3.0323  128.089   3.0234 -0.1567078E-01 4.282026 
1 1 1   18    6    8 o  145.853   2.5297  440.025   14.500  441.728   17.979  436.856   24.523  146.288   2.9798  145.419   4.0888 0.8689117 5.059419 
1 1 1   18    6    9 o   34.101   5.6553   28.547   7.3302   33.200   8.4186   13.960   14.905   40.067   5.0943   28.135   10.098 11.93172 11.31066 
1 1 1   18    6   10 o  127.307   2.4542  335.025   12.872  346.231   18.002  323.299   18.414  129.493   3.3706  125.121   3.5683 4.371162 4.908476 
1 1 1   18    6   11 o  239.358   2.8607  1187.61   26.804  1170.78   45.624  1196.49   33.124  237.990   4.6480  240.726   3.3362 -2.736145 5.721382 
1 1 1   18    6   12 o  149.093   2.3160  460.796   14.082  445.935   21.400  472.147   18.702  146.950   3.5308  151.236   2.9983 -4.286041 4.632083 
1 1 1   18    6   13 o  346.982   2.8411  2487.47   40.659  2481.34   57.369  2493.66   57.633  346.553   4.0136  347.411   4.0222 -0.8576660 5.682200 
1 1 1   18    6   14 o  268.148   2.9187  1499.59   29.934  1449.47   53.033  1523.02   36.262  264.718   4.8573  271.578   3.2374 -6.859589 5.837316 
1 1 1   18    6   15 o  293.150   2.8320  1769.51   33.644  1810.16   53.018  1742.11   43.532  295.904   4.3442  290.397   3.6345 5.506927 5.664080 
1 1 1   18    6   16 o  216.805   2.8281  977.349   23.824  953.624   41.058  989.393   29.253  214.729   4.6360  218.881   3.2404 -4.152283 5.656167 
1 1 1   18    6   17 o   90.557   3.3115  175.816   11.918  137.859   18.127  204.713   15.816   81.588   5.3869   99.525   3.8531 -17.93701 6.623037 
1 1 1   18    6   18 o   50.311   3.9674   52.733   8.1821   46.716   11.692   58.508   11.454   47.468   5.9719   53.155   5.2247 -5.687187 7.934853 
1 1 1   18    6   19 f  206.405   2.5533  880.000   21.632  884.028   32.243  876.702   29.172  206.814   3.7799  205.996   3.4335 0.8185730 5.106564 
1 1 1   18    6   20 o  279.275   3.3557  1611.93   37.764  1603.15   48.430  1625.55   60.319  278.414   4.2175  280.136   5.2206 -1.722351 6.711320 
1 1 1   18    6   21 o   41.837   5.0608   37.796   8.3532   45.285   11.546   29.569   12.100   46.721   5.9916   36.953   8.1577 9.768139 10.12160 
1 1 1   18    6   22 o  260.304   2.9259  1401.42   31.408  1414.76   44.877  1388.61   43.972  261.514   4.1607  259.095   4.1148 2.419403 5.851768 
1 1 1   18    6   23 o  181.794   3.1133  685.900   22.642  691.831   28.787  676.279   36.667  182.910   3.8158  180.679   4.9204 2.231155 6.226614 
1 1 1   18    6   24 o   55.581   6.0292   68.444   11.321   71.086   13.081   60.559   22.598   58.528   5.4187   52.634   10.772 5.893856 12.05840 
1 1 1   18    6   25 o   83.372   3.1996  144.907   10.914  124.445   15.489  165.083   15.380   77.461   4.8481   89.282   4.1767 -11.82104 6.399147 
1 1 1   18    6   26 f   62.104   3.8437   80.226   9.8408   78.920   14.058   81.480   13.780   61.599   5.5333   62.609   5.3364 -1.009678 7.687334 
1 1 1   18    6   27 o  120.641   3.6867  302.858   18.323  296.725   26.395  308.563   25.456  119.434   5.3582  121.849   5.0653 -2.414978 7.373454 
1 1 1   18    6   28 o  172.358   3.9302  616.303   27.939   0.0000   0.0000  616.303   27.939  ?   ?   172.358   3.9302      ?      ? 
1 1 1   18    6   29 o   61.039   3.8646   77.888   9.7264   79.892   13.740   75.875   13.771   61.838   5.3871   60.241   5.5425 1.597298 7.729154 
1 1 1   18    6   30 o   33.537   6.0435   25.071   8.5329   31.380   12.015   18.651   12.120   37.705   7.9751   29.369   9.0825 8.336906 12.08690 
1 1 1   18    6   31 o   87.040   3.1939  158.516   11.436  150.599   16.496  165.842   15.869   84.897   4.7109   89.184   4.3141 -4.286774 6.387841 
1 1 1   18    6   32 o   59.259   4.2906   73.606   10.389   70.061   13.655   78.477   16.007   57.653   5.7425   60.865   6.3766 -3.211426 8.581191 
1 1 1   18    6   33 o   36.692   7.3720   31.881   10.734   33.752   12.168   25.318   22.793   38.875   7.8590   34.509   12.475 4.365654 14.74396 
1 1 1   18    6   34 o   55.752   4.1737   66.027   9.5912   68.780   13.585   63.290   13.544   56.944   5.7841   54.561   6.0184 2.382336 8.347313 
1 1 1   18    6   35 o   56.677   4.0849   68.020   9.4242   83.562   13.768   54.317   12.928   62.881   5.3085   50.473   6.2101 12.40856 8.169798 
1 1 1   18    6   36 o   64.465   5.3028   90.093   12.773   92.081   23.721   89.282   15.158   64.204   8.9578   64.725   5.6780 -0.5208359 10.60570 
1 1 1   18    6   37 o   55.716   4.2936   66.060   9.8199   74.352   14.740   59.443   13.168   58.829   6.0749   52.603   6.0692 6.225746 8.587186 
1 1 1   18    6   38 o   21.892   6.0483   7.5288   7.9892   4.6274   11.704   10.060   10.932   20.711   8.5184   23.073   8.5887 -2.361959 12.09665 
1 1 1   18    6   39 o   55.746   4.4263   68.320   10.062   58.210   14.418   77.917   14.048   51.419   6.7987   60.072   5.6697 -8.652782 8.852555 
1 1 1   18    6   40 o   24.027   5.8490   7.7501   8.8910   24.564   12.198 -11.3068   12.986   31.974   8.9147   16.080   7.5743 15.89465 11.69796 
1 1 1   18    6   41 o   23.380   7.1238   6.5566   10.706   8.2732   11.843  -1.1199   25.045   21.981   8.7356   24.780   11.255 -2.799349 14.24758 
1 1 1   18    6   42 o   58.984   7.1099   93.365   13.850  101.204   16.113   71.193   27.099   67.876   5.7557   50.092   13.003 17.78391 14.21978 
1 1 1   18    6   43 o   30.685   8.8994   11.691   21.833 -34.7604   32.074   51.799   29.803   21.706   10.631   39.664   14.275 -17.95780 17.79875 
1 1 1   18    6   44 o   39.101   10.232   57.650   27.312  -1.4858   51.648   80.605   32.179   29.413   14.192   48.789   14.744 -19.37570 20.46437 
1 1 1   18    6   45 o   34.063   10.627   38.155   25.204   77.522   52.995   26.648   28.651   37.998   16.883   30.128   12.909 7.870424 21.25300 
1 1 1   18    7    0 o   69.847   2.6301  101.519   10.646  101.519   10.646  101.519   10.646   69.847   3.7195   69.847   3.7195 0.000000 0.000000 
1 1 1   18    7    1 o  186.604   2.1666  718.656   16.675  716.751   23.572  720.564   23.593  186.356   3.0668  186.852   3.0614 -0.4953613 4.333298 
1 1 1   18    7    2 o  384.455   3.0254  3052.81   47.972  3046.19   67.657  3059.50   68.029  384.037   4.2715  384.873   4.2856 -0.8361206 6.050773 
1 1 1   18    7    3 f  331.437   2.7476  2268.31   37.559  2275.94   53.302  2260.78   52.933  331.990   3.8927  330.885   3.8787 1.105408 5.495194 
1 1 1   18    7    4 o   70.511   2.7608  101.783   7.9336   97.249   10.350  108.242   12.353   68.630   3.6565   72.393   4.1374 -3.762703 5.521573 
1 1 1   18    7    5 o   28.267   4.9849   17.189   5.8846   12.723   8.2782   21.750   8.3667   24.707   7.4809   31.828   6.5905 -7.120462 9.969854 
1 1 1   18    7    6 o   90.239   2.4509  169.605   9.0109  157.176   13.553  179.451   12.063   87.240   3.7667   93.237   3.1369 -5.997398 4.901880 
1 1 1   18    7    7 o  104.245   2.1967  224.175   9.4413  216.631   13.161  232.173   13.551  102.439   3.1151  106.051   3.0981 -3.611671 4.393382 
1 1 1   18    7    8 o   66.683   2.9585   92.450   8.0820   81.664   11.582  102.689   11.284   62.859   4.4672   70.507   3.8801 -7.647816 5.917048 
1 1 1   18    7    9 o   48.536   4.2688   55.106   7.2982   66.385   9.1129   34.933   12.187   56.690   3.8975   40.381   7.5961 16.30890 8.537632 
1 1 1   18    7   10 o  191.633   2.3634  758.340   18.486  758.945   24.451  757.532   28.243  191.739   3.0918  191.527   3.5753 0.2121582 4.726769 
1 1 1   18    7   11 o  275.610   2.6913  1571.71   30.356  1546.23   45.671  1591.87   40.630  273.577   4.0476  277.643   3.5481 -4.065399 5.382528 
1 1 1   18    7   12 o  180.535   2.3457  674.241   17.300  663.625   26.238  682.405   23.010  179.259   3.5488  181.811   3.0685 -2.551620 4.691463 
1 1 1   18    7   13 o  190.596   2.6835  750.794   19.213  749.762   35.439  751.224   22.864  190.432   4.5120  190.760   2.9061 -0.3277283 5.366922 
1 1 1   18    7   14 o  106.197   2.8135  234.144   12.061  227.623   18.989  238.553   15.614  104.927   4.3878  107.465   3.5228 -2.537964 5.626967 
1 1 1   18    7   15 o  165.321   3.2668  590.512   17.940  522.684   38.478  609.351   20.279  158.839   5.8735  171.803   2.8618 -12.96324 6.533574 
1 1 1   18    7   16 o  100.959   2.5359  213.563   10.338  194.033   15.922  227.798   13.594   96.890   3.9844  105.027   3.1381 -8.137505 5.071794 
1 1 1   18    7   17 o  102.067   2.5771  215.250   10.849  216.883   15.420  213.650   15.265  102.450   3.6493  101.684   3.6399 0.7657852 5.154272 
1 1 1   18    7   18 o   65.167   4.2715   99.914   10.041   55.124   16.079  128.546   12.856   51.476   7.5735   78.857   3.9528 -27.38157 8.543002 
1 1 1   18    7   19 o  115.557   3.2206  276.559   15.281  311.089   21.859  243.556   21.370  122.638   4.3215  108.477   4.7764 14.16087 6.441246 
1 1 1   18    7   20 o  200.743   3.0211  831.204   24.483  822.387   31.465  844.734   38.976  199.457   3.8248  202.029   4.6775 -2.571762 6.042258 
1 1 1   18    7   21 o  132.679   2.7844  361.942   15.008  352.522   19.483  375.685   23.533  130.596   3.6172  134.762   4.2340 -4.165588 5.568713 
1 1 1   18    7   22 o  134.343   2.5517  373.073   14.138  374.735   20.083  371.440   19.907  134.639   3.6165  134.048   3.6007 0.5917206 5.103336 
1 1 1   18    7   23 o  174.411   3.3261  643.159   22.681  674.616   28.322  586.917   37.870  180.611   3.8020  168.210   5.4586 12.40088 6.652134 
1 1 1   18    7   24 o   27.130   6.1571   14.796   8.0453   19.875   11.205   9.3923   11.558   30.382   8.5703   23.878   8.8427 6.503876 12.31429 
1 1 1   18    7   25 o   78.907   3.2868  129.666   10.597  108.496   14.873  151.501   15.104   72.303   4.9873   85.511   4.2826 -13.20754 6.573681 
1 1 1   18    7   26 o  106.836   2.8467  236.408   12.535  224.575   17.558  248.707   17.902  104.102   4.0894  109.569   3.9613 -5.466896 5.693436 
1 1 1   18    7   27 o   57.132   7.6807   83.932   13.254   51.735   30.750   91.278   14.689   48.045   14.389   66.220   5.3782 -18.17502 15.36147 
1 1 1   18    7   28 o   68.459   3.7843   97.925   10.656   95.999   15.571   99.621   14.614   67.792   5.5689   69.127   5.1256 -1.334763 7.568656 
1 1 1   18    7   29 o  134.118   2.6875  373.479   14.863  384.431   21.131  362.756   20.910  136.072   3.7652  132.164   3.8359 3.908661 5.375016 
1 1 1   18    7   30 o  116.963   3.3902  290.146   15.673  269.750   25.672  302.267   19.790  113.401   5.4887  120.525   3.9811 -7.123322 6.780499 
1 1 1   18    7   31 o  201.446   3.5191  852.330   29.121  783.240   41.795  917.516   40.597  193.323   5.2417  209.569   4.6968 -16.24632 7.038191 
1 1 1   18    7   32 o   72.778   3.8821  113.541   11.403  123.481   15.108  100.385   17.381   76.735   4.7737   68.820   6.1234 7.915703 7.764246 
1 1 1   18    7   33 o   53.615   6.3351   60.754   12.111   57.024   14.047   71.555   23.904   51.670   6.5915   55.559   10.821 -3.888611 12.67024 
1 1 1   18    7   34 o  107.751   2.9492  242.973   13.106  247.444   18.625  238.587   18.445  108.740   4.1527  106.763   4.1888 1.977425 5.898400 
1 1 1   18    7   35 o   26.276   5.7513   11.691   8.1074   27.597   12.011  -1.6218   10.988   34.784   8.4546   17.768   7.7995 17.01605 11.50268 
1 1 1   18    7   36 o   39.083   7.8948   39.514   12.184   16.458   32.934   43.171   13.115   33.573   14.088   44.594   7.1306 -11.02139 15.78953 
1 1 1   18    7   37 o   41.523   5.2520   38.393   8.7347   38.083   13.101   38.641   11.720   40.864   8.0596   42.181   6.7364 -1.316872 10.50408 
1 1 1   18    7   38 o   38.497   5.7677   33.981   8.8809   40.448   13.009   28.337   12.153   42.153   7.7691   34.841   8.5267 7.311913 11.53533 
1 1 1   18    7   39 o   18.884   5.6387  -1.7065   8.0754   10.030   12.168 -10.9444   10.795   23.354   8.9777   14.414   6.8248 8.939775 11.27733 
1 1 1   18    7   40 o   38.854   7.3392   45.846   12.784   53.482   13.867   2.5926   33.003   49.047   6.8549   28.661   12.979 20.38558 14.67844 
1 1 1   18    7   41 o   25.083   7.4617   9.8980   11.077   10.723   12.207   6.0525   26.359   23.340   8.9870   26.826   11.914 -3.486021 14.92331 
1 1 1   18    7   42 o   42.813   7.1626   55.460   12.599   65.122   14.470   25.186   25.614   53.923   6.5064   31.703   12.762 22.21924 14.32522 
1 1 1   18    7   43 o   22.905   7.7337 -18.2947   20.920 -37.1442   31.040  -2.6061   28.318   20.997   10.319   24.812   11.522 -3.814589 15.46735 
1 1 1   18    7   44 o   33.508   9.4546   25.316   22.492   68.563   33.353 -10.7503   30.459   43.230   15.146   23.786   11.320 19.44366 18.90929 
1 1 1   18    7   45 o   31.114   9.8895   31.138   26.403   17.619   52.039   35.824   30.639   29.910   14.384   32.318   13.576 -2.407803 19.77894 
1 1 1   18    8    0 o  318.723   3.1052  2097.98   57.704  2097.98   57.704  2097.98   57.704  318.723   4.3915  318.723   4.3915 0.000000 0.000000 
1 1 1   18    8    1 o  173.439   2.6137  618.860   17.586  627.836   30.708  614.479   21.451  174.334   4.2707  172.544   3.0143 1.789871 5.227344 
1 1 1   18    8    2 o  195.007   2.3495  784.434   18.702  789.335   28.617  780.781   24.709  195.524   3.5487  194.490   3.0803 1.033310 4.699061 
1 1 1   18    8    3 o  105.854   2.1759  231.209   9.4980  226.526   13.290  236.099   13.580  104.758   3.0758  106.949   3.0785 -2.190575 4.351752 
1 1 1   18    8    4 o   93.008   2.2497  178.597   8.6280  174.027   12.191  183.184   12.213   91.814   3.2192   94.201   3.1435 -2.386894 4.499400 
1 1 1   18    8    5 o  231.788   2.3002  1108.87   21.985  1092.69   30.735  1125.82   31.462  230.058   3.2392  233.518   3.2666 -3.459290 4.600303 
1 1 1   18    8    6 o  295.047   2.5721  1797.77   31.299  1789.85   44.073  1805.83   44.456  294.393   3.6298  295.702   3.6451 -1.309479 5.144168 
1 1 1   18    8    7 f  232.917   2.4858  1116.78   23.600  1098.01   30.968  1142.78   36.451  230.612   3.2558  235.222   3.7572 -4.609238 4.971617 
1 1 1   18    8    8 o  171.657   2.4374  608.003   17.244  619.448   24.956  597.547   23.854  173.199   3.4935  170.115   3.3998 3.083389 4.874703 
1 1 1   18    8    9 o  337.171   3.0184  2350.58   41.586  2360.23   55.242  2337.97   63.174  338.016   3.9625  336.326   4.5542 1.689758 6.036748 
1 1 1   18    8   10 o  158.268   2.8151  517.938   17.936  519.672   23.009  515.251   28.634  158.636   3.5166  157.900   4.3968 0.7365875 5.630131 
1 1 1   18    8   11 f  180.790   2.3558  674.145   17.378  679.949   26.647  669.850   22.924  181.450   3.5607  180.130   3.0856 1.320114 4.711624 
1 1 1   18    8   12 o  199.279   2.3953  820.403   19.470  818.198   29.815  822.043   25.708  199.024   3.6322  199.533   3.1238 -0.5097198 4.790676 
1 1 1   18    8   13 o  269.572   2.9836  1494.53   29.834  1519.48   56.451  1484.86   35.143  270.988   5.0508  268.155   3.1775 2.833344 5.967151 
1 1 1   18    8   14 o   74.451   3.1394  113.734   8.9307  116.918   16.099  112.318   10.734   75.162   5.1931   73.740   3.5293 1.422722 6.278877 
1 1 1   18    8   15 o  113.826   3.2989  262.439   12.795  277.933   27.755  258.257   14.418  115.820   5.8102  111.831   3.1260 3.988708 6.597719 
1 1 1   18    8   16 o  217.693   2.4931  976.718   22.033  992.431   34.468  965.862   28.650  219.135   3.8136  216.250   3.2122 2.885223 4.986188 
1 1 1   18    8   17 o  188.195   2.5101  728.991   19.363  755.958   29.268  708.000   25.822  191.262   3.7102  185.128   3.3818 6.133545 5.020180 
1 1 1   18    8   18 o  179.253   2.6092  664.048   19.290  663.121   27.181  664.988   27.381  179.129   3.6790  179.378   3.7010 -0.2496338 5.218476 
1 1 1   18    8   19 o  249.536   2.7003  1285.59   27.604  1300.59   41.629  1273.82   36.879  250.801   4.0244  248.272   3.6015 2.528778 5.400571 
1 1 1   18    8   20 o   88.942   2.8444  163.540   10.433  165.722   14.911  161.449   14.602   89.521   4.0385   88.362   4.0066 1.159752 5.688840 
1 1 1   18    8   21 o   77.357   3.4270  124.373   10.784  126.755   14.206  121.133   16.568   78.263   4.4010   76.451   5.2544 1.812126 6.853999 
1 1 1   18    8   22 o   98.394   2.8097  200.206   11.400  194.162   16.011  206.420   16.234   96.886   4.0067   99.902   3.9400 -3.016487 5.619332 
1 1 1   18    8   23 o  166.682   3.3331  577.247   21.583  580.492   26.453  570.786   37.327  167.517   3.8286  165.846   5.4570 1.670441 6.666139 
1 1 1   18    8   24 o  150.446   3.0363  471.885   18.545  487.699   24.412  450.306   28.517  153.510   3.8557  147.382   4.6914 6.127914 6.072536 
1 1 1   18    8   25 o  139.592   3.3381  404.187   19.215  394.070   26.937  414.669   27.418  137.811   4.7392  141.374   4.7022 -3.562775 6.676141 
1 1 1   18    8   26 o   90.305   3.1463  169.269   11.687  153.601   16.390  185.475   16.669   86.031   4.6192   94.580   4.2731 -8.548645 6.292526 
1 1 1   18    8   27 f   38.390   6.6522   42.555   11.806 -20.9312   29.332   54.829   12.897   25.566   11.821   51.214   6.1057 -25.64824 13.30440 
1 1 1   18    8   28 o  148.910   2.6542  460.019   16.292  438.605   22.866  482.096   23.218  145.376   3.8136  152.443   3.6928 -7.067184 5.308465 
1 1 1   18    8   29 o  157.816   2.9209  512.053   18.511  544.235   30.196  492.680   23.429  161.602   4.5304  154.029   3.6880 7.573273 5.841724 
1 1 1   18    8   30 o   28.813   6.1074   17.213   8.2956   26.496   12.034   8.8050   11.452   34.456   8.5164   23.170   8.7563 11.28567 12.21483 
1 1 1   18    8   31 o   60.432   3.9097   76.477   9.7023   87.048   14.131   67.050   13.345   64.411   5.3192   56.452   5.7316 7.958878 7.819467 
1 1 1   18    8   32 o  111.551   3.1730  258.540   14.413  247.651   18.773  274.174   22.494  108.830   4.1824  114.272   4.7727 -5.442574 6.345900 
1 1 1   18    8   33 o   69.372   5.2899  109.257   12.876  115.161   15.017   92.873   25.017   73.980   4.9217   64.765   9.3654 9.214478 10.57989 
1 1 1   18    8   34 o   38.045   5.8203   32.634   8.8675   32.971   12.531   32.296   12.550   38.260   8.1884   37.830   8.2738 0.4305115 11.64070 
1 1 1   18    8   35 o   18.254   5.5999  -0.4043   7.8145   0.3813   10.918  -1.2294   11.189   18.467   7.9424   18.042   7.8964 0.4247131 11.19973 
1 1 1   18    8   36 o   49.673   7.7726   76.259   13.301   24.683   33.463   85.936   14.495   35.815   14.528   63.531   5.5318 -27.71621 15.54511 
1 1 1   18    8   37 o   32.892   6.1494   24.805   8.5062   30.381   12.680   20.243   11.470   36.157   8.6237   29.626   8.7689 6.531065 12.29881 
1 1 1   18    8   38 o   29.235   6.5219   19.869   9.0640   13.730   13.270   25.239   12.410   25.815   9.4898   32.655   8.9489 -6.839680 13.04374 
1 1 1   18    8   39 o   42.656   5.4139   41.544   9.2671   39.701   13.619   43.133   12.646   41.186   8.3040   44.127   6.9486 -2.941051 10.82770 
1 1 1   18    8   40 o   35.850   8.1425   31.997   12.268   30.847   13.898   36.053   26.105   35.382   9.3742   36.319   13.316 -0.9366570 16.28501 
1 1 1   18    8   41 o   22.115   7.1763  -1.5558   11.216  -2.1723   12.272   1.5728   27.646   17.976   8.0462   26.253   11.885 -8.276867 14.35254 
1 1 1   18    8   42 o   57.636   7.0894   82.958   13.499   82.736   15.378   83.704   28.180   60.967   6.1155   54.305   12.792 6.662239 14.17871 
1 1 1   18    8   43 o   26.799   7.6932   16.237   12.688   19.902   14.065   0.2130   29.410   28.009   9.8343   25.590   11.833 2.419090 15.38634 
1 1 1   18    8   44 o   25.278   8.2737  -2.1282   20.437   20.006   31.059 -19.0280   27.139   29.221   12.957   21.335   10.292 7.886530 16.54737 
1 1 1   18    8   45 o   23.623   8.2101 -18.9120   24.600 -27.6758   49.661 -16.0623   28.318   25.488   12.624   21.758   10.501 3.729582 16.42011 
1 1 1   18    9    0 o  165.824   2.1107  567.883   20.400  567.883   20.400  567.883   20.400  165.824   2.9849  165.824   2.9849 0.000000 0.000000 
1 1 1   18    9    1 o  128.188   2.0972  339.003   11.083  326.095   15.490  352.542   15.865  125.689   2.9881  130.688   2.9433 -4.999153 4.194300 
1 1 1   18    9    2 o  267.460   2.4430  1477.11   26.949  1476.90   38.123  1477.33   38.100  267.441   3.4562  267.480   3.4536 -0.3921509E-01 4.885946 
1 1 1   18    9    3 o  228.594   2.6370  1079.26   24.862  1079.34   35.101  1079.17   35.220  228.603   3.7228  228.584   3.7357 0.1937866E-01 5.274000 
1 1 1   18    9    4 o  317.740   3.0906  2086.23   40.500  2075.23   56.883  2097.54   57.676  316.894   4.3521  318.586   4.3893 -1.692871 6.181224 
1 1 1   18    9    5 o   64.909   3.1273   87.087   8.3628   92.522   11.902   81.787   11.753   66.913   4.3126   62.905   4.5300 4.007862 6.254560 
1 1 1   18    9    6 o   82.313   3.0113  141.448   10.097  151.809   13.588  128.671   15.090   85.730   3.8429   78.897   4.6372 6.832260 6.022567 
1 1 1   18    9    7 o  131.378   2.2346  356.716   12.026  359.711   16.134  352.971   18.041  132.008   2.9632  130.749   3.3456 1.259674 4.469167 
1 1 1   18    9    8 o  346.903   3.0695  2472.69   43.116  2415.07   55.595  2559.65   68.297  341.923   3.9422  351.882   4.7059 -9.959564 6.138908 
1 1 1   18    9    9 o   66.560   3.0825   91.617   8.4408   90.604   12.348   92.507   11.565   66.208   4.5217   66.911   4.1906 -0.7022934 6.165008 
1 1 1   18    9   10 o  214.242   2.2577  947.618   19.949  941.371   28.065  953.997   28.361  213.529   3.1867  214.955   3.1990 -1.426239 4.515380 
1 1 1   18    9   11 o  167.946   2.3177  583.871   15.894  572.088   24.119  592.916   21.132  166.428   3.5138  169.465   3.0234 -3.036758 4.635464 
1 1 1   18    9   12 o  275.592   3.0693  1589.83   33.343  1501.34   55.265  1640.48   41.809  269.379   4.9741  281.805   3.5971 -12.42542 6.138528 
1 1 1   18    9   13 f  102.934   2.9322  218.633   11.895  220.229   20.065  217.769   14.770  103.189   4.7146  102.679   3.4876 0.5097275 5.864373 
1 1 1   18    9   14 o  243.265   2.8700  1204.68   25.805  1264.82   49.499  1182.23   30.239  247.253   4.8538  239.278   3.0641 7.974976 5.740074 
1 1 1   18    9   15 o  185.805   3.5290  688.876   22.746  762.590   48.611  668.213   25.737  191.764   6.1462  179.847   3.4697 11.91675 7.057950 
1 1 1   18    9   16 o   97.771   3.2602  197.379   13.117  179.324   18.152  217.107   18.975   93.094   4.7277  102.449   4.4906 -9.355576 6.520458 
1 1 1   18    9   17 o  191.826   2.5218  759.810   19.860  765.843   29.593  754.867   26.789  192.501   3.7272  191.151   3.3979 1.349518 5.043571 
1 1 1   18    9   18 o  153.571   2.4087  487.015   15.252  476.840   21.254  497.817   21.900  151.919   3.3921  155.223   3.4207 -3.303268 4.817446 
1 1 1   18    9   19 o   77.824   3.2074  126.183   10.222  115.228   14.932  135.845   14.023   74.605   4.8527   81.044   4.1953 -6.439796 6.414795 
1 1 1   18    9   20 o  129.734   2.6117  348.107   13.957  344.071   20.190  351.801   19.315  129.004   3.7947  130.463   3.5896 -1.458603 5.223468 
1 1 1   18    9   21 o  165.062   2.9059  553.534   18.874  531.396   23.204  596.815   32.444  160.342   3.5087  169.783   4.6331 -9.440247 5.811787 
1 1 1   18    9   22 o  140.612   2.6912  410.809   15.493  427.032   20.939  391.182   23.031  143.722   3.5324  137.502   4.0611 6.219940 5.382360 
1 1 1   18    9   23 o   34.139   6.8377   22.493   9.5267   17.457   11.402   34.135   17.337   28.785   8.7941   39.494   10.473 -10.70878 13.67533 
1 1 1   18    9   24 o  161.012   2.5520  536.265   16.945  526.106   23.737  546.820   24.197  159.457   3.6093  162.566   3.6088 -3.108902 5.103924 
1 1 1   18    9   25 o  113.576   2.7680  267.188   12.966  270.241   18.395  264.174   18.279  114.222   3.9047  112.930   3.9245 1.291962 5.536082 
1 1 1   18    9   26 o   89.690   3.2953  168.074   11.988  161.004   18.509  173.184   15.734   87.994   5.0999   91.386   4.1745 -3.392204 6.590542 
1 1 1   18    9   27 o  103.988   3.4936  222.609   14.267  233.772   24.474  216.863   17.560  105.791   5.6090  102.185   4.1665 3.606117 6.987154 
1 1 1   18    9   28 o   83.077   4.5977  146.678   15.414  111.490   21.620  183.054   21.982   72.647   7.2158   93.506   5.6999 -20.85952 9.195459 
1 1 1   18    9   29 o  108.488   3.0298  244.314   13.490  253.712   20.258  236.827   18.082  110.312   4.4525  106.664   4.1101 3.647881 6.059519 
1 1 1   18    9   30 f   62.036   3.8213   81.137   9.7249   75.206   14.144   86.454   13.393   59.809   5.7338   64.263   5.0530 -4.454102 7.642556 
1 1 1   18    9   31 o   21.882   6.0111   5.8525   8.0522   12.044   11.661   0.2096   11.132   25.008   8.9368   18.755   8.0417 6.253399 12.02227 
1 1 1   18    9   32 o   61.375   6.2954   90.124   12.287   95.635   14.025   71.937   25.479   67.405   5.0449   55.344   11.536 12.06101 12.59087 
1 1 1   18    9   33 o   58.756   4.0634   73.244   9.8220   66.841   13.790   79.838   13.994   56.086   5.9611   61.425   5.5236 -5.339100 8.126787 
1 1 1   18    9   34 o   50.352   4.4923   54.140   9.3291   54.589   13.217   53.695   13.169   50.564   6.3378   50.140   6.3682 0.4240227 8.984570 
1 1 1   18    9   35 o   30.471   6.1078   18.345   8.7674   35.585   13.760   6.5641   11.375   39.356   8.7079   21.587   8.5669 17.76872 12.21552 
1 1 1   18    9   36 o   72.589   3.5372  111.944   10.565  106.715   15.218  116.810   14.680   70.866   5.2066   74.312   4.7896 -3.445183 7.074494 
1 1 1   18    9   37 o   38.426   5.8444   33.636   8.9987   41.607   13.376   27.046   12.162   42.789   7.8695   34.063   8.6429 8.725319 11.68888 
1 1 1   18    9   38 o   63.116   4.1198   84.527   10.589  105.897   16.156   68.434   14.020   70.094   5.5882   56.137   6.0551 13.95742 8.239675 
1 1 1   18    9   39 o   40.020   5.8496   37.790   9.3206   34.624   13.562   40.623   12.831   38.074   8.8111   41.966   7.6965 -3.892185 11.69924 
1 1 1   18    9   40 o   38.524   8.0859   29.329   12.251   19.023   13.837   66.723   26.357   28.195   9.7624   48.853   12.893 -20.65750 16.17181 
1 1 1   18    9   41 o   27.832   7.8406   17.426   12.423   22.488   12.878 -50.4625   47.162   30.146   9.3684   25.517   12.575 4.629387 15.68114 
1 1 1   18    9   42 o   22.488   7.3698  -1.8155   12.300  -2.8362   13.487   3.2286   29.983   18.363   8.3083   26.613   12.175 -8.249874 14.73968 
1 1 1   18    9   43 o   21.862   6.8023   3.2543   11.975   10.798   13.363 -27.4996   26.981   23.272   9.2696   20.451   9.9580 2.821924 13.60467 
1 1 1   18    9   44 o   33.062   9.2780   31.526   21.984  -4.3762   32.674   61.224   29.717   24.917   11.820   41.207   14.305 -16.28959 18.55601 
1 1 1   18    9   45 o   26.088   8.9735  -6.5079   24.800   26.237   51.605 -16.3412   28.279   30.510   14.580   21.667   10.466 8.843704 17.94695 
1 1 1   18   10    0 o  176.135   2.4657  640.949   25.310  640.949   25.310  640.949   25.310  176.135   3.4871  176.135   3.4871 0.000000 0.000000 
1 1 1   18   10    1 o  195.071   2.6463  784.422   20.094  781.374   24.614  790.513   34.794  194.553   3.0674  195.589   4.3131 -1.035995 5.292616 
1 1 1   18   10    2 o  318.920   2.6833  2100.77   35.295  2097.24   49.761  2104.34   50.069  318.651   3.7862  319.188   3.8033 -0.5371704 5.366603 
1 1 1   18   10    3 o  158.046   2.0931  515.611   13.644  514.455   19.308  516.764   19.284  157.869   2.9653  158.223   2.9550 -0.3543091 4.186260 
1 1 1   18   10    4 o  221.454   2.2595  1012.44   20.637  1006.76   29.065  1018.22   29.308  220.828   3.1911  222.081   3.1997 -1.252975 4.519014 
1 1 1   18   10    5 o  204.565   2.2034  863.783   18.589  854.115   26.112  873.718   26.469  203.405   3.1125  205.725   3.1195 -2.320496 4.406716 
1 1 1   18   10    6 o  430.553   3.5385  3832.82   62.203  3829.71   82.321  3836.97   94.963  430.432   4.6370  430.674   5.3461 -0.2416382 7.076938 
1 1 1   18   10    7 o   92.907   2.3496  179.279   8.9452  190.903   12.244  165.975   13.100   96.163   3.0872   89.651   3.5427 6.512924 4.699115 
1 1 1   18   10    8 o  120.221   2.2909  295.709   11.225  281.952   14.639  315.335   17.486  116.867   3.0371  123.574   3.4307 -6.707047 4.581898 
1 1 1   18   10    9 o  177.610   2.3115  652.292   16.777  658.301   22.322  644.490   25.434  178.568   3.0308  176.653   3.4909 1.915176 4.622961 
1 1 1   18   10   10 o  257.403   2.6128  1370.46   27.487  1355.81   41.664  1381.75   36.576  256.153   3.9436  258.654   3.4286 -2.501129 5.225641 
1 1 1   18   10   11 o  224.038   2.8356  1042.04   24.616  1023.34   42.728  1051.32   30.115  222.443   4.6572  225.632   3.2361 -3.188232 5.671161 
1 1 1   18   10   12 o  185.342   2.6582  715.372   18.580  695.728   33.810  723.871   22.240  183.433   4.4689  187.251   2.8796 -3.817993 5.316330 
1 1 1   18   10   13 o   92.465   3.4164  195.791   11.694  121.853   18.853  242.025   14.909   76.680   5.9613  108.250   3.3392 -31.57003 6.832822 
1 1 1   18   10   14 f  237.480   2.8331  1161.47   25.185  1176.11   46.893  1155.53   29.857  238.411   4.7688  236.549   3.0602 1.861389 5.666294 
1 1 1   18   10   15 o  232.889   2.8650  1124.87   26.042  1110.03   44.605  1132.54   32.076  231.625   4.6691  234.152   3.3214 -2.527161 5.729951 
1 1 1   18   10   16 o  201.858   2.7018  850.364   20.802  820.487   37.022  864.149   25.147  199.152   4.5072  204.563   2.9805 -5.411041 5.403555 
1 1 1   18   10   17 o  139.228   2.3577  402.992   13.174  389.240   21.043  411.857   16.895  137.232   3.7179  141.225   2.9005 -3.992279 4.715456 
1 1 1   18   10   18 o  399.635   3.2127  3304.62   52.951  3294.42   74.488  3315.04   75.287  399.017   4.5262  400.253   4.5606 -1.236481 6.425324 
1 1 1   18   10   19 o  112.914   2.6635  263.324   12.387  268.072   18.066  259.111   17.017  113.868   3.8467  111.960   3.6852 1.907677 5.327089 
1 1 1   18   10   20 o  273.617   2.8116  1547.68   31.534  1554.76   47.342  1542.03   42.279  274.136   4.1871  273.098   3.7535 1.038147 5.623264 
1 1 1   18   10   21 f  101.404   3.3662  220.158   13.358  239.575   16.908  187.901   21.792  107.634   3.8086   95.174   5.5515 12.46021 6.732387 
1 1 1   18   10   22 o  121.800   3.3154  308.302   15.457  309.842   18.687  304.967   27.501  122.392   3.7020  121.207   5.5011 1.184807 6.630754 
1 1 1   18   10   23 o   34.444   6.8662   22.880   9.8135   16.696   11.905   35.990   17.334   28.401   9.0331   40.486   10.343 -12.08460 13.73243 
1 1 1   18   10   24 o   59.111   3.9319   72.568   9.5575   80.639   13.800   65.126   13.250   62.282   5.3720   55.940   5.7428 6.342342 7.863727 
1 1 1   18   10   25 o   30.105   5.8020   18.960   8.2353   6.1504   11.749   31.333   11.547   22.211   8.7405   37.999   7.6327 -15.78798 11.60406 
1 1 1   18   10   26 o   25.117   6.4731   10.991   8.7110   13.240   12.757   9.0265   11.924   26.485   9.3597   23.749   8.9442 2.735828 12.94614 
1 1 1   18   10   27 o   33.905   7.2209   23.283   9.9079   29.511   19.552   21.131   11.493   36.771   11.563   31.039   8.6529 5.731415 14.44180 
1 1 1   18   10   28 f  131.396   2.6620  358.602   14.422  347.277   20.301  370.141   20.492  129.291   3.8070  133.501   3.7216 -4.209930 5.323924 
1 1 1   18   10   29 o   31.470   6.1996   21.719   8.3251   25.047   12.519   19.079   11.147   33.482   8.9090   29.459   8.6237 4.022951 12.39916 
1 1 1   18   10   30 o   32.834   6.0281   24.061   8.2367   24.588   11.571   23.520   11.727   33.197   8.4343   32.470   8.6147 0.7269173 12.05611 
1 1 1   18   10   31 o   35.422   5.8445   28.916   8.4818   21.186   12.548   35.420   11.509   30.755   9.1875   40.089   7.2266 -9.334608 11.68903 
1 1 1   18   10   32 o   38.536   7.2401   35.633   10.671   37.653   12.118   28.656   22.518   41.256   7.3929   35.815   12.451 5.441227 14.48025 
1 1 1   18   10   33 o   66.335   3.9644   91.873   10.770   80.464   14.302  106.818   16.369   61.639   5.6257   71.032   5.5873 -9.393188 7.928865 
1 1 1   18   10   34 o   59.631   3.9007   75.399   9.5837   77.474   13.937   73.537   13.200   60.384   5.5961   58.878   5.4356 1.505482 7.801417 
1 1 1   18   10   35 o   69.634   4.1503  106.254   11.572   87.597   17.516  120.704   15.415   63.718   6.6653   75.550   4.9471 -11.83153 8.300607 
1 1 1   18   10   36 o   22.626   5.8479   5.8212   8.1260   19.137   11.935  -5.6847   11.094   28.939   9.0233   16.313   7.4411 12.62537 11.69572 
1 1 1   18   10   37 o   32.831   7.1383   27.039   10.423   15.736   21.388   30.558   11.936   29.326   11.713   36.337   8.1633 -7.011024 14.27666 
1 1 1   18   10   38 o   36.472   6.2537   31.349   9.3994   39.587   13.856   24.328   12.793   41.083   8.4592   31.861   9.2130 9.222795 12.50748 
1 1 1   18   10   39 o   30.672   7.9791   16.275   11.147   10.756   12.454   38.514   25.000   23.689   9.0882   37.655   13.117 -13.96655 15.95821 
1 1 1   18   10   40 o   28.958   7.7791   7.8351   11.644  -2.2720   13.147   44.621   25.081   18.534   8.3097   39.383   13.153 -20.84834 15.55820 
1 1 1   18   10   41 o   24.686   8.2300   2.0229   12.264   2.8827   12.685 -10.2892   47.999   19.980   8.5760   29.391   14.049 -9.411465 16.45996 
1 1 1   18   10   42 o   31.072   8.2899   25.492   13.211   26.236   14.663   22.287   30.445   31.565   10.024   30.579   13.207 0.9864025 16.57982 
1 1 1   18   10   43 o   25.040   7.7567  -2.6346   12.181 -11.6251   13.482   37.307   28.417   15.906   7.5588   34.174   13.547 -18.26830 15.51340 
1 1 1   18   10   44 o   22.266   7.6106 -17.1759   20.920 -10.0256   31.762 -22.6545   27.802   23.704   11.357   20.828   10.134 2.876474 15.22114 
1 1 1   18   11    0 o   27.389   5.5511   18.868   7.6884   18.868   7.6884   18.868   7.6884   27.389   7.8505   27.389   7.8505 0.000000 0.000000 
1 1 1   18   11    1 o  184.368   2.1461  701.667   16.319  705.212   23.161  698.171   22.997  184.830   3.0382  183.906   3.0318 0.9246063 4.292144 
1 1 1   18   11    2 o  130.318   2.2551  347.445   11.956  369.228   18.737  332.485   15.528  133.723   3.3973  126.914   2.9665 6.808937 4.510167 
1 1 1   18   11    3 o  121.088   2.1005  302.550   10.488  294.231   14.686  311.208   14.983  119.389   2.9825  122.786   2.9585 -3.396980 4.200944 
1 1 1   18   11    4 o  104.967   2.3203  227.830   9.9264  225.230   15.211  229.759   13.101  104.435   3.5313  105.500   3.0108 -1.064697 4.640552 
1 1 1   18   11    5 f  262.893   2.6033  1429.57   28.040  1446.77   37.672  1408.20   41.987  264.694   3.4507  261.093   3.8990 3.600159 5.206699 
1 1 1   18   11    6 o  177.735   2.2853  653.719   16.655  667.068   22.507  637.561   24.762  179.757   3.0357  175.712   3.4168 4.045471 4.570536 
1 1 1   18   11    7 o   68.335   2.5960   96.363   7.2854   95.466   9.8359   97.453   10.844   67.988   3.5076   68.682   3.8280 -0.6939774 5.192029 
1 1 1   18   11    8 o  172.390   2.2996  615.620   16.216  629.857   21.727  597.719   24.363  174.663   3.0161  170.117   3.4723 4.546402 4.599269 
1 1 1   18   11    9 o  117.102   2.3200  283.780   11.073  287.127   14.625  279.285   16.948  117.926   3.0070  116.278   3.5339 1.647964 4.640096 
1 1 1   18   11   10 o  148.578   2.1114  455.224   12.930  433.111   17.959  479.024   18.631  144.835   3.0063  152.321   2.9656 -7.485931 4.222871 
1 1 1   18   11   11 o  210.873   2.7241  904.916   21.232  950.224   40.728  888.008   24.880  214.352   4.6068  207.393   2.9086 6.958984 5.448169 
1 1 1   18   11   12 o  164.497   2.6840  565.894   17.023  539.942   29.607  578.711   20.806  161.584   4.4425  167.411   3.0133 -5.826935 5.368088 
1 1 1   18   11   13 o  171.371   3.6828  605.358   21.865  613.126   45.829  603.069   24.880  171.893   6.4643  170.849   3.5307 1.043610 7.365670 
1 1 1   18   11   14 o   63.754   4.6280   84.091   12.169   0.0000   0.0000   84.091   12.169  ?   ?    63.754   4.6280      ?      ? 
1 1 1   18   11   15 o  147.873   2.3508  449.374   14.113  464.652   22.163  438.953   18.303  149.956   3.5834  145.790   3.0439 4.165482 4.701688 
1 1 1   18   11   16 o  216.857   2.7486  967.818   22.391  982.722   41.466  961.683   26.603  217.923   4.6135  215.792   2.9891 2.130768 5.497126 
1 1 1   18   11   17 o  116.759   3.0111  296.889   13.137  244.967   23.159  321.523   15.952  108.752   5.1632  124.766   3.0999 -16.01387 6.022239 
1 1 1   18   11   18 o   39.533   5.0188   33.084   7.9989   32.068   11.543   34.023   11.094   38.600   7.5210   40.465   6.6475 -1.864540 10.03766 
1 1 1   18   11   19 o   81.631   3.0179  137.895   10.128  123.687   14.148  152.831   14.506   77.306   4.4372   85.956   4.0918 -8.649582 6.035880 
1 1 1   18   11   20 o  130.694   4.0932  358.113   21.604  374.413   28.225  335.052   33.572  134.415   5.0912  126.973   6.4106 7.442345 8.186301 
1 1 1   18   11   21 o   81.197   3.1604  136.634   10.571  128.910   14.941  144.377   14.959   78.888   4.5920   83.506   4.3434 -4.617943 6.320739 
1 1 1   18   11   22 o   99.796   6.6776  161.551   14.720  154.062   15.198  274.996   59.152   86.247   4.2725  113.345   12.653 -27.09795 13.35513 
1 1 1   18   11   23 f   67.068   3.5736   93.413   9.8826   95.880   13.970   90.942   13.983   67.961   4.9838   66.175   5.1230 1.785675 7.147291 
1 1 1   18   11   24 f   94.811   2.9581  186.389   11.554  174.967   16.258  198.042   16.422   91.863   4.2911   97.759   4.0728 -5.896194 5.916152 
1 1 1   18   11   25 o  185.556   3.0003  719.105   22.801  657.095   33.293  773.882   31.291  177.892   4.5376  193.221   3.9265 -15.32838 6.000593 
1 1 1   18   11   26 o  135.952   3.4758  388.110   19.115  402.364   24.994  368.026   29.669  139.130   4.3557  132.774   5.4177 6.355621 6.951554 
1 1 1   18   11   27 o   51.790   6.0188   62.361   10.937   48.792   20.075   68.090   13.043   46.536   10.685   57.044   5.5439 -10.50808 12.03755 
1 1 1   18   11   28 o   62.449   5.4779   96.061   11.595  117.195   14.328   55.966   19.735   74.934   4.6360   49.965   9.9265 24.96881 10.95571 
1 1 1   18   11   29 o   30.665   6.2541   20.283   8.4661   26.584   12.554   15.026   11.466   34.476   8.7992   26.853   8.8899 7.622593 12.50827 
1 1 1   18   11   30 o   49.578   4.3850   52.035   8.9645   52.550   12.838   51.545   12.523   49.807   6.2495   49.349   6.1528 0.4587021 8.769986 
1 1 1   18   11   31 o  102.085   2.9989  218.029   12.625  213.367   17.764  222.788   17.948  100.974   4.2654  103.197   4.2167 -2.222321 5.997877 
1 1 1   18   11   32 o   36.091   7.1436   29.988   10.462   30.408   12.418   28.962   19.419   36.647   8.3960   35.535   11.560 1.111942 14.28728 
1 1 1   18   11   33 o   24.534   6.2689   11.168   8.1741   7.9987   10.992   15.088   12.225   22.248   8.5376   26.820   9.1819 -4.572144 12.53790 
1 1 1   18   11   34 o   62.857   3.8375   84.094   9.9301   80.859   14.295   87.111   13.805   61.618   5.6247   64.096   5.2219 -2.478233 7.675017 
1 1 1   18   11   35 f   52.882   4.4186   60.135   9.6316   60.204   13.865   60.070   13.390   52.873   6.3578   52.891   6.1380 -0.1752090E-01 8.837276 
1 1 1   18   11   36 o   18.872   5.6762   0.9399   7.7660   4.9476   11.613  -2.3027   10.445   20.822   8.5151   16.921   7.5081 3.900314 11.35249 
1 1 1   18   11   37 o   38.238   6.8983   39.015   11.047   20.759   21.718   45.387   12.832   31.042   11.977   45.435   6.8474 -14.39296 13.79656 
1 1 1   18   11   38 o   73.594   3.7304  116.971   11.270  109.848   16.396  123.349   15.515   71.283   5.5769   75.905   4.9558 -4.622375 7.460723 
1 1 1   18   11   39 o   24.390   7.4471   5.7979   11.317   4.4876   12.650   11.053   25.331   20.770   8.7241   28.009   12.072 -7.238281 14.89429 
1 1 1   18   11   40 o   27.938   7.7029   17.282   11.997   19.137   13.676   11.091   24.989   28.190   9.7088   27.687   11.962 0.5025921 15.40580 
1 1 1   18   11   41 o   25.091   8.5089  -0.3801   11.433  -1.4034   11.765   16.973   48.451   17.748   7.9159   32.434   15.065 -14.68625 17.01786 
1 1 1   18   11   42 o   63.240   8.0116  113.510   16.390  119.502   18.761   94.201   33.679   72.796   6.2487   53.685   14.755 19.11059 16.02317 
1 1 1   18   11   43 o   25.372   7.7329   11.885   12.871   12.403   14.365   9.7798   28.980   24.010   9.5954   26.734   12.129 -2.724848 15.46583 
1 1 1   18   11   44 o   32.796   13.939   39.016   32.915   39.016   32.915   0.0000   0.0000   32.796   13.939  ?   ?       ?      ? 
1 1 1   18   12    0 o  158.910   2.0839  521.559   19.301  521.559   19.301  521.559   19.301  158.910   2.9471  158.910   2.9471 0.000000 0.000000 
1 1 1   18   12    1 o  259.386   2.4034  1389.33   25.712  1387.87   36.323  1390.79   36.402  259.249   3.3971  259.522   3.4008 -0.2727051 4.806813 
1 1 1   18   12    2 o  325.977   2.7177  2195.05   36.537  2186.71   51.447  2203.53   51.898  325.354   3.8339  326.600   3.8528 -1.246277 5.435304 
1 1 1   18   12    3 o  116.047   2.1012  277.948   10.055  270.181   14.114  285.953   14.329  114.401   2.9913  117.694   2.9518 -3.293236 4.202490 
1 1 1   18   12    4 o  191.270   2.1675  755.005   17.094  743.640   23.819  767.073   24.545  189.788   3.0430  192.751   3.0875 -2.963821 4.335009 
1 1 1   18   12    5 f  151.883   2.2280  475.817   13.847  472.384   18.433  480.265   20.980  151.266   2.9545  152.499   3.3356 -1.233505 4.455910 
1 1 1   18   12    6 o  199.243   2.3404  819.528   19.065  817.633   25.332  822.003   28.954  198.996   3.0864  199.490   3.5190 -0.4942169 4.680784 
1 1 1   18   12    7 o  200.238   2.1988  827.826   18.158  835.183   25.861  820.673   25.501  201.115   3.1178  199.362   3.1013 1.753265 4.397572 
1 1 1   18   12    8 o  287.845   2.7443  1714.71   32.325  1734.09   43.233  1690.14   48.679  289.730   3.6179  285.961   4.1274 3.769318 5.488545 
1 1 1   18   12    9 o  151.611   2.4207  474.542   15.132  466.880   21.069  482.705   21.747  150.349   3.3976  152.872   3.4491 -2.523163 4.841475 
1 1 1   18   12   10 o  276.440   2.6815  1583.47   30.483  1501.99   44.092  1658.06   42.189  269.583   3.9655  283.296   3.6107 -13.71304 5.363081 
1 1 1   18   12   11 o  319.276   3.4693  2122.44   45.198  2011.66   68.081  2209.74   60.438  311.689   5.2959  326.863   4.4831 -15.17395 6.938659 
1 1 1   18   12   12 o  160.187   2.6333  534.197   15.884  520.575   28.994  540.038   18.986  158.647   4.4310  161.726   2.8464 -3.078568 5.266508 
1 1 1   18   12   13 o   50.016   5.6455   50.015   8.0306   57.436   21.377   48.795   8.6652   51.458   10.430   48.574   4.3252 2.883560 11.29101 
1 1 1   18   12   14 o   93.298   2.5950  180.691   9.7639  175.940   15.421  183.870   12.615   92.248   4.0531   94.347   3.2417 -2.099571 5.190019 
1 1 1   18   12   15 o  246.052   2.6053  1250.08   26.093  1258.45   40.360  1244.07   34.201  246.716   3.9664  245.388   3.3792 1.327530 5.210682 
1 1 1   18   12   16 o  187.089   2.7182  731.944   19.976  695.489   33.422  752.206   24.916  183.350   4.4196  190.828   3.1657 -7.478378 5.436386 
1 1 1   18   12   17 o   54.407   3.8243   61.644   7.7463   60.662   14.444   62.040   9.1776   54.042   6.4804   54.771   4.0627 -0.7291145 7.648601 
1 1 1   18   12   18 o   62.101   3.6053   79.522   9.2111   72.782   12.561   87.363   13.548   59.266   5.1386   64.936   5.0585 -5.670452 7.210686 
1 1 1   18   12   19 o  205.173   3.0585  873.580   25.279  882.668   32.530  859.726   40.164  206.604   3.8175  203.743   4.7795 2.860336 6.116988 
1 1 1   18   12   20 o   60.344   4.3929   76.383   10.584   78.602   13.495   72.837   17.061   61.557   5.3154   59.131   6.9954 2.426636 8.785757 
1 1 1   18   12   21 o  150.923   2.6717  470.640   16.544  465.083   22.225  477.546   24.775  149.950   3.5936  151.897   3.9545 -1.947754 5.343444 
1 1 1   18   12   22 o   43.469   8.0733   29.262   11.121   23.651   11.955   65.349   30.317   32.952   8.6766   53.985   13.617 -21.03350 16.14668 
1 1 1   18   12   23 o  143.172   2.5603  423.901   15.110  444.079   21.733  405.021   21.022  146.470   3.5976  139.874   3.6440 6.596344 5.120659 
1 1 1   18   12   24 o   59.545   3.8189   74.108   9.3367   67.676   13.409   80.162   13.009   56.994   5.7040   62.095   5.0795 -5.100578 7.637863 
1 1 1   18   12   25 o   65.081   3.9151   88.158   10.365   89.955   16.111   86.888   13.538   65.583   5.9563   64.578   5.0828 1.005104 7.830231 
1 1 1   18   12   26 o   57.925   4.1003   70.360   9.6243   54.195   13.265   88.325   13.985   50.805   6.3307   65.045   5.2127 -14.24057 8.200621 
1 1 1   18   12   27 o   70.871   5.2425  109.269   14.896   84.604   21.784  130.930   20.414   62.883   8.3990   78.859   6.2764 -15.97588 10.48507 
1 1 1   18   12   28 o   53.023   6.2096   76.314   11.057   32.235   19.424   97.445   13.448   37.768   11.464   68.279   4.7755 -30.51092 12.41921 
1 1 1   18   12   29 o   60.198   3.8484   76.099   9.5543   74.897   13.431   77.332   13.594   59.715   5.4532   60.682   5.4317 -0.9672279 7.696786 
1 1 1   18   12   30 f   85.481   4.0911  161.081   13.771  186.674   18.051  125.446   21.300   94.339   4.6392   76.623   6.7399 17.71619 8.182230 
1 1 1   18   12   31 o   84.529   3.4388  150.279   11.933  150.446   16.127  150.078   17.739   84.661   4.6185   84.397   5.0961 0.2641144 6.877547 
1 1 1   18   12   32 o   26.388   6.1257   13.848   7.9898   21.548   11.920   7.5653   10.767   30.877   8.8828   21.898   8.4378 8.978651 12.25149 
1 1 1   18   12   33 o   69.303   3.9447  103.028   11.078  108.319   14.624   95.904   16.970   71.627   4.9504   66.978   6.1430 4.648682 7.889400 
1 1 1   18   12   34 o   20.963   5.9973   4.4951   8.3551  -2.1306   12.567   9.7445   11.186   18.756   8.2829   23.171   8.6754 -4.414457 11.99452 
1 1 1   18   12   35 o   80.650   3.3283  137.596   11.057  138.129   16.058  137.115   15.248   80.748   4.8215   80.551   4.5896 0.1964569 6.656661 
1 1 1   18   12   36 o   33.635   5.9906   26.724   8.5254   18.733   12.308   34.094   11.820   28.603   9.1939   38.668   7.6824 -10.06521 11.98114 
1 1 1   18   12   37 o   71.169   5.3648  123.767   13.224   90.506   24.663  137.187   15.666   62.102   9.6289   80.235   4.7339 -18.13337 10.72962 
1 1 1   18   12   38 o   44.792   5.4332   46.918   9.5350   35.222   13.779   57.664   13.208   38.305   8.8926   51.279   6.2451 -12.97389 10.86644 
1 1 1   18   12   39 f   30.560   7.4997   24.445   12.417   31.200   14.299   3.7245   25.042   35.262   9.5818   25.859   11.540 9.403053 14.99934 
1 1 1   18   12   40 o   28.561   7.8344   11.476   11.770   3.4919   13.442   37.712   24.368   20.676   8.8502   36.447   12.930 -15.77110 15.66878 
1 1 1   18   12   41 o   35.042   7.2032   38.164   13.729   50.690   15.586  -5.1989   28.999   45.398   8.6396   24.685   11.528 20.71333 14.40642 
1 1 1   18   12   42 o   43.340   8.8921   47.233   15.362   47.233   15.362   0.0000   0.0000   43.340   8.8921  ?   ?       ?      ? 
1 1 1   18   12   43 o   22.400   7.3592  -2.2335   12.630  -6.2571   14.050   14.711   28.833   17.384   8.0870   27.415   12.298 -10.03073 14.71846 
1 1 1   18   12   44 o   28.635   8.9726   18.839   22.358  -4.8370   33.538   37.777   29.995   24.631   11.765   32.639   13.550 -8.008575 17.94514 
1 1 1   18   13    0 o  123.809   2.0835  316.828   15.027  316.828   15.027  316.828   15.027  123.809   2.9466  123.809   2.9466 0.000000 0.000000 
1 1 1   18   13    1 o   83.362   2.5471  147.291   8.5273  120.757   12.827  168.302   11.415   76.440   4.0686   90.284   3.0654 -13.84399 5.094180 
1 1 1   18   13    2 o  129.860   2.0688  348.172   11.080  344.778   15.687  351.550   15.652  129.227   2.9433  130.492   2.9081 -1.264740 4.137627 
1 1 1   18   13    3 o   77.961   2.3251  125.516   7.4757  125.280   10.515  125.757   10.630   77.887   3.2733   78.034   3.3029 -0.1469879 4.650114 
1 1 1   18   13    4 o   64.752   2.6708   86.739   7.1046   87.923   9.6641   85.345   10.480   65.240   3.5916   64.265   3.9540 0.9751968 5.341683 
1 1 1   18   13    5 o  194.502   2.3286  777.756   18.460  759.186   24.182  803.692   28.578  191.751   3.0577  197.253   3.5128 -5.501755 4.657113 
1 1 1   18   13    6 o  328.457   2.7348  2229.03   37.045  2215.95   51.982  2242.53   52.808  327.481   3.8485  329.433   3.8865 -1.951935 5.469604 
1 1 1   18   13    7 o  222.807   2.2667  1024.95   20.827  1013.47   29.148  1036.93   29.769  221.534   3.1901  224.080   3.2210 -2.545593 4.533389 
1 1 1   18   13    8 o  158.378   2.4664  517.859   16.106  500.716   22.492  535.900   23.073  155.688   3.5028  161.068   3.4732 -5.379410 4.932837 
1 1 1   18   13    9 o   76.755   2.7383  126.381   8.3346   99.293   12.768  146.492   11.002   69.288   4.4679   84.221   3.1672 -14.93295 5.476613 
1 1 1   18   13   10 o  203.661   2.3374  860.732   19.152  838.395   30.459  875.339   24.631  201.428   3.6663  205.895   2.9005 -4.467651 4.674899 
1 1 1   18   13   11 o  138.059   2.6478  395.009   13.666  391.250   25.360  396.547   16.223  137.532   4.4707  138.585   2.8383 -1.052521 5.295569 
1 1 1   18   13   12 o  225.140   3.6931  1047.66   25.339  1052.71   62.747  1046.67   27.698  225.147   6.7571  225.133   2.9829 0.1310730E-01 7.386238 
1 1 1   18   13   13 o  301.899   4.1982  1862.64   38.132  1930.70   96.642  1850.09   41.499  304.546   7.6939  299.253   3.3623 5.293610 8.396476 
1 1 1   18   13   14 o   94.614   2.9289  187.488   10.572  178.819   18.749  191.530   12.802   92.938   4.8912   96.290   3.2234 -3.352356 5.857851 
1 1 1   18   13   15 o  119.695   2.7924  299.221   13.062  286.645   22.139  305.936   16.179  117.695   4.5607  121.696   3.2233 -4.000565 5.584787 
1 1 1   18   13   16 o  129.613   2.7434  350.461   13.880  337.556   23.618  357.269   17.155  127.717   4.4836  131.508   3.1628 -3.791344 5.486830 
1 1 1   18   13   17 o  269.743   3.0783  1514.31   32.822  1475.05   54.524  1536.61   41.103  266.848   4.9541  272.637   3.6553 -5.789429 6.156630 
1 1 1   18   13   18 o   78.352   3.7310  131.703   11.441  143.885   14.503  111.633   18.615   83.390   4.2167   73.314   6.1563 10.07636 7.461972 
1 1 1   18   13   19 o  108.584   2.6646  243.917   11.930  250.493   16.853  237.313   16.890  110.055   3.7127  107.112   3.8231 2.943565 5.329196 
1 1 1   18   13   20 o  131.686   3.0888  365.331   16.439  399.011   21.853  321.430   24.949  138.865   3.8155  124.506   4.8585 14.35896 6.177598 
1 1 1   18   13   21 o  324.724   3.2808  2184.16   43.874  2145.25   60.198  2228.25   64.079  321.681   4.5372  327.767   4.7401 -6.085907 6.561615 
1 1 1   18   13   22 o  171.242   2.8468  598.782   19.419  575.233   24.262  640.763   32.394  166.717   3.5284  175.768   4.4685 -9.050964 5.693570 
1 1 1   18   13   23 o  272.657   3.3925  1521.95   36.668  1467.31   45.545  1622.64   61.822  266.040   4.1507  279.274   5.3671 -13.23425 6.784904 
1 1 1   18   13   24 o  103.911   2.8734  223.976   12.310  220.947   17.120  227.219   17.712  103.191   4.0225  104.632   4.1043 -1.440987 5.746789 
1 1 1   18   13   25 o   66.302   4.6818   93.676   12.428   98.396   16.028   86.558   19.682   68.593   5.6653   64.010   7.4552 4.583298 9.363557 
1 1 1   18   13   26 o  106.954   3.4050  241.803   14.287  249.404   17.825  228.145   23.893  109.540   3.9453  104.368   5.5507 5.172668 6.809931 
1 1 1   18   13   27 o   20.529   5.8958   4.1311   7.8120   5.0204   11.147   3.2729   10.951   21.020   8.4343   20.038   8.2403 0.9824333 11.79151 
1 1 1   18   13   28 o   49.941   5.4727   47.843   10.427   68.514   19.905   40.025   12.241   56.425   8.5532   43.457   6.8298 12.96831 10.94543 
1 1 1   18   13   29 o   40.197   5.2333   35.204   8.3455   48.905   12.322   23.593   11.343   48.010   6.2226   32.383   8.4159 15.62701 10.46652 
1 1 1   18   13   30 o  101.623   3.0623  215.867   12.776  220.055   19.086  212.467   17.196  102.447   4.5169  100.799   4.1363 1.647713 6.124691 
1 1 1   18   13   31 o   38.513   6.7428   38.708   10.714   46.214   12.397   16.554   21.298   46.515   6.4619   30.512   11.837 16.00262 13.48552 
1 1 1   18   13   32 o   38.619   5.6861   34.192   8.8965   23.656   13.020   43.420   12.185   32.205   9.2892   45.033   6.5602 -12.82812 11.37213 
1 1 1   18   13   33 o   28.913   5.8270   17.787   8.3841   3.7548   11.956   31.362   11.760   20.632   8.5592   37.195   7.9092 -16.56310 11.65396 
1 1 1   18   13   34 o   27.683   6.7441   16.457   9.3953   13.526   13.183   19.483   13.393   25.977   9.4725   29.388   9.6024 -3.410549 13.48829 
1 1 1   18   13   35 o   48.924   4.6081   52.266   9.2038   44.647   13.133   59.620   12.902   45.192   7.0459   52.656   5.9408 -7.464039 9.216201 
1 1 1   18   13   36 o   82.606   3.3366  145.207   11.353  144.021   16.442  146.288   15.695   82.213   4.8490   82.999   4.5847 -0.7861786 6.673266 
1 1 1   18   13   37 o   43.157   6.9592   51.243   11.485   30.129   22.628   58.570   13.330   34.564   12.439   51.751   6.2453 -17.18678 13.91839 
1 1 1   18   13   38 o   44.785   7.4055   52.825   12.323   55.558   14.175   44.372   24.934   49.835   6.8964   39.735   13.108 10.10004 14.81109 
1 1 1   18   13   39 o   40.900   10.277   33.522   13.758   28.679   14.341   89.517   48.762   33.723   9.7553   48.076   18.091 -14.35334 20.55373 
1 1 1   18   13   40 o   21.442   6.6911   1.3062   11.728   9.0210   13.356 -24.6848   24.515   22.783   9.2001   20.102   9.7182 2.680384 13.38223 
1 1 1   18   13   41 o   40.696   8.4285   46.826   13.825   45.903   15.687   50.037   29.262   42.543   9.2071   38.848   14.121 3.695614 16.85709 
1 1 1   18   13   42 o   60.171   6.9914   84.283   17.351   84.283   17.351   0.0000   0.0000   60.171   6.9914  ?   ?       ?      ? 
1 1 1   18   13   43 o   39.968   8.8796   44.989   14.725   36.136   17.056   70.900   29.180   35.276   10.751   44.659   14.135 -9.383083 17.75919 
1 1 1   18   14    0 o   58.371   2.6551   71.198   8.9542   71.198   8.9542   71.198   8.9542   58.371   3.7549   58.371   3.7549 0.000000 0.000000 
1 1 1   18   14    1 o   78.054   2.3086  125.673   7.4247  118.010   10.325  133.878   10.685   75.592   3.3116   80.517   3.2174 -4.925087 4.617192 
1 1 1   18   14    2 o  132.107   2.0746  360.196   11.301  371.790   16.134  349.028   15.835  134.194   2.9150  130.020   2.9528 4.174667 4.149289 
1 1 1   18   14    3 o  172.573   2.2590  616.225   15.967  625.893   21.449  604.206   23.913  174.109   2.9869  171.036   3.3899 3.072662 4.518034 
1 1 1   18   14    4 o  128.933   2.2097  343.451   11.675  344.845   15.667  341.710   17.509  129.237   2.9392  128.628   3.3004 0.6087036 4.419450 
1 1 1   18   14    5 o  233.590   2.4696  1128.76   23.632  1141.37   31.728  1113.05   35.416  235.081   3.2724  232.098   3.6996 2.982910 4.939203 
1 1 1   18   14    6 o  194.235   2.1788  778.956   17.453  767.115   24.499  791.159   24.870  192.736   3.0819  195.734   3.0806 -2.997406 4.357523 
1 1 1   18   14    7 o   70.554   2.6837  103.846   7.6973  109.591   10.235   96.368   11.678   72.836   3.4071   68.273   4.1473 4.563354 5.367337 
1 1 1   18   14    8 o  251.530   2.5822  1305.15   26.448  1293.76   34.677  1320.98   40.895  250.260   3.3595  252.801   3.9222 -2.541000 5.164323 
1 1 1   18   14    9 o  222.512   2.3871  1026.46   21.392  1005.55   33.971  1040.20   27.538  220.585   3.7340  224.440   2.9749 -3.854782 4.774146 
1 1 1   18   14   10 o  219.577   2.3869  1002.04   21.159  965.542   33.219  1026.96   27.448  216.150   3.7262  223.004   2.9842 -6.853943 4.773892 
1 1 1   18   14   11 o  133.187   2.6375  361.613   13.072  378.218   24.774  355.206   15.389  135.216   4.4422  131.158   2.8447 4.057678 5.274983 
1 1 1   18   14   12 o  158.119   3.4641  503.943   16.470  537.806   42.088  497.820   17.897  160.967   6.3395  155.272   2.7946 5.694366 6.928126 
1 1 1   18   14   13 o   86.568   3.2095  165.009   10.132  132.957   18.459  178.831   12.122   80.090   5.5880   93.046   3.1587 -12.95589 6.418989 
1 1 1   18   14   14 o  135.886   2.3732  382.377   13.051  376.945   20.464  386.101   16.945  135.046   3.6740  136.727   3.0048 -1.681366 4.746329 
1 1 1   18   14   15 o  217.170   2.4183  979.637   21.204  949.349   33.336  1000.22   27.479  214.288   3.7718  220.053   3.0276 -5.764557 4.836605 
1 1 1   18   14   16 o  213.921   2.5070  950.676   21.953  901.221   32.613  991.654   29.686  208.774   3.7874  219.069   3.2855 -10.29568 5.013903 
1 1 1   18   14   17 o  130.292   2.6514  349.287   13.125  355.480   23.844  346.595   15.721  131.050   4.4114  129.535   2.9427 1.515656 5.302821 
1 1 1   18   14   18 o   69.324   3.4990   99.754   9.7762   98.959   15.541  100.274   12.576   69.057   5.4566   69.591   4.3815 -0.5340500 6.997988 
1 1 1   18   14   19 f  143.269   2.4793  424.497   14.650  425.599   20.775  423.407   20.662  143.453   3.5113  143.084   3.5012 0.3687744 4.958641 
1 1 1   18   14   20 o   93.525   3.3292  181.482   12.694  180.928   19.467  181.891   16.743   93.360   5.0556   93.690   4.3329 -0.3293839 6.658315 
1 1 1   18   14   21 o  165.701   3.0500  565.815   20.774  528.118   28.010  611.903   30.971  159.615   4.2548  171.786   4.3712 -12.17079 6.100053 
1 1 1   18   14   22 o  106.106   2.9563  233.296   12.934  229.117   18.011  237.744   18.584  105.130   4.1537  107.083   4.2079 -1.953552 5.912656 
1 1 1   18   14   23 o  113.351   3.0772  263.698   13.993  253.934   17.682  280.057   22.887  110.658   3.8742  116.043   4.7819 -5.384392 6.154352 
1 1 1   18   14   24 o  134.339   2.8496  374.070   15.587  379.212   24.113  370.379   20.429  135.058   4.3289  133.619   3.7070 1.438965 5.699198 
1 1 1   18   14   25 o  118.119   2.8491  289.839   13.871  275.550   19.371  304.876   19.872  115.121   4.0798  121.116   3.9781 -5.995621 5.698195 
1 1 1   18   14   26 o  115.689   3.2219  281.441   14.865  288.189   18.898  270.491   24.074  117.705   3.8928  113.673   5.1349 4.032501 6.443705 
1 1 1   18   14   27 o  136.950   2.6372  389.933   14.896  385.792   20.985  394.139   21.147  136.215   3.7352  137.684   3.7239 -1.469009 5.274405 
1 1 1   18   14   28 o  103.318   3.5763  233.798   14.229  193.553   23.692  256.504   17.796   95.691   6.0029  110.946   3.8890 -15.25558 7.152615 
1 1 1   18   14   29 o  105.914   2.8822  234.423   12.589  236.731   17.935  232.180   17.676  106.425   4.0860  105.404   4.0660 1.021080 5.764317 
1 1 1   18   14   30 o   35.040   6.0910   27.954   8.8513   21.652   12.473   34.348   12.563   30.964   9.1385   39.116   8.0553 -8.151669 12.18198 
1 1 1   18   14   31 o   49.794   6.1700   56.298   11.115   57.824   13.246   52.666   20.430   52.113   6.1629   47.476   10.691 4.637482 12.34002 
1 1 1   18   14   32 o   22.835   6.6711  -0.8349   9.5543  -7.5938   11.159   17.733   18.495   15.857   7.3172   29.812   11.157 -13.95550 13.34219 
1 1 1   18   14   33 o   20.522   6.3151  -0.5847   10.146   5.8613   12.139 -15.5277   18.482   21.687   8.7662   19.358   9.0926 2.328632 12.63017 
1 1 1   18   14   34 f   29.635   5.1516   15.701   9.2629   40.926   12.419 -15.9250   13.906   43.323   6.9503   15.947   7.6059 27.37643 10.30322 
1 1 1   18   14   35 o   34.021   6.1250   26.904   8.6152   30.866   12.783   23.607   11.662   36.297   8.6598   31.746   8.6644 4.550808 12.25004 
1 1 1   18   14   36 o   83.409   3.3743  148.471   11.599  144.135   16.556  152.652   16.255   82.145   4.8866   84.673   4.6545 -2.527847 6.748570 
1 1 1   18   14   37 o   24.036   6.4593   11.334   8.8968   8.7515   13.280   13.437   11.983   23.079   9.2251   24.993   9.0438 -1.913492 12.91869 
1 1 1   18   14   38 o   23.168   6.5829   7.1733   11.022   17.461   12.599 -26.3832   22.755   27.144   9.3203   19.193   9.2989 7.951353 13.16578 
1 1 1   18   14   39 o   27.887   7.7934   15.394   11.532   13.298   13.079   22.715   24.444   24.873   9.3676   30.902   12.458 -6.029379 15.58674 
1 1 1   18   14   40 o   18.114   6.1821 -14.1213   11.402 -14.0175   13.033 -14.4598   23.542   15.178   7.2726   21.050   9.9990 -5.872145 12.36413 
1 1 1   18   14   41 o   29.926   8.4781   17.614   13.620   10.501   15.437   42.608   28.938   23.781   9.7821   36.071   13.850 -12.28982 16.95620 
1 1 1   18   14   42 o   29.786   10.280   24.514   15.336   24.514   15.336   0.0000   0.0000   29.786   10.280  ?   ?       ?      ? 
1 1 1   18   14   43 o   26.486   7.9389   7.0151   12.798  -2.7821   14.446   42.740   27.586   18.411   8.4331   34.562   13.453 -16.15071 15.87786 
1 1 1   18   15    0 o   9.7465   4.5642  -1.7467   6.8102  -1.7467   6.8102  -1.7467   6.8102   9.7465   6.4548   9.7465   6.4548 0.000000 0.000000 
1 1 1   18   15    1 o  139.662   2.0718  402.750   11.934  404.209   16.913  401.304   16.842  139.914   2.9308  139.410   2.9291 0.5035400 4.143619 
1 1 1   18   15    2 o  133.708   2.2115  369.486   12.103  371.429   16.175  367.014   18.244  134.120   2.9240  133.297   3.3185 0.8237915 4.422947 
1 1 1   18   15    3 o  131.519   2.2055  355.074   11.858  341.972   15.634  372.818   18.194  128.691   2.9456  134.348   3.2834 -5.657578 4.411019 
1 1 1   18   15    4 o  104.093   2.2502  223.372   9.6137  219.710   12.925  227.909   14.384  103.147   3.0381  105.040   3.3202 -1.892982 4.500354 
1 1 1   18   15    5 o  145.960   2.0772  439.802   12.503  447.790   17.848  432.104   17.521  147.261   2.9385  144.659   2.9366 2.602142 4.154335 
1 1 1   18   15    6 o   96.717   2.5163  193.464   9.9935  191.154   14.796  195.401   13.552   96.176   3.7300   97.257   3.3784 -1.080856 5.032531 
1 1 1   18   15    7 o  128.082   2.2659  339.954   11.851  347.265   15.786  330.511   17.940  129.680   2.9515  126.483   3.4389 3.197090 4.531813 
1 1 1   18   15    8 o  246.420   2.4119  1254.76   24.507  1269.10   34.396  1239.98   34.926  247.856   3.3647  244.984   3.4565 2.872101 4.823783 
1 1 1   18   15    9 o  129.057   2.2824  346.073   11.852  334.571   18.805  353.652   15.265  127.243   3.5832  130.871   2.8280 -3.628265 4.564762 
1 1 1   18   15   10 o  149.222   2.2708  460.882   13.616  455.866   21.818  464.081   17.425  148.527   3.5616  149.917   2.8181 -1.389954 4.541677 
1 1 1   18   15   11 o  227.833   3.6544  1080.29   25.894  1067.24   62.244  1083.02   28.476  226.670   6.6579  228.996   3.0149 -2.325958 7.308724 
1 1 1   18   15   12 o   83.247   4.1715  149.302   10.239  135.824   25.723  151.840   11.162   80.757   7.7229   85.737   3.1565 -4.979706 8.343028 
1 1 1   18   15   13 o  130.750   2.7695  365.514   13.800  320.749   23.945  387.778   16.887  124.479   4.6639  137.021   2.9881 -12.54187 5.539042 
1 1 1   18   15   14 o  132.637   2.3896  367.514   12.866  338.068   19.564  389.951   17.078  127.877   3.7094  137.398   3.0136 -9.520653 4.779297 
1 1 1   18   15   15 o  253.528   2.7962  1316.77   29.082  1210.83   38.747  1453.44   44.009  241.974   3.8824  265.081   4.0252 -23.10725 5.592489 
1 1 1   18   15   16 o  288.058   2.9679  1715.41   35.244  1659.78   48.945  1775.32   50.792  283.213   4.1901  292.902   4.2044 -9.688904 5.935880 
1 1 1   18   15   17 o  220.529   2.8416  1015.58   24.625  975.693   41.285  1037.60   30.679  217.016   4.6125  224.042   3.3201 -7.026840 5.683109 
1 1 1   18   15   18 o  119.668   2.7556  296.930   13.462  292.454   20.472  300.340   17.869  118.840   4.1767  120.496   3.5956 -1.655815 5.511126 
1 1 1   18   15   19 o  197.493   2.4631  806.773   20.062  817.905   28.579  795.959   28.169  198.836   3.4848  196.151   3.4818 2.685272 4.926179 
1 1 1   18   15   20 o  157.771   2.7045  515.310   17.592  509.153   24.497  521.866   25.281  156.805   3.7878  158.738   3.8614 -1.932678 5.409028 
1 1 1   18   15   21 o   48.006   5.7667   54.597   10.276   71.351   13.421   30.861   15.975   58.545   5.5583   37.467   10.106 21.07874 11.53338 
1 1 1   18   15   22 o  155.768   2.9342  504.198   18.615  507.638   24.513  499.513   28.610  156.477   3.7982  155.060   4.4735 1.416840 5.868454 
1 1 1   18   15   23 o  125.836   4.2121  338.462   17.585  343.485   19.792  319.634   38.319  128.674   3.7294  122.997   7.5536 5.676895 8.424142 
1 1 1   18   15   24 o   61.809   4.0795   81.112   10.200   73.760   15.606   86.594   13.476   59.220   6.3894   64.398   5.0739 -5.177952 8.158948 
1 1 1   18   15   25 o   26.063   6.1892   13.895   7.9254   11.097   11.680   16.283   10.789   24.594   8.9240   27.533   8.5783 -2.938681 12.37840 
1 1 1   18   15   26 o   36.623   5.8913   29.654   8.6213   31.312   13.263   28.441   11.345   37.420   8.7500   35.827   7.8910 1.593506 11.78263 
1 1 1   18   15   27 o   72.416   3.5938  109.147   10.621  115.497   16.425  104.584   13.925   74.142   5.3714   70.690   4.7759 3.452637 7.187578 
1 1 1   18   15   28 o   70.321   4.6637  110.177   12.404   92.617   21.394  119.070   15.224   65.381   7.9338   75.261   4.9046 -9.879875 9.327367 
1 1 1   18   15   29 o  108.280   2.8697  245.086   12.812  253.210   18.241  237.176   18.000  110.065   4.0183  106.494   4.0981 3.570244 5.739450 
1 1 1   18   15   30 o   32.968   5.9561   27.486   10.414   42.257   12.309  -9.7084   19.533   44.422   6.7185   21.515   9.8368 22.90717 11.91227 
1 1 1   18   15   31 o   58.261   4.1840   71.809   10.008   78.068   15.060   66.859   13.393   60.478   6.0375   56.043   5.7941 4.435177 8.367931 
1 1 1   18   15   32 o   75.308   3.5084  120.520   10.840  110.491   15.665  129.738   15.017   72.170   5.2626   78.447   4.6413 -6.276825 7.016887 
1 1 1   18   15   33 o   49.613   5.0884   55.714   9.8283   45.901   14.837   63.387   13.119   44.849   8.3276   54.377   5.8497 -9.528320 10.17686 
1 1 1   18   15   34 f   60.509   4.3487   80.161   10.674   91.731   14.677   67.173   15.551   65.509   5.4322   55.510   6.7923 9.999184 8.697402 
1 1 1   18   15   35 o   20.637   5.9502   4.0070   8.0666   10.453   12.448  -0.6602   10.592   23.731   9.0904   17.543   7.6803 6.188055 11.90047 
1 1 1   18   15   36 o   26.026   6.2507   13.548   8.6680   24.166   12.660   4.1780   11.893   31.680   9.1663   20.372   8.5008 11.30865 12.50137 
1 1 1   18   15   37 o   53.744   4.6750   64.468   10.319   58.065   14.583   70.890   14.603   50.854   6.9525   56.634   6.2518 -5.779739 9.349972 
1 1 1   18   15   38 f   35.593   8.5739   32.420   13.422   31.024   15.091   37.704   29.363   34.923   9.9793   36.263   13.945 -1.339615 17.14773 
1 1 1   18   15   39 o   26.346   7.9811   9.5698   16.020   19.377   21.694  -2.1909   23.758   29.013   11.722   23.678   10.834 5.334509 15.96217 
1 1 1   18   15   40 f   67.772   6.6617  108.959   16.585  101.884   19.348  128.557   32.204   66.439   7.0608   69.106   11.299 -2.667206 13.32339 
1 1 1   18   15   41 o   29.258   7.8265   23.883   13.398   28.865   15.314   7.6244   27.666   32.431   10.238   26.084   11.841 6.346598 15.65304 
1 1 1   18   15   42 o   18.997   8.5241   0.1623   13.862   0.1623   13.862   0.0000   0.0000   18.997   8.5241  ?   ?       ?      ? 
1 1 1   18   16    0 o  271.004   2.4573  1516.70   38.829  1516.70   38.829  1516.70   38.829  271.004   3.4752  271.004   3.4752 0.000000 0.000000 
1 1 1   18   16    1 o  144.045   2.0786  428.464   12.349  432.626   17.469  424.307   17.459  144.745   2.9261  143.345   2.9531 1.400223 4.157295 
1 1 1   18   16    2 o  305.393   2.8136  1930.97   35.203  1954.89   47.298  1901.27   52.709  307.561   3.7286  303.225   4.2146 4.336151 5.627172 
1 1 1   18   16    3 o   47.673   3.2430   46.687   6.3110   38.032   8.5672   56.956   9.3318   42.867   4.8457   52.479   4.3114 -9.611553 6.486020 
1 1 1   18   16    4 o  190.907   2.3179  751.778   18.099  744.739   24.040  760.989   27.500  189.897   3.0694  191.918   3.4742 -2.021225 4.635849 
1 1 1   18   16    5 o   57.350   2.7085   68.000   6.4046   70.031   9.0566   65.968   9.0582   58.209   3.7723   56.492   3.8877 1.717617 5.417070 
1 1 1   18   16    6 o  271.627   2.4695  1523.79   27.657  1497.71   38.529  1551.51   39.725  269.234   3.4697  274.020   3.5149 -4.786407 4.938978 
1 1 1   18   16    7 o   80.102   2.8016  133.677   9.1835  118.409   13.271  147.705   12.721   75.664   4.2526   84.540   3.6483 -8.875992 5.603127 
1 1 1   18   16    8 o  110.212   2.3102  250.292   10.199  253.581   16.578  248.289   12.937  110.771   3.6285  109.653   2.8605 1.117378 4.620452 
1 1 1   18   16    9 o  128.736   2.2869  344.697   11.833  331.610   18.804  353.277   15.226  126.673   3.5991  130.799   2.8225 -4.126320 4.573851 
1 1 1   18   16   10 o  184.684   2.3039  704.353   17.077  705.860   27.541  703.411   21.765  184.807   3.6133  184.561   2.8593 0.2458954 4.607750 
1 1 1   18   16   11 o  182.833   3.5331  715.958   21.254  653.208   46.534  732.499   23.891  177.354   6.3616  188.313   3.0761 -10.95895 7.066271 
1 1 1   18   16   12 o  140.131   2.7149  422.471   14.340  363.907   25.236  450.401   17.427  132.585   4.6148  147.676   2.8613 -15.09142 5.429863 
1 1 1   18   16   13 o  316.409   3.2954  2095.58   41.181  1991.64   68.073  2155.59   51.718  309.959   5.3248  322.858   3.8839 -12.89880 6.590751 
1 1 1   18   16   14 o  210.454   2.6197  907.589   22.637  817.750   30.405  1019.32   33.908  198.873   3.7069  222.035   3.7026 -23.16190 5.239315 
1 1 1   18   16   15 o  177.748   2.3513  659.441   16.918  616.623   26.103  690.459   22.217  172.681   3.6650  182.816   2.9464 -10.13527 4.702528 
1 1 1   18   16   16 o  156.895   2.3499  510.041   14.811  503.818   23.738  514.007   18.952  156.064   3.6878  157.725   2.9133 -1.660919 4.699733 
1 1 1   18   16   17 o  109.868   2.6621  250.619   12.009  239.496   17.603  260.302   16.425  107.559   3.9681  112.177   3.5500 -4.617653 5.324278 
1 1 1   18   16   18 o  163.079   2.6238  552.462   17.493  534.501   26.311  566.691   23.418  160.651   3.9708  165.507   3.4306 -4.855911 5.247529 
1 1 1   18   16   19 o   80.642   3.1303  134.995   10.400  141.710   14.669  128.211   14.747   82.673   4.3021   78.612   4.5482 4.060913 6.260527 
1 1 1   18   16   20 o  252.446   2.7465  1320.22   28.454  1322.34   42.424  1318.49   38.361  252.571   4.0725  252.321   3.6861 0.2508087 5.493016 
1 1 1   18   16   21 o  112.110   3.1417  258.951   14.345  248.107   18.688  274.504   22.380  109.331   4.1443  114.889   4.7230 -5.558167 6.283485 
1 1 1   18   16   22 o  171.261   2.6778  608.648   18.913  600.703   26.774  616.560   26.720  170.137   3.8155  172.384   3.7582 -2.247009 5.355556 
1 1 1   18   16   23 o   76.795   3.5652  126.082   10.910  109.923   17.167  137.030   14.130   72.427   5.7467   81.163   4.2210 -8.735840 7.130355 
1 1 1   18   16   24 o   82.051   3.6011  135.424   11.940  113.429   15.167  171.274   19.363   73.650   4.9930   90.451   5.1904 -16.80124 7.202154 
1 1 1   18   16   25 o   53.807   4.0199   60.706   8.9039   66.243   12.915   55.690   12.292   56.159   5.5758   51.455   5.7920 4.704197 8.039701 
1 1 1   18   16   26 o   43.175   4.6309   39.461   8.2352   40.118   12.002   38.876   11.321   43.489   6.6912   42.861   6.4039 0.6286888 9.261850 
1 1 1   18   16   27 o   73.418   3.4095  114.330   10.211   97.861   14.712  129.637   14.184   68.147   5.2344   78.689   4.3703 -10.54244 6.818934 
1 1 1   18   16   28 o   54.565   5.8665   71.260   10.872   54.204   20.446   77.982   12.836   48.296   10.559   60.835   5.1160 -12.53920 11.73308 
1 1 1   18   16   29 o   57.930   5.9611   80.672   12.135   91.537   14.794   58.334   21.213   65.793   5.4518   50.068   10.603 15.72541 11.92222 
1 1 1   18   16   30 o   46.727   6.3878   53.471   10.918   60.368   13.191   38.465   19.457   53.234   6.0079   40.221   11.275 13.01291 12.77564 
1 1 1   18   16   31 o   67.374   4.1214   96.633   11.432   92.482   15.610  101.435   16.790   65.850   5.7474   68.899   5.9086 -3.049187 8.242799 
1 1 1   18   16   32 o   30.869   6.3191   22.735   8.8848   13.538   14.217   28.629   11.381   26.337   9.7963   35.402   7.9848 -9.065477 12.63818 
1 1 1   18   16   33 o   81.772   3.6850  141.301   12.216  148.418   19.313  136.553   15.773   83.261   5.6238   80.282   4.7635 2.979378 7.370062 
1 1 1   18   16   34 o   28.746   6.3691   19.213   8.3969   19.213   11.988   19.214   11.765   28.750   9.0561   28.743   8.9581 0.7625580E-02 12.73815 
1 1 1   18   16   35 o   34.054   6.3018   27.738   8.9936   31.381   12.850   24.239   12.592   36.324   8.6932   31.784   9.1257 4.540474 12.60354 
1 1 1   18   16   36 o   43.218   7.0045   49.823   11.276   36.439   22.590   54.263   13.012   36.834   12.482   49.603   6.3604 -12.76901 14.00907 
1 1 1   18   16   37 o   23.112   7.0874   4.0592   10.839   2.1287   12.426   10.204   22.170   19.614   8.4544   26.610   11.377 -6.995823 14.17476 
1 1 1   18   16   38 o   31.643   7.9972   20.452   16.138   47.345   22.123 -10.1291   23.592   41.121   12.180   22.165   10.367 18.95671 15.99435 
1 1 1   18   16   39 o   51.228   6.9265   60.180   12.689   52.756   14.604   83.049   25.632   47.597   7.4392   54.860   11.686 -7.263622 13.85297 
1 1 1   18   16   40 o   44.982   8.0567   59.932   14.736   63.813   17.228   49.347   28.449   51.559   8.1014   38.406   13.929 13.15274 16.11344 
1 1 1   18   16   41 o   33.320   8.3144   23.807   12.963   12.098   14.818   61.973   26.754   23.806   9.6635   42.833   13.533 -19.02736 16.62878 
1 1 1   18   16   42 o   19.949   6.6335  -3.4804   11.767  -1.9471   13.169  -9.5522   26.206   17.928   8.1503   21.970   10.468 -4.041977 13.26703 
1 1 1   18   17    0 o   39.316   3.7717   33.659   8.2004   33.659   8.2004   33.659   8.2004   39.316   5.3340   39.316   5.3340 0.000000 0.000000 
1 1 1   18   17    1 o  155.156   2.2362  497.424   14.202  498.673   18.967  495.831   21.427  155.393   2.9593  154.919   3.3534 0.4746094 4.472432 
1 1 1   18   17    2 o  219.115   2.4181  992.733   21.693  998.269   29.017  985.719   32.662  219.834   3.2003  218.396   3.6260 1.437653 4.836271 
1 1 1   18   17    3 o  170.433   2.2611  598.956   15.754  592.160   20.879  607.938   24.004  169.331   2.9896  171.536   3.3929 -2.205063 4.522101 
1 1 1   18   17    4 o  126.177   2.0964  328.771   10.909  324.438   15.368  333.173   15.489  125.339   2.9727  127.016   2.9567 -1.677094 4.192771 
1 1 1   18   17    5 o  169.003   2.1191  589.779   14.769  580.609   20.732  599.229   21.046  167.670   2.9979  170.337   2.9957 -2.667511 4.238111 
1 1 1   18   17    6 o  148.382   2.2884  454.200   13.828  450.904   18.140  458.773   21.367  147.760   2.9765  149.005   3.4767 -1.244354 4.576832 
1 1 1   18   17    7 o  292.448   2.8235  1765.88   33.747  1787.06   51.448  1749.89   44.708  293.935   4.2437  290.961   3.7255 2.973419 5.647027 
1 1 1   18   17    8 o  193.537   2.3207  772.079   18.019  781.495   29.161  766.262   22.918  194.449   3.6360  192.625   2.8847 1.823883 4.641342 
1 1 1   18   17    9 o  139.061   2.2554  399.079   12.592  401.379   20.309  397.643   16.049  139.357   3.5334  138.764   2.8042 0.5932770 4.510891 
1 1 1   18   17   10 o  162.967   2.6187  557.525   16.232  526.840   28.872  571.706   19.628  159.556   4.3873  166.378   2.8603 -6.821976 5.237304 
1 1 1   18   17   11 o  108.767   3.7340  252.933   12.315  233.886   30.030  256.783   13.503  106.036   6.8666  111.499   2.9362 -5.463104 7.468007 
1 1 1   18   17   12 o  155.863   2.6918  490.493   15.849  531.833   29.520  473.751   18.786  160.288   4.4652  151.438   3.0076 8.849808 5.383695 
1 1 1   18   17   13 o  124.918   2.9061  330.929   14.173  296.629   23.611  350.248   17.720  119.657   4.7843  130.180   3.3003 -10.52267 5.812210 
1 1 1   18   17   14 o  247.441   2.5212  1267.41   25.041  1260.74   40.294  1271.61   31.962  246.829   3.9580  248.052   3.1241 -1.222794 5.042421 
1 1 1   18   17   15 o  142.976   2.3409  417.247   13.390  444.458   22.077  401.413   16.841  146.576   3.6518  139.376   2.9296 7.200363 4.681718 
1 1 1   18   17   16 o  149.025   2.3311  456.002   13.888  472.385   22.803  446.342   17.511  151.090   3.6593  146.961   2.8890 4.129074 4.662223 
1 1 1   18   17   17 o   93.001   2.7643  178.656   10.571  184.909   15.678  173.445   14.313   94.477   4.0236   91.525   3.7916 2.952232 5.528626 
1 1 1   18   17   18 o  146.165   2.7981  443.148   16.369  440.379   26.529  444.850   20.800  145.713   4.4142  146.616   3.4397 -0.9027252 5.596179 
1 1 1   18   17   19 o   56.365   4.1205   66.894   9.4586   61.226   14.173   71.445   12.701   54.134   6.3479   58.597   5.2552 -4.463238 8.240955 
1 1 1   18   17   20 o   61.419   4.2064   78.938   10.395   79.144   13.326   78.618   16.611   61.615   5.2438   61.222   6.5786 0.3937149 8.412786 
1 1 1   18   17   21 o  106.846   2.7816  236.301   12.223  246.308   18.112  227.931   16.564  108.899   4.0326  104.794   3.8324 4.105125 5.563225 
1 1 1   18   17   22 o   74.072   3.1978  114.163   9.7546  116.587   14.253  112.028   13.378   74.794   4.6204   73.349   4.4223 1.444572 6.395662 
1 1 1   18   17   23 o   33.136   6.1225   24.320   8.3650   25.168   13.051   23.728   10.898   33.583   9.1659   32.690   8.1196 0.8927994 12.24506 
1 1 1   18   17   24 o   61.134   4.1696   79.255   10.231   81.419   13.154   75.943   16.276   62.351   5.1151   59.917   6.5863 2.434471 8.339293 
1 1 1   18   17   25 o   78.458   3.1399  128.675   10.141  126.065   14.715  131.037   13.996   77.665   4.5937   79.251   4.2819 -1.585739 6.279848 
1 1 1   18   17   26 o   68.565   3.4866   99.524   9.7849   90.164   14.265  107.842   13.447   65.401   5.2883   71.729   4.5453 -6.328407 6.973284 
1 1 1   18   17   27 o   97.672   2.9542  200.073   11.870  188.058   17.030  211.423   16.553   94.752   4.3578  100.592   3.9898 -5.840157 5.908397 
1 1 1   18   17   28 o   29.996   7.2226   19.784   10.496   12.673   19.558   22.660   12.439   28.387   11.243   31.605   9.0692 -3.217770 14.44525 
1 1 1   18   17   29 o   78.384   3.5984  128.456   11.536  138.470   17.724  121.097   15.194   80.932   5.3098   75.837   4.8578 5.095306 7.196709 
1 1 1   18   17   30 o   59.767   4.9365   75.562   11.633   71.378   14.316   83.693   19.958   57.762   6.0090   61.773   7.8337 -4.010548 9.872917 
1 1 1   18   17   31 o   24.392   6.3163   10.956   8.1947   15.106   13.000   8.2199   10.556   26.814   9.4514   21.970   8.3818 4.844215 12.63259 
1 1 1   18   17   32 o   20.066   5.8828   3.1412   8.2611  -5.1742   13.498   8.1217   10.446   18.360   8.3087   21.772   8.3304 -3.412270 11.76567 
1 1 1   18   17   33 f   82.490   4.4735  149.474   13.695  143.638   25.305  151.892   16.287   80.382   7.6329   84.597   4.6679 -4.215141 8.947060 
1 1 1   18   17   34 o   72.302   3.6172  112.316   10.757  106.405   15.496  117.814   14.944   70.337   5.3417   74.266   4.8788 -3.928757 7.234381 
1 1 1   18   17   35 o   26.178   6.4582   15.419   8.5949   16.816   11.942   13.919   12.380   26.982   9.0756   25.373   9.1905 1.608372 12.91636 
1 1 1   18   17   36 o   62.293   3.9918   85.260   10.200   79.138   14.818   90.772   14.061   59.931   5.9948   64.656   5.2728 -4.724884 7.983685 
1 1 1   18   17   37 o   35.360   7.8415   29.181   11.450   24.148   13.233   44.178   22.842   31.107   9.4670   39.612   12.503 -8.504881 15.68298 
1 1 1   18   17   38 o   48.282   8.3123   63.982   16.596   49.420   22.432   81.592   24.668   41.386   12.266   55.177   11.222 -13.79103 16.62455 
1 1 1   18   17   39 o   33.579   8.3853   32.094   13.748   32.818   15.670   29.673   28.653   34.957   10.222   32.202   13.295 2.755581 16.77069 
1 1 1   18   17   40 o   44.311   8.4421   51.562   14.570   40.853   17.115   79.753   27.770   38.274   10.518   50.348   13.208 -12.07433 16.88427 
1 1 1   18   17   41 o   42.936   8.0097   59.909   15.128   66.198   17.679   42.710   29.235   51.576   8.3109   34.295   13.695 17.28111 16.01939 
1 1 1   18   18    0 o   18.086   6.2452   9.9819   7.7788   9.9819   7.7788   9.9819   7.7788   18.086   8.8320   18.086   8.8320 0.000000 0.000000 
1 1 1   18   18    1 o   38.377   3.7577   30.654   5.9117   32.047   8.0478   29.022   8.7125   39.339   4.9600   37.414   5.6461 1.925674 7.515312 
1 1 1   18   18    2 o   73.573   2.5132  111.174   7.5967  104.320   10.209  119.678   11.372   71.051   3.4837   76.095   3.6233 -5.044067 5.026350 
1 1 1   18   18    3 o  148.148   2.0997  453.293   12.829  453.662   18.135  452.923   18.152  148.208   2.9668  148.087   2.9719 0.1212616 4.199314 
1 1 1   18   18    4 o  187.645   2.1621  727.131   16.732  715.568   23.446  739.129   23.884  186.126   3.0542  189.165   3.0613 -3.038773 4.324289 
1 1 1   18   18    5 o  192.577   2.1765  765.691   17.283  782.884   24.795  749.445   24.102  194.677   3.0880  190.477   3.0680 4.200806 4.352963 
1 1 1   18   18    6 o  245.132   2.6063  1241.33   26.151  1249.29   39.548  1235.16   34.860  245.794   3.9011  244.471   3.4573 1.322403 5.212646 
1 1 1   18   18    7 o  233.959   2.5641  1127.46   24.491  1159.21   37.632  1104.13   32.258  236.770   3.8535  231.147   3.3837 5.622879 5.128256 
1 1 1   18   18    8 o  102.394   2.4007  219.049   9.8484  206.177   15.685  227.426   12.653   99.856   3.8085  104.933   2.9237 -5.076904 4.801357 
1 1 1   18   18    9 o  132.606   2.2903  365.802   12.184  352.413   19.466  374.426   15.623  130.566   3.6148  134.646   2.8133 -4.080765 4.580562 
1 1 1   18   18   10 o   39.310   5.0172   33.242   6.9400   31.842   13.568   33.738   8.0764   38.265   8.7832   40.356   4.8523 -2.091312 10.03437 
1 1 1   18   18   11 o   89.357   2.8766  155.636   9.4810  186.837   18.779  144.963   10.984   94.959   4.7949   83.755   3.1796 11.20463 5.753277 
1 1 1   18   18   12 o   93.952   2.9392  178.937   10.335  191.740   19.506  173.941   12.186   96.168   4.9177   91.735   3.2206 4.432991 5.878498 
1 1 1   18   18   13 f   74.116   3.4169  115.121   9.0460  111.457   17.924  116.373   10.478   73.213   5.9357   75.019   3.3865 -1.805626 6.833868 
1 1 1   18   18   14 o   94.350   2.5810  186.669   9.6993  174.189   15.638  194.471   12.365   91.708   4.1344   96.992   3.0909 -5.283829 5.162094 
1 1 1   18   18   15 o  100.951   2.5393  213.984   10.199  198.600   16.461  223.568   12.993   97.911   4.0762  103.990   3.0293 -6.078468 5.078609 
1 1 1   18   18   16 o  111.528   2.6369  258.548   12.065  246.118   17.745  269.233   16.453  108.998   3.9472  114.058   3.4975 -5.059082 5.273774 
1 1 1   18   18   17 o  179.318   2.8386  653.706   20.579  606.855   26.230  728.719   33.190  171.183   3.7151  187.453   4.2929 -16.27013 5.677213 
1 1 1   18   18   18 o   55.314   3.8835   64.649   8.7192   52.693   12.525   75.892   12.146   50.221   6.0467   60.407   4.8749 -10.18636 7.767061 
1 1 1   18   18   19 o   94.247   2.9682  184.701   11.382  183.418   17.565  185.629   14.944   93.908   4.5350   94.587   3.8307 -0.6793213 5.936336 
1 1 1   18   18   20 o   49.361   4.8811   51.395   9.7108   51.632   12.499   51.035   15.424   49.619   6.1076   49.104   7.6156 0.5144272 9.762181 
1 1 1   18   18   21 o   41.694   4.8272   36.073   7.8983   50.929   12.306   25.667   10.300   49.233   6.0604   34.155   7.5153 15.07771 9.654429 
1 1 1   18   18   22 o   90.358   2.9603  170.786   10.985  156.471   15.783  184.236   15.298   86.619   4.4177   94.098   3.9417 -7.478371 5.920601 
1 1 1   18   18   23 o   54.097   3.9346   62.015   8.6920   55.762   12.774   67.406   11.861   51.451   6.0196   56.742   5.0683 -5.290936 7.869114 
1 1 1   18   18   24 o   81.886   3.5479  138.764   11.745  132.025   15.027  149.349   18.831   79.471   4.5844   84.300   5.4160 -4.828674 7.095778 
1 1 1   18   18   25 o   81.390   3.4722  137.551   11.533  128.328   15.066  150.607   17.925   78.207   4.6706   84.572   5.1390 -6.364929 6.944308 
1 1 1   18   18   26 o   78.830   3.3080  131.408   10.631  123.342   16.001  137.782   14.225   76.526   5.0696   81.134   4.2510 -4.607330 6.615986 
1 1 1   18   18   27 o   40.345   5.2802   37.973   8.2660   24.519   12.462   48.542   11.046   32.811   8.9575   47.880   5.5933 -15.06855 10.56043 
1 1 1   18   18   28 o   53.173   4.2349   59.983   9.2545   62.145   13.772   58.203   12.497   53.990   6.1845   52.356   5.7871 1.633690 8.469866 
1 1 1   18   18   29 o   79.369   4.8237  137.109   15.662  123.140   22.751  149.692   21.592   75.216   7.3338   83.523   6.2680 -8.307533 9.647446 
1 1 1   18   18   30 o   39.692   7.3173   32.982   10.357   46.742   22.835   29.419   11.621   43.463   12.225   35.921   8.0442 7.541710 14.63458 
1 1 1   18   18   31 o   26.326   6.2741   15.103   8.3186   9.5626   12.595   19.389   11.079   23.598   9.1169   29.054   8.6222 -5.455946 12.54827 
1 1 1   18   18   32 o   26.973   6.2441   15.812   8.7610   5.1677   13.194   24.207   11.717   21.786   9.0109   32.159   8.6465 -10.37291 12.48829 
1 1 1   18   18   33 o   55.581   4.3382   67.330   9.9022   66.431   14.624   68.092   13.456   55.090   6.4362   56.072   5.8187 -0.9816628 8.676480 
1 1 1   18   18   34 o   52.536   4.3966   60.507   9.5119   58.288   13.646   62.604   13.265   51.495   6.4252   53.578   6.0031 -2.083210 8.793170 
1 1 1   18   18   35 f   48.731   5.1500   53.770   10.291   53.383   13.833   54.250   15.399   48.773   6.8764   48.689   7.6684 0.8372116E-01 10.29994 
1 1 1   18   18   36 o   23.762   6.3493   11.649   8.5406   9.8038   12.762   13.146   11.494   23.089   9.1022   24.435   8.8547 -1.346209 12.69867 
1 1 1   18   18   37 f   35.684   7.6745   32.570   11.297   30.839   13.072   37.678   22.454   35.118   8.9874   36.250   12.443 -1.132416 15.34909 
1 1 1   18   18   38 o   35.664   8.5569   37.557   15.353   43.566   20.675   30.168   22.925   38.850   11.836   32.478   12.361 6.371941 17.11386 
1 1 1   18   18   39 o   77.804   6.0088  145.879   16.684  143.739   19.398  151.960   32.702   79.947   5.8828   75.661   10.479 4.286308 12.01761 
1 1 1   18   18   40 o   28.555   8.0571   20.790   12.835   18.067   14.752   29.276   26.038   26.393   9.9469   30.717   12.678 -4.324289 16.11425 
1 1 1   18   19    0 o   40.187   3.9789   35.296   8.8028   35.296   8.8028   35.296   8.8028   40.187   5.6270   40.187   5.6270 0.000000 0.000000 
1 1 1   18   19    1 o  104.407   2.4028  225.303   10.344  219.202   14.610  231.436   14.649  102.987   3.4395  105.828   3.3561 -2.840355 4.805591 
1 1 1   18   19    2 o   71.948   2.5681  106.056   7.5851   94.230   10.213  120.601   11.327   67.513   3.6678   76.382   3.5955 -8.868813 5.136163 
1 1 1   18   19    3 o  160.753   2.1090  533.763   13.983  538.271   19.845  529.318   19.705  161.427   2.9807  160.079   2.9845 1.348572 4.218050 
1 1 1   18   19    4 o  120.918   2.1014  301.941   10.479  308.338   14.944  295.754   14.698  122.178   2.9656  119.658   2.9781 2.519882 4.202868 
1 1 1   18   19    5 o  217.300   2.3740  972.708   20.646  988.604   33.658  963.118   26.143  218.665   3.7320  215.935   2.9354 2.729996 4.748078 
1 1 1   18   19    6 o   35.479   4.7708   25.878   6.7759   44.107   10.471   12.745   8.8878   46.114   5.5052   24.843   7.7932 21.27127 9.541541 
1 1 1   18   19    7 o   90.958   2.6084  171.780   9.7331  162.829   14.296  179.514   13.288   88.725   3.9067   93.191   3.4573 -4.465172 5.216759 
1 1 1   18   19    8 o   87.129   2.5220  158.756   8.7871  149.284   14.059  164.828   11.257   84.942   4.0131   89.316   3.0557 -4.374779 5.044019 
1 1 1   18   19    9 o  142.064   2.5936  409.741   13.795  435.714   25.976  399.536   16.281  145.059   4.3416  139.069   2.8385 5.990189 5.187206 
1 1 1   18   19   10 o  136.164   2.6285  385.116   13.493  379.693   24.651  387.436   16.122  135.389   4.4145  136.939   2.8545 -1.550537 5.257024 
1 1 1   18   19   11 o  150.040   2.6993  469.447   15.499  456.203   27.465  475.635   18.773  148.375   4.4881  151.705   3.0004 -3.329483 5.398621 
1 1 1   18   19   12 o   81.146   3.1957  136.182   9.5267  137.204   18.261  135.799   11.167   81.260   5.4485   81.033   3.3412 0.2264938 6.391406 
1 1 1   18   19   13 o   32.800   5.9434   23.453   7.1227   21.743   15.240   23.931   8.0568   32.208   10.218   33.392   6.0737 -1.183670 11.88673 
1 1 1   18   19   14 o   78.585   2.7087  126.182   8.4880  134.497   14.112  121.470   10.625   80.548   4.2480   76.622   3.3619 3.925621 5.417363 
1 1 1   18   19   15 o  201.017   2.4006  838.997   19.410  823.256   30.946  849.205   24.920  199.378   3.7633  202.656   2.9815 -3.277695 4.801176 
1 1 1   18   19   16 o  138.553   2.3489  393.855   13.010  411.338   21.403  383.611   16.384  140.912   3.6827  136.195   2.9166 4.717514 4.697762 
1 1 1   18   19   17 o   88.975   2.8566  163.350   10.424  173.003   15.761  155.846   13.897   91.276   4.1867   86.673   3.8876 4.603058 5.713291 
1 1 1   18   19   18 o   33.720   5.1480   25.517   7.7984   6.0565   11.210   43.769   10.856   21.698   8.5380   45.742   5.7543 -24.04436 10.29609 
1 1 1   18   19   19 o  153.866   2.9532  492.678   18.713  499.746   25.871  484.923   27.099  155.064   4.0452  152.669   4.3036 2.395294 5.906368 
1 1 1   18   19   20 o   88.320   3.5267  162.828   12.830  159.538   17.624  166.537   18.713   87.395   4.8893   89.245   5.0838 -1.850540 7.053358 
1 1 1   18   19   21 f   58.071   4.1690   69.812   9.8767   57.270   13.139   86.109   14.977   52.127   6.1110   64.014   5.6726 -11.88669 8.338086 
1 1 1   18   19   22 o   64.647   3.7801   87.827   9.7720   86.867   15.839   88.417   12.417   64.226   5.9792   65.068   4.6268 -0.8415222 7.560267 
1 1 1   18   19   23 o   74.540   4.1423  118.195   12.385  121.488   15.915  113.137   19.723   76.083   5.0716   72.997   6.5509 3.085106 8.284691 
1 1 1   18   19   24 o   52.512   3.9755   57.824   8.5544   67.916   12.693   49.425   11.579   56.719   5.4258   48.304   5.8121 8.415867 7.951094 
1 1 1   18   19   25 o   60.335   4.0702   75.696   10.019   62.668   13.247   93.104   15.313   54.340   5.9108   66.331   5.5973 -11.99073 8.140490 
1 1 1   18   19   26 o   62.990   3.5262   83.388   9.1437   86.326   13.429   80.850   12.485   63.995   5.0879   61.985   4.8835 2.010094 7.052337 
1 1 1   18   19   27 o   20.399   6.2448   1.4467   8.7690  -7.9382   18.439   4.1896   9.9684   21.223   9.6466   19.575   7.9330 1.647655 12.48952 
1 1 1   18   19   28 o   37.852   5.6090   32.681   8.6182   24.715   12.513   39.869   11.887   32.720   8.9936   42.984   6.7050 -10.26420 11.21796 
1 1 1   18   19   29 o   96.309   4.2190  200.193   16.602  177.835   24.157  220.202   22.853   90.876   6.4452  101.741   5.4460 -10.86507 8.437983 
1 1 1   18   19   30 o   28.397   6.3128   18.053   8.1714   20.677   12.602   16.149   10.734   29.947   9.2609   26.847   8.5814 3.099895 12.62555 
1 1 1   18   19   31 o   55.500   5.6654   71.322   12.091   79.372   15.745   59.753   18.876   60.524   6.3072   50.476   9.4131 10.04860 11.33083 
1 1 1   18   19   32 o   62.276   4.2504   86.336   10.587   66.611   15.506  103.563   14.491   54.977   6.8383   69.575   5.0499 -14.59764 8.500857 
1 1 1   18   19   33 o   39.923   5.7098   37.334   8.9894   36.264   13.762   38.131   11.872   39.013   8.7662   40.833   7.3183 -1.819904 11.41950 
1 1 1   18   19   34 o   20.525   5.7180   4.6623   7.9502  -6.4988   11.907   13.640   10.679   16.410   7.5677   24.640   8.5740 -8.230074 11.43608 
1 1 1   18   19   35 o   26.666   6.1187   15.786   8.7033   3.4745   12.734   26.581   11.923   20.322   8.6541   33.010   8.6523 -12.68756 12.23746 
1 1 1   18   19   36 o   33.693   7.7456   25.947   11.088   20.419   12.811   42.453   22.136   28.719   9.3917   38.667   12.320 -9.948074 15.49123 
1 1 1   18   19   37 o   56.512   6.2933   77.610   12.864   76.476   15.325   80.315   23.670   58.158   6.3889   54.867   10.844 3.290844 12.58652 
1 1 1   18   19   38 o   25.146   8.1299   2.7444   17.792   11.237   30.724  -1.5402   21.823   27.737   12.546   22.555   10.344 5.182398 16.25989 
1 1 1   18   19   39 o   22.883   7.2395   5.0514   12.162   3.8358   13.867   9.1044   25.320   20.283   8.8361   25.483   11.470 -5.199900 14.47893 
1 1 1   18   19   40 o   28.182   8.0035   17.515   12.749   10.348   14.818   37.939   25.014   22.917   9.5196   33.447   12.869 -10.52989 16.00690 
1 1 1   18   20    0 o   79.989   3.2685  133.544   15.133  133.544   15.133  133.544   15.133   79.989   4.6223   79.989   4.6223 0.000000 0.000000 
1 1 1   18   20    1 o  108.151   2.3841  241.663   10.632  249.924   15.199  233.749   14.877  109.961   3.3513  106.340   3.3920 3.620689 4.768290 
1 1 1   18   20    2 o  124.151   2.1183  318.184   10.842  329.204   15.596  307.874   15.084  126.230   2.9955  122.073   2.9960 4.157784 4.236610 
1 1 1   18   20    3 o  136.408   2.1000  384.450   11.814  380.813   16.734  388.064   16.681  135.763   2.9885  137.053   2.9510 -1.289612 4.199969 
1 1 1   18   20    4 o  200.130   2.1309  827.183   17.532  832.301   25.890  822.849   23.827  200.687   3.1278  199.574   2.8946 1.112991 4.261731 
1 1 1   18   20    5 o  137.971   2.3135  395.740   12.991  378.650   19.823  408.607   17.200  135.316   3.5518  140.626   2.9654 -5.309769 4.627016 
1 1 1   18   20    6 o  112.405   2.4596  261.337   11.336  260.684   16.964  261.864   15.238  112.261   3.6637  112.549   3.2827 -0.2872772 4.919217 
1 1 1   18   20    7 o  199.423   2.3392  818.306   18.674  838.396   30.483  806.239   23.625  201.314   3.6713  197.532   2.8999 3.781647 4.678446 
1 1 1   18   20    8 o   46.093   3.7229   44.622   6.6821   42.507   11.386   45.733   8.2525   45.197   6.1081   46.989   4.2582 -1.791988 7.445891 
1 1 1   18   20    9 o  103.042   2.8439  229.809   10.906  195.925   19.551  245.117   13.141   97.179   4.8778  108.905   2.9255 -11.72616 5.687875 
1 1 1   18   20   10 o  204.731   2.4477  868.174   20.398  860.725   31.425  873.599   26.815  203.917   3.7364  205.545   3.1630 -1.627853 4.895442 
1 1 1   18   20   11 o   34.446   5.6238   28.105   7.0635   18.569   14.633   31.002   8.0653   30.259   10.044   38.633   5.0617 -8.374437 11.24756 
1 1 1   18   20   12 o   50.776   4.0544   51.528   7.4486   58.221   15.011   49.342   8.5793   52.767   6.8974   48.785   4.2638 3.982086 8.108882 
1 1 1   18   20   13 o   31.451   5.9258   19.123   6.7831   26.531   14.606   17.086   7.6590   34.861   9.7678   28.041   6.7118 6.820061 11.85150 
1 1 1   18   20   14 o   77.627   2.7893  122.547   8.5409  132.918   14.618  117.171   10.524   80.021   4.4291   75.233   3.3917 4.788063 5.578548 
1 1 1   18   20   15 o   28.996   5.0454   20.422   6.3026   7.3430   11.341   26.266   7.5811   22.489   8.6615   35.503   5.1772 -13.01429 10.09084 
1 1 1   18   20   16 o  155.087   2.3327  496.426   14.460  505.909   23.662  490.773   18.268  156.179   3.6733  153.995   2.8762 2.183456 4.665333 
1 1 1   18   20   17 o   88.879   2.9060  163.323   10.619  146.970   14.484  182.331   15.616   84.082   4.1766   93.676   4.0418 -9.594154 5.812029 
1 1 1   18   20   18 o  122.071   2.8645  310.303   14.189  312.265   18.515  307.511   22.086  122.632   3.6606  121.509   4.4070 1.123573 5.728966 
1 1 1   18   20   19 o   20.980   6.0193  -1.6757   8.7437 -11.6216   11.221   13.695   13.950   14.973   7.0494   26.986   9.7587 -12.01255 12.03855 
1 1 1   18   20   20 o   35.436   5.4334   30.099   8.0048   13.683   12.464   41.623   10.443   26.373   9.2580   44.499   5.6900 -18.12631 10.86674 
1 1 1   18   20   21 o   92.244   2.9200  177.997   11.028  170.836   16.429  183.870   14.878   90.484   4.4023   94.005   3.8373 -3.520386 5.839955 
1 1 1   18   20   22 o   57.693   4.1988   70.045   9.5681   71.795   16.097   69.088   11.898   58.040   6.7242   57.346   5.0306 0.6943398 8.397688 
1 1 1   18   20   23 o   43.073   4.9863   41.816   8.3203   31.843   12.472   49.814   11.169   37.607   8.2661   48.540   5.5791 -10.93295 9.972665 
1 1 1   18   20   24 o   36.934   6.5341   29.941   9.0625   33.827   17.685   28.556   10.553   38.064   10.777   35.804   7.3915 2.260036 13.06828 
1 1 1   18   20   25 o   25.244   5.8619   11.499   8.2377   23.057   11.211  -2.0647   12.145   31.910   8.4025   18.577   8.1760 13.33354 11.72383 
1 1 1   18   20   26 o  130.648   2.6312  356.525   14.167  339.121   19.975  374.142   20.097  127.404   3.8013  133.893   3.6392 -6.489197 5.262437 
1 1 1   18   20   27 o   20.662   5.4479   2.7140   7.5908 -12.1957   11.065   15.970   10.433   14.507   6.8804   26.818   8.4484 -12.31120 10.89571 
1 1 1   18   20   28 o   65.782   3.6453   91.967   9.8616   88.626   14.330   94.972   13.592   64.563   5.3814   67.001   4.9186 -2.437706 7.290520 
1 1 1   18   20   29 o   68.374   5.0601  112.348   12.254   79.005   21.965  127.417   14.766   59.117   9.0084   77.631   4.6117 -18.51461 10.12023 
1 1 1   18   20   30 o   51.194   4.1838   56.374   8.8067   57.429   13.020   55.484   11.957   51.558   6.1230   50.830   5.7032 0.7271042 8.367658 
1 1 1   18   20   31 o   62.306   4.1194   83.325   10.355   87.443   16.597   80.701   13.250   63.273   6.3598   61.338   5.2374 1.934704 8.238784 
1 1 1   18   20   32 o   51.758   4.3676   59.425   9.1541   51.484   13.626   65.957   12.358   48.221   6.8512   55.295   5.4189 -7.073505 8.735157 
1 1 1   18   20   33 o   26.596   6.3692   16.189   8.2360   18.725   12.723   14.360   10.805   28.046   9.3682   25.146   8.6315 2.899706 12.73835 
1 1 1   18   20   34 f   83.887   3.3350  152.310   11.447  135.236   16.516  168.093   15.879   79.070   5.0645   88.704   4.3404 -9.634315 6.669935 
1 1 1   18   20   35 o   27.031   6.4967   17.495   8.6232   18.269   12.844   16.860   11.635   27.491   9.4115   26.571   8.9583 0.9197865 12.99334 
1 1 1   18   20   36 o   27.032   8.6785   9.2055   12.026   8.4257   12.431   20.599   47.517   21.943   8.8706   32.120   14.919 -10.17751 17.35692 
1 1 1   18   20   37 o   59.619   5.5475   78.424   12.488   69.964   14.667  100.718   23.811   55.505   6.4069   63.734   9.0583 -8.228943 11.09509 
1 1 1   18   20   38 o   25.100   7.2093   12.745   13.188   23.324   15.472 -15.3575   25.217   29.187   10.309   21.013   10.081 8.173717 14.41869 
1 1 1   18   20   39 o   36.590   8.3362   40.050   13.353   37.879   15.456   46.440   26.517   36.982   9.9256   36.198   13.396 0.7836037 16.67231 
1 1 1   18   21    0 o   38.724   4.1956   33.140   8.8156   33.140   8.8156   33.140   8.8156   38.724   5.9335   38.724   5.9335 0.000000 0.000000 
1 1 1   18   21    1 o   69.195   3.3059   98.944   9.3496  101.559   14.292   96.988   12.362   69.969   4.9523   68.420   4.3806 1.549049 6.611786 
1 1 1   18   21    2 o  202.617   2.3672  847.077   19.580  861.729   30.024  836.235   25.828  204.101   3.5667  201.133   3.1134 2.967773 4.734400 
1 1 1   18   21    3 o   98.123   2.1599  199.181   8.7329  194.051   12.525  204.035   12.182   96.887   3.1344   99.360   2.9727 -2.473068 4.319894 
1 1 1   18   21    4 o  102.136   2.4217  220.294   9.8827  195.305   15.551  237.222   12.800   97.133   3.8818  107.140   2.8966 -10.00700 4.843404 
1 1 1   18   21    5 o   35.336   4.6395   26.816   6.3141   25.498   10.534   27.555   7.8884   34.248   7.6503   36.424   5.2508 -2.176941 9.278913 
1 1 1   18   21    6 o  166.670   2.4081  575.914   16.505  554.768   24.014  594.844   22.721  163.740   3.5559  169.599   3.2482 -5.858368 4.816165 
1 1 1   18   21    7 o  138.756   2.3244  397.293   13.084  403.385   20.512  393.114   16.989  139.614   3.5621  137.897   2.9871 1.717056 4.648824 
1 1 1   18   21    8 o  209.607   2.7291  908.874   21.511  912.415   39.644  907.396   25.610  209.714   4.5833  209.501   2.9638 0.2128906 5.458125 
1 1 1   18   21    9 o  171.705   2.6939  621.781   17.972  576.096   30.529  646.010   22.233  166.659   4.4414  176.751   3.0498 -10.09174 5.387736 
1 1 1   18   21   10 o   87.021   2.5463  154.297   8.8586  166.632   14.671  147.221   11.113   89.679   3.9666   84.363   3.1938 5.315422 5.092580 
1 1 1   18   21   11 o   78.266   3.1520  126.535   9.1634  128.473   17.284  125.777   10.807   78.575   5.3332   77.957   3.3612 0.6181641 6.304008 
1 1 1   18   21   12 o  104.960   2.8273  225.047   10.901  236.084   21.104  221.031   12.731  106.557   4.8018  103.363   2.9862 3.193481 5.654669 
1 1 1   18   21   13 o  175.297   2.7172  647.437   17.937  612.557   32.465  662.763   21.519  171.627   4.5863  178.967   2.9153 -7.340576 5.434449 
1 1 1   18   21   14 o  164.243   2.8367  565.465   18.258  542.672   30.770  577.852   22.683  161.481   4.6200  167.006   3.2931 -5.525375 5.673483 
1 1 1   18   21   15 f   65.672   3.5378   97.696   8.3858   72.860   15.113  108.746   10.080   58.917   6.2191   72.427   3.3744 -13.51001 7.075565 
1 1 1   18   21   16 o  161.504   2.3675  541.616   15.267  538.255   24.893  543.642   19.328  160.987   3.7490  162.022   2.8924 -1.034836 4.735080 
1 1 1   18   21   17 o   60.790   3.5232   77.264   8.8333   77.161   12.536   77.366   12.449   60.746   5.0036   60.834   4.9616 -0.8793259E-01 7.046467 
1 1 1   18   21   18 o   35.641   5.1894   27.509   7.3308   32.096   11.202   24.072   9.6953   38.246   7.3685   33.035   7.3093 5.211155 10.37888 
1 1 1   18   21   19 o  105.422   3.0445  227.700   12.957  213.395   16.488  250.799   20.952  101.258   3.9480  109.585   4.6357 -8.326767 6.089054 
1 1 1   18   21   20 o   25.581   6.5956   12.778   8.6822  -1.5035   19.513   16.304   9.6947   23.892   10.443   27.271   8.0591 -3.378481 13.19111 
1 1 1   18   21   21 o   26.231   6.4503   14.092   8.1552   11.382   15.222   15.183   9.6584   26.109   10.040   26.354   8.1007 -0.2447815 12.90063 
1 1 1   18   21   22 o   59.751   3.6165   74.312   8.8541   83.367   13.496   67.471   11.732   62.886   5.2033   56.616   5.0242 6.270653 7.233054 
1 1 1   18   21   23 o   20.947   5.6909   5.9911   7.3018  -0.6782   10.868   11.479   9.8585   18.087   7.8510   23.807   8.2405 -5.720312 11.38174 
1 1 1   18   21   24 o   40.355   5.1676   38.204   8.0259   23.293   12.058   50.065   10.754   32.029   8.8389   48.681   5.3561 -16.65228 10.33510 
1 1 1   18   21   25 o   24.538   5.3939   11.103   7.4669  -4.6906   11.312   23.300   9.9403   16.936   7.6406   32.139   7.6156 -15.20280 10.78783 
1 1 1   18   21   26 o   24.210   6.2426   11.337   8.1092   12.457   11.468   10.218   11.468   24.851   8.8644   23.569   8.7922 1.282471 12.48521 
1 1 1   18   21   27 o   81.441   3.2989  140.175   10.951  113.808   15.177  168.817   15.818   73.291   5.0206   89.590   4.2808 -16.29872 6.597885 
1 1 1   18   21   28 o   85.001   3.6984  151.472   12.609  144.033   15.905  164.058   20.688   82.505   4.6740   87.496   5.7329 -4.990601 7.396771 
1 1 1   18   21   29 o   52.875   5.7921   64.837   10.804   59.491   20.203   66.979   12.787   49.853   10.170   55.896   5.5463 -6.043316 11.58414 
1 1 1   18   21   30 o   49.450   4.6163   51.936   9.1837   61.158   15.126   46.553   11.558   52.616   6.9703   46.284   6.0544 6.331127 9.232574 
1 1 1   18   21   31 o   51.543   4.4766   57.827   9.4811   63.218   14.169   53.456   12.758   53.669   6.4012   49.417   6.2596 4.252251 8.953111 
1 1 1   18   21   32 o   30.840   6.2865   22.692   8.4143   26.987   12.761   19.388   11.192   33.221   9.0620   28.460   8.7156 4.761137 12.57302 
1 1 1   18   21   33 o   25.016   6.3445   14.049   8.2545   12.589   13.252   14.975   10.551   24.638   9.3933   25.394   8.5310 -0.7559662 12.68905 
1 1 1   18   21   34 o   44.119   5.2560   45.808   9.1405   38.654   13.522   51.828   12.404   39.959   8.4678   48.280   6.2290 -8.320625 10.51208 
1 1 1   18   21   35 o   21.867   5.9316   6.5663   8.1511   18.150   12.238  -2.6707   10.928   27.103   9.1870   16.630   7.5056 10.47274 11.86320 
1 1 1   18   21   36 o   29.478   8.7477   18.938   12.420   18.899   12.868   19.469   47.488   27.395   9.4185   31.560   14.744 -4.165350 17.49530 
1 1 1   18   21   37 o   22.437   6.9684   5.6852   12.005   6.6288   14.739   3.8252   20.692   21.761   9.2897   23.113   10.389 -1.352100 13.93686 
1 1 1   18   21   38 o   41.183   8.4489   44.537   14.172   31.670   16.636   78.593   27.064   32.986   10.698   49.380   13.080 -16.39387 16.89777 
1 1 1   18   22    0 o   28.638   5.7098   20.596   8.2583   20.596   8.2583   20.596   8.2583   28.638   8.0749   28.638   8.0749 0.000000 0.000000 
1 1 1   18   22    1 o   79.999   2.4807  132.918   8.1480  126.443   11.924  138.589   11.160   78.149   3.6995   81.849   3.3058 -3.699921 4.961308 
1 1 1   18   22    2 o  134.956   2.2327  377.247   12.367  370.631   18.333  382.771   16.753  133.848   3.3208  136.064   2.9852 -2.215912 4.465350 
1 1 1   18   22    3 o   52.380   3.4822   52.790   7.0534   69.299   12.985   45.880   8.4007   57.720   5.4546   47.040   4.3300 10.67998 6.964320 
1 1 1   18   22    4 o  197.716   2.4099  810.321   19.421  799.436   29.731  818.423   25.649  196.503   3.6684  198.930   3.1261 -2.426880 4.819718 
1 1 1   18   22    5 o   65.824   3.0113   88.565   8.1163  101.561   12.399   78.822   10.736   69.987   4.2954   61.662   4.2215 8.324997 6.022580 
1 1 1   18   22    6 o   71.090   2.9630  104.977   8.6233  102.996   12.943  106.558   11.563   70.462   4.4538   71.718   3.9092 -1.256706 5.926085 
1 1 1   18   22    7 o   92.681   2.5425  180.374   9.3480  168.215   15.214  187.749   11.849   90.081   4.0948   95.281   3.0150 -5.199921 5.085067 
1 1 1   18   22    8 o  123.542   2.6989  325.582   12.439  293.920   22.582  339.375   14.905  118.968   4.6023  128.115   2.8207 -9.147179 5.397899 
1 1 1   18   22    9 o  265.792   2.8772  1465.34   31.535  1479.62   45.120  1451.70   44.092  267.047   4.0965  264.537   4.0412 2.509430 5.754373 
1 1 1   18   22   10 o   76.935   2.9941  124.684   9.3326  111.552   14.134  134.837   12.427   73.231   4.6794   80.638   3.7365 -7.406708 5.988168 
1 1 1   18   22   11 o  115.677   3.6053  281.325   13.128  275.290   30.949  282.649   14.497  114.505   6.5532  116.850   3.0080 -2.344910 7.210531 
1 1 1   18   22   12 o   71.616   3.3574  106.519   8.6119  107.438   17.159  106.210   9.9568   71.646   5.8066   71.585   3.3723 0.6095123E-01 6.714886 
1 1 1   18   22   13 o   40.790   5.1854   36.934   7.0217   33.805   14.781   37.846   7.9796   38.948   9.3252   42.631   4.5382 -3.683254 10.37082 
1 1 1   18   22   14 o   42.328   4.5733   31.160   6.7729   51.453   15.324   26.234   7.5503   49.233   7.5468   35.424   5.1678 13.80922 9.146622 
1 1 1   18   22   15 o   98.440   2.5305  200.402   9.8595  204.377   16.516  198.201   12.290   99.098   4.0408   97.781   3.0473 1.317101 5.061037 
1 1 1   18   22   16 o   49.419   4.8009   53.208   7.6290   50.978   16.559   53.809   8.5956   48.010   8.6823   50.828   4.1002 -2.817913 9.601752 
1 1 1   18   22   17 o   54.510   4.3735   63.544   9.6307   68.074   12.711   57.440   14.757   56.964   5.4101   52.055   6.8732 4.908936 8.747014 
1 1 1   18   22   18 o   80.195   2.9705  135.189   9.7438  119.924   14.119  149.069   13.464   75.769   4.5182   84.622   3.8576 -8.853416 5.940937 
1 1 1   18   22   19 o   18.612   5.3884   2.0546   6.9340  -4.7170   10.496   7.2981   9.2364   16.310   7.3591   20.913   7.8729 -4.602219 10.77674 
1 1 1   18   22   20 o   78.022   3.0438  128.184   9.7214  119.589   14.345  135.484   13.220   75.504   4.6065   80.539   3.9797 -5.034500 6.087528 
1 1 1   18   22   21 o   31.449   6.3364   21.315   8.1232   25.586   14.689   19.434   9.7497   33.474   9.9271   29.424   7.8773 4.049509 12.67276 
1 1 1   18   22   22 o  124.203   2.7360  322.612   13.989  314.496   20.265  330.000   19.335  122.653   4.0059  125.754   3.7278 -3.101036 5.472098 
1 1 1   18   22   23 o   70.457   3.2386  104.163   9.3780  105.075   13.881  103.398   12.720   70.690   4.7611   70.225   4.3916 0.4654160 6.477195 
1 1 1   18   22   24 o   86.352   2.9528  157.042   10.474  147.069   15.179  166.107   14.470   83.644   4.3998   89.061   3.9394 -5.416641 5.905652 
1 1 1   18   22   25 o   96.325   2.8802  194.739   11.431  191.833   16.463  197.445   15.885   95.589   4.1757   97.061   3.9680 -1.471809 5.760312 
1 1 1   18   22   26 o   56.291   4.3199   66.363   9.8792   53.151   12.943   84.805   15.291   49.668   6.3182   62.914   5.8928 -13.24586 8.639729 
1 1 1   18   22   27 o   38.888   5.1596   33.194   8.0418   42.317   12.086   25.947   10.772   44.149   6.6375   33.626   7.9012 10.52317 10.31920 
1 1 1   18   22   28 o   57.742   4.9066   76.514   11.012   88.441   14.258   58.883   17.336   64.274   5.3786   51.210   8.2078 13.06383 9.813110 
1 1 1   18   22   29 o   48.127   6.2775   60.969   10.314   39.908   19.722   68.898   12.101   39.566   11.439   56.689   5.1754 -17.12304 12.55494 
1 1 1   18   22   30 o   26.644   6.5192   14.551   8.6151   22.736   14.171   9.7525   10.851   30.708   9.8646   22.581   8.5259 8.126873 13.03848 
1 1 1   18   22   31 o   15.344   4.9182 -10.2084   7.6362 -27.2141   11.412   3.5785   10.276   11.748   5.8569   18.941   7.9026 -7.192939 9.836347 
1 1 1   18   22   32 f  105.708   2.9449  238.083   12.805  216.206   17.920  260.908   18.304  100.618   4.3181  110.798   4.0054 -10.17924 5.889736 
1 1 1   18   22   33 o   54.612   4.4011   65.441   9.7802   71.578   15.364   61.260   12.681   56.495   6.5937   52.729   5.8310 3.766232 8.802197 
1 1 1   18   22   34 o   75.168   3.7149  123.936   11.479  123.057   16.881  124.693   15.655   74.726   5.4773   75.610   5.0200 -0.8845673 7.429733 
1 1 1   18   22   35 o   45.594   6.8915   50.440   11.792   44.445   14.101   64.380   21.503   42.527   8.3373   48.661   10.975 -6.134239 13.78305 
1 1 1   18   22   36 o   22.777   6.9506   2.6889   10.673  -3.9647   12.429   21.377   20.830   17.054   7.8154   28.500   11.496 -11.44615 13.90120 
1 1 1   18   22   37 o   35.013   7.7560   37.740   12.861   42.015   15.665   28.897   22.528   39.339   9.7129   30.686   12.095 8.652906 15.51193 
1 1 1   18   23    0 o  146.979   2.1169  446.731   18.131  446.731   18.131  446.731   18.131  146.979   2.9938  146.979   2.9938 0.000000 0.000000 
1 1 1   18   23    1 o   90.539   2.5565  166.936   9.1808  180.087   15.499  159.829   11.395   93.190   4.0325   87.887   3.1435 5.302628 5.113037 
1 1 1   18   23    2 o  123.895   2.7034  318.280   13.421  317.657   21.708  318.666   17.076  123.721   4.2541  124.068   3.3371 -0.3461533 5.406771 
1 1 1   18   23    3 o  126.268   2.5826  337.789   12.452  310.177   21.809  351.145   15.168  122.232   4.3260  130.304   2.8223 -8.071533 5.165251 
1 1 1   18   23    4 o  144.476   2.5573  426.544   13.982  447.625   25.760  417.740   16.648  146.839   4.2534  142.114   2.8402 4.724213 5.114519 
1 1 1   18   23    5 o   66.121   3.3986   90.690   9.2233   88.316   12.377   93.655   13.832   65.175   4.6042   67.067   5.0004 -1.892326 6.797274 
1 1 1   18   23    6 o   83.313   3.0588  141.811   10.003  152.016   17.260  136.650   12.274   85.444   4.8977   81.182   3.6657 4.261879 6.117569 
1 1 1   18   23    7 o   60.677   6.1718  100.738   9.1985   53.972   23.702  109.031   9.9807   48.812   11.884   72.543   3.3358 -23.73050 12.34355 
1 1 1   18   23    8 o   22.203   5.0593   10.385   6.2005 -10.8394   13.222   16.369   7.0204   17.004   7.8880   27.403   6.3378 -10.39929 10.11868 
1 1 1   18   23    9 o  101.874   2.4674  217.659   10.031  204.957   16.135  225.663   12.807   99.347   3.9377  104.400   2.9743 -5.052727 4.934767 
1 1 1   18   23   10 o  177.342   2.3557  652.465   16.759  649.954   27.014  654.037   21.369  176.955   3.7014  177.729   2.9151 -0.7733917 4.711485 
1 1 1   18   23   11 o   82.034   3.2207  147.438   9.5420  124.849   17.892  156.416   11.280   77.194   5.6197   86.873   3.1481 -9.679260 6.441408 
1 1 1   18   23   12 o  132.647   2.7018  364.146   13.424  369.526   24.960  361.956   15.923  133.117   4.5462  132.178   2.9208 0.9396210 5.403614 
1 1 1   18   23   13 o   96.204   3.9538  192.588   15.688   0.0000   0.0000  192.588   15.688  ?   ?    96.204   3.9538      ?      ? 
1 1 1   18   23   14 o  129.588   2.7761  356.146   13.316  334.109   24.734  365.141   15.802  126.441   4.7429  132.736   2.8863 -6.294975 5.552102 
1 1 1   18   23   15 o   75.022   2.8509  120.314   8.3353  106.963   13.889  127.829   10.421   71.552   4.7064   78.491   3.2189 -6.939064 5.701828 
1 1 1   18   23   16 o   21.582   5.7208   7.7208   6.9530   4.8127   10.532   9.9671   9.2567   20.454   8.2014   22.711   7.9780 -2.257256 11.44164 
1 1 1   18   23   17 o   18.976   5.4913   3.3413   6.7680   2.7094   10.525   3.7868   8.8376   19.348   8.0288   18.603   7.4938 0.7444954 10.98266 
1 1 1   18   23   18 o   81.268   3.3307  138.006   10.993  135.091   14.282  142.243   17.219   80.336   4.3103   82.199   5.0789 -1.863464 6.661423 
1 1 1   18   23   19 o   39.730   4.7305   33.602   7.5335   39.279   11.608   29.471   9.9021   42.884   6.5631   36.577   6.8146 6.307125 9.461085 
1 1 1   18   23   20 o   91.129   3.1583  178.632   11.439  154.796   18.065  194.584   14.779   85.687   5.1117   96.571   3.7106 -10.88364 6.316513 
1 1 1   18   23   21 o   45.000   4.5099   43.068   8.1703   43.846   13.090   42.572   10.457   45.171   7.0263   44.829   5.6558 0.3418884 9.019763 
1 1 1   18   23   22 o   48.045   4.5459   49.800   8.7238   47.807   14.036   51.055   11.136   47.019   7.2379   49.072   5.5020 -2.053211 9.091745 
1 1 1   18   23   23 o   27.998   5.9517   16.886   7.4137   22.713   11.630   12.896   9.6223   31.454   8.6806   24.542   8.1449 6.912020 11.90348 
1 1 1   18   23   24 o   61.190   3.5244   78.059   8.8221   93.095   13.372   66.472   11.739   66.361   4.8858   56.019   5.0809 10.34199 7.048866 
1 1 1   18   23   25 o   21.511   5.6368   7.2186   7.2757  -1.5808   10.909   14.269   9.7646   17.595   7.7464   25.426   8.1908 -7.830992 11.27370 
1 1 1   18   23   26 o   21.787   5.9329   7.5234   7.5753   11.176   11.245   4.4891   10.250   23.857   8.7412   19.716   8.0242 4.140903 11.86575 
1 1 1   18   23   27 o   28.876   6.5723   19.260   8.8543   18.785   11.881   19.853   13.278   28.495   9.0201   29.257   9.5612 -0.7619724 13.14452 
1 1 1   18   23   28 o   59.980   3.7992   77.075   9.3583   80.831   14.014   74.052   12.572   61.209   5.5512   58.750   5.1885 2.458942 7.598410 
1 1 1   18   23   29 o   47.063   5.5667   55.550   9.5115   36.333   15.655   66.794   11.975   38.410   9.8385   55.716   5.2111 -17.30640 11.13340 
1 1 1   18   23   30 o   47.714   7.5358   57.696   14.452   65.851   21.330   50.776   19.649   51.066   10.479   44.363   10.833 6.702858 15.07169 
1 1 1   18   23   31 o   39.955   5.3371   37.700   8.4643   31.504   12.626   42.758   11.407   36.008   8.6170   43.903   6.2995 -7.895721 10.67414 
1 1 1   18   23   32 o   26.278   6.3230   16.436   8.1820   14.764   12.831   17.583   10.622   25.535   9.3399   27.021   8.5259 -1.486671 12.64607 
1 1 1   18   23   33 f   22.275   5.8304   6.2715   8.0221   20.978   12.262  -4.7329   10.607   28.841   9.1670   15.710   7.2071 13.13088 11.66084 
1 1 1   18   23   34 o   56.767   4.5745   73.356   10.620   71.693   15.930   74.687   14.247   55.809   6.9206   57.725   5.9841 -1.916389 9.149000 
1 1 1   18   23   35 o   49.312   6.1925   54.877   11.654   43.651   13.881   81.684   21.450   41.804   8.3431   56.820   9.1531 -15.01594 12.38493 
1 1 1   18   23   36 o   26.882   7.4951   18.399   11.876   16.571   14.836   21.659   19.813   25.660   9.8999   28.104   11.256 -2.444675 14.99015 
1 1 1   18   24    0 o   72.624   2.8945  110.194   12.172  110.194   12.172  110.194   12.172   72.624   4.0934   72.624   4.0934 0.000000 0.000000 
1 1 1   18   24    1 o  186.551   3.3630  732.581   20.120  712.377   46.253  737.296   22.345  184.361   6.0828  188.740   2.8704 -4.378967 6.726062 
1 1 1   18   24    2 o  167.175   3.3235  557.166   17.300  620.760   42.703  544.679   18.923  172.119   6.0154  162.230   2.8280 9.888824 6.647056 
1 1 1   18   24    3 o   90.589   2.7410  170.488   9.4310  170.090   17.049  170.664   11.321   90.394   4.5728   90.785   3.0235 -0.3907318 5.481979 
1 1 1   18   24    4 o   67.220   3.0617   93.363   7.8056   95.565   14.234   92.415   9.3343   67.672   5.0998   66.767   3.3896 0.9045944 6.123487 
1 1 1   18   24    5 o   51.291   3.9996   58.527   7.7631   45.215   13.050   65.818   9.6576   46.318   6.8314   56.265   4.1616 -9.947304 7.999212 
1 1 1   18   24    6 o   80.430   2.7490  138.607   8.6526  119.739   14.166  149.835   10.928   75.821   4.5300   85.038   3.1157 -9.217026 5.498007 
1 1 1   18   24    7 f  109.032   2.8330  257.739   11.324  223.337   20.891  272.053   13.476  103.441   4.8967  114.622   2.8506 -11.18084 5.665984 
1 1 1   18   24    8 o   55.660   3.6867   66.605   7.3978   61.018   14.216   68.680   8.6633   53.813   6.4052   57.506   3.6526 -3.693562 7.373417 
1 1 1   18   24    9 o  106.235   2.5949  236.673   11.259  212.456   16.540  257.580   15.368  101.057   3.9683  111.414   3.3445 -10.35620 5.189719 
1 1 1   18   24   10 o   59.732   3.0685   69.951   7.1835   88.828   12.787   61.246   8.6832   65.203   4.7548   54.260   3.8800 10.94371 6.137032 
1 1 1   18   24   11 o   63.722   3.6843   89.437   8.2290   76.613   16.170   93.919   9.5596   60.196   6.5127   67.248   3.4466 -7.051624 7.368522 
1 1 1   18   24   12 o   36.836   5.0497   26.157   6.5125   36.262   13.790   23.257   7.3883   40.374   8.5474   33.298   5.3797 7.076012 10.09942 
1 1 1   18   24   13 o   92.563   2.9614  181.784   9.9676  171.636   19.073  185.596   11.691   90.516   5.1090   94.610   2.9960 -4.094193 5.922713 
1 1 1   18   24   14 o   49.007   5.0713   61.593   7.4553   37.153   15.569   68.864   8.4923   40.478   9.4903   57.537   3.5786 -17.05935 10.14259 
1 1 1   18   24   15 o   77.193   2.8075  125.620   8.5781  119.781   14.111  129.042   10.803   75.618   4.5244   78.769   3.3254 -3.150581 5.615030 
1 1 1   18   24   16 o   68.543   3.2156   98.202   9.0421  101.399   13.592   95.664   12.110   69.491   4.7424   67.595   4.3439 1.896324 6.431152 
1 1 1   18   24   17 o  126.554   2.4925  333.771   12.997  331.764   18.776  335.616   18.009  126.158   3.6084  126.950   3.4395 -0.7922592 4.985065 
1 1 1   18   24   18 o  130.904   3.0222  347.122   15.575  321.798   19.052  398.152   27.044  124.186   3.7196  137.622   4.7645 -13.43593 6.044456 
1 1 1   18   24   19 o  123.204   2.5757  316.573   13.074  316.341   18.941  316.785   18.068  123.127   3.7297  123.280   3.5535 -0.1530838 5.151491 
1 1 1   18   24   20 o   88.968   3.2814  170.482   11.663  146.145   18.099  187.766   15.253   83.156   5.2770   94.779   3.9018 -11.62252 6.562882 
1 1 1   18   24   21 o   24.772   5.8445   13.122   7.1012   9.8826   10.734   15.644   9.4693   23.061   8.5253   26.483   7.9970 -3.421968 11.68900 
1 1 1   18   24   22 o   85.689   3.2659  157.402   11.199  142.457   17.635  167.502   14.497   81.967   5.2163   89.412   3.9310 -7.444672 6.531707 
1 1 1   18   24   23 o   38.196   5.4823   33.588   8.1602   29.028   13.390   36.283   10.293   35.276   9.1316   41.117   6.0694 -5.840397 10.96467 
1 1 1   18   24   24 o   73.293   3.2980  115.326   9.8039   95.144   14.206  133.680   13.547   66.875   5.1504   79.711   4.1206 -12.83515 6.595925 
1 1 1   18   24   25 o  110.858   2.8590  259.143   12.991  253.828   19.364  263.493   17.518  109.687   4.2803  112.028   3.7914 -2.340790 5.717958 
1 1 1   18   24   26 o   57.998   3.8063   72.900   9.0111   64.920   13.183   79.898   12.345   54.790   5.8340   61.206   4.8903 -6.416294 7.612517 
1 1 1   18   24   27 o   63.578   6.2537   78.633   12.611   71.042   13.726  119.722   31.936   57.234   5.8147   69.923   11.074 -12.68974 12.50750 
1 1 1   18   24   28 o   53.758   5.4830   69.977   10.890   82.478   14.000   50.826   17.328   61.728   5.4991   45.788   9.4875 15.93970 10.96601 
1 1 1   18   24   29 o   45.283   5.1025   44.443   9.2160   54.502   15.615   39.067   11.416   48.724   7.7703   41.841   6.6153 6.882767 10.20493 
1 1 1   18   24   30 o   31.417   7.1897   20.084   9.3994   37.983   19.569   14.716   10.717   37.589   11.527   25.244   8.5969 12.34536 14.37948 
1 1 1   18   24   31 o   49.998   4.4022   55.565   9.0352   56.698   13.486   54.641   12.170   50.293   6.5017   49.704   5.9367 0.5891190 8.804317 
1 1 1   18   24   32 o   32.706   6.1305   26.675   8.3374   27.858   12.790   25.801   10.994   33.075   9.0935   32.337   8.2242 0.7376480 12.26090 
1 1 1   18   24   33 o   52.488   4.4228   62.207   9.5169   62.368   14.233   62.077   12.799   52.291   6.5993   52.685   5.8902 -0.3941078 8.845631 
1 1 1   18   24   34 o   30.943   6.6030   26.905   11.653   41.987   14.313  -2.7453   20.069   40.542   8.8115   21.343   9.8363 19.19928 13.20592 
1 1 1   18   24   35 o   44.930   6.9698   52.009   11.718   47.680   13.967   62.301   21.535   43.722   8.0416   46.138   11.386 -2.416355 13.93961 
1 1 1   18   25    0 o  177.695   2.3425  653.789   24.260  653.789   24.260  653.789   24.260  177.695   3.3128  177.695   3.3128 0.000000 0.000000 
1 1 1   18   25    1 o   33.688   5.0015   24.909   6.8414   19.563   9.9158   29.767   9.4514   29.765   7.9332   37.610   6.0929 -7.845764 10.00297 
1 1 1   18   25    2 o   64.009   3.2789   90.397   7.8562   72.920   13.679   98.999   9.5967   58.949   5.6263   69.069   3.3688 -10.12050 6.557725 
1 1 1   18   25    3 o   47.008   3.6799   42.786   6.7515   57.470   12.196   36.298   8.1071   52.322   5.6515   41.694   4.7144 10.62790 7.359707 
1 1 1   18   25    4 o   33.378   5.6224   25.078   8.0611   14.734   11.967   33.670   10.907   26.847   9.0849   39.909   6.6263 -13.06155 11.24470 
1 1 1   18   25    5 o   23.324   5.5584   11.171   6.5476   4.2487   11.315   14.656   8.0283   20.762   8.4381   25.886   7.2376 -5.124281 11.11685 
1 1 1   18   25    6 o   64.216   3.3375   76.360   7.7777  107.788   16.255   67.028   8.8574   71.659   5.4997   56.772   3.7828 14.88758 6.675031 
1 1 1   18   25    7 o   43.604   5.0738   47.657   6.9077   30.488   14.345   52.841   7.8818   36.803   9.4127   50.404   3.7914 -13.60080 10.14758 
1 1 1   18   25    8 o   35.471   4.6514   28.367   6.0346   23.961   10.860   30.335   7.2582   32.829   8.0762   38.113   4.6173 -5.284138 9.302896 
1 1 1   18   25    9 o   27.322   4.6574   18.726   5.8995   1.7824   10.468   26.613   7.1418   18.969   7.9502   35.675   4.8538 -16.70588 9.314743 
1 1 1   18   25   10 o  115.843   2.4151  279.015   11.239  277.538   18.040  279.952   14.368  115.497   3.7870  116.189   2.9982 -0.6923981 4.830188 
1 1 1   18   25   11 o   56.025   3.8202   67.292   7.4116   63.598   15.217   68.440   8.4863   54.692   6.7460   57.358   3.5872 -2.665783 7.640421 
1 1 1   18   25   12 f   28.908   5.7418   17.911   6.2646   18.846   13.534   17.656   7.0673   29.491   9.6535   28.326   6.2197 1.165258 11.48364 
1 1 1   18   25   13 o   54.988   4.2194   71.711   7.6294   51.058   15.425   78.399   8.7783   48.615   7.6930   61.362   3.4686 -12.74713 8.438807 
1 1 1   18   25   14 o   78.301   3.1853  127.764   9.0030  130.135   17.750  126.943   10.446   78.479   5.4838   78.123   3.2421 0.3564606 6.370535 
1 1 1   18   25   15 o  111.677   2.5384  262.870   11.396  246.036   17.940  274.260   14.756  108.498   4.0089  114.856   3.1149 -6.357506 5.076783 
1 1 1   18   25   16 f   83.222   2.8684  145.195   9.8118  139.690   14.314  150.075   13.476   81.674   4.2492   84.770   3.8543 -3.095963 5.736889 
1 1 1   18   25   17 o  141.029   2.8073  413.511   16.250  395.129   21.752  436.724   24.445  137.564   3.8339  144.494   4.1017 -6.930481 5.614520 
1 1 1   18   25   18 o  101.382   2.7007  214.633   11.268  215.973   16.507  213.464   15.421  101.637   3.9376  101.127   3.6972 0.5105209 5.401334 
1 1 1   18   25   19 o   76.478   3.4366  126.094   10.329  114.048   16.966  133.189   13.020   73.216   5.6184   79.741   3.9589 -6.524391 6.873114 
1 1 1   18   25   20 o   71.231   3.2047  107.398   9.3505  101.180   13.801  112.674   12.713   69.214   4.8346   73.249   4.2080 -4.035606 6.409453 
1 1 1   18   25   21 o  112.568   2.7474  265.536   12.754  259.976   17.952  271.203   18.123  111.368   3.9084  113.769   3.8622 -2.400673 5.494733 
1 1 1   18   25   22 o   46.219   4.5648   48.020   8.1577   40.038   12.622   53.746   10.691   42.164   7.5344   50.274   5.1558 -8.110825 9.129618 
1 1 1   18   25   23 o   52.729   4.0823   57.314   8.6818   71.721   14.213   48.738   10.965   57.736   5.9686   47.723   5.5709 10.01343 8.164530 
1 1 1   18   25   24 o   56.598   3.8199   68.958   8.8265   66.388   13.306   70.976   11.795   55.482   5.8149   57.714   4.9550 -2.232368 7.639708 
1 1 1   18   25   25 o   67.794   3.4777   98.153   9.7222   99.288   13.912   97.070   13.592   68.162   4.9486   67.426   4.8875 0.7365189 6.955342 
1 1 1   18   25   26 o   61.809   3.6030   82.152   9.1532   79.582   13.376   84.415   12.552   60.782   5.3357   62.836   4.8433 -2.054924 7.206055 
1 1 1   18   25   27 f   39.819   6.3860   37.946   10.015   36.519   12.699   40.293   16.290   39.378   8.0898   40.261   9.8832 -0.8828850 12.77194 
1 1 1   18   25   28 o   41.978   6.0961   41.778   10.421   58.304   15.458   28.012   14.108   50.586   7.4092   33.370   9.6826 17.21534 12.19219 
1 1 1   18   25   29 o   64.415   3.7623   91.235   9.8642   80.811   14.557  100.086   13.414   60.647   5.8196   68.183   4.7698 -7.536743 7.524527 
1 1 1   18   25   30 o   36.277   6.3659   37.693   9.8781   16.515   19.502   45.002   11.457   27.622   11.130   44.932   6.1821 -17.31008 12.73177 
1 1 1   18   25   31 o   57.355   4.3313   76.444   9.7320   53.508   14.235   96.573   13.335   48.103   7.1748   66.607   4.8542 -18.50402 8.662629 
1 1 1   18   25   32 o   53.284   4.2805   63.592   9.3755   66.977   13.960   60.811   12.654   54.451   6.2159   52.118   5.8868 2.332558 8.561075 
1 1 1   18   25   33 o   27.343   6.4390   18.956   8.5803   23.960   12.704   14.759   11.635   30.079   9.2979   24.607   8.9102 5.472319 12.87803 
1 1 1   18   25   34 o   20.906   6.4266   4.1982   10.757   10.813   13.054  -9.8016   18.990   22.664   9.1152   19.148   9.0619 3.515961 12.85324 
1 1 1   18   26    0 o   10.309   4.9266  -3.9902   8.6824  -3.9902   8.6824  -3.9902   8.6824   10.309   6.9672   10.309   6.9672 0.000000 0.000000 
1 1 1   18   26    1 o   98.147   2.9086  202.197   11.605  190.418   17.682  211.109   15.381   95.523   4.4881  100.770   3.7008 -5.246414 5.817111 
1 1 1   18   26    2 o   58.246   4.4120   70.621   9.9312   74.358   17.587   68.872   12.034   59.141   7.2099   57.350   5.0873 1.790401 8.824071 
1 1 1   18   26    3 o   98.910   2.7418  202.427   10.597  207.139   18.261  200.035   13.012   99.635   4.4437   98.186   3.2131 1.449463 5.483658 
1 1 1   18   26    4 o  149.797   2.6978  471.649   16.223  444.591   25.696  489.582   20.920  146.023   4.2666  153.571   3.3028 -7.547729 5.395566 
1 1 1   18   26    5 o   25.175   5.3084   14.598   6.3782   3.5319   11.545   19.458   7.6518   20.557   8.4583   29.792   6.4168 -9.234913 10.61687 
1 1 1   18   26    6 o   77.675   4.2249  143.806   9.7675  103.509   22.563  153.100   10.835   69.449   7.8769   85.900   3.0584 -16.45071 8.449789 
1 1 1   18   26    7 o   78.285   2.6908  131.583   8.2599  113.744   13.462  142.353   10.460   73.759   4.4253   82.810   3.0626 -9.050987 5.381694 
1 1 1   18   26    8 o   61.622   2.9675   78.712   7.1451   81.337   12.338   77.387   8.7643   62.264   4.8044   60.981   3.4847 1.283592 5.935079 
1 1 1   18   26    9 o   49.642   3.4723   53.157   6.5902   47.943   11.429   55.754   8.0661   47.580   5.8240   51.703   3.7825 -4.122860 6.944566 
1 1 1   18   26   10 o   82.066   2.7031  145.029   8.7426  123.019   13.993  159.120   11.197   76.631   4.4274   87.501   3.1026 -10.86993 5.406272 
1 1 1   18   26   11 o   94.337   3.0111  181.445   11.190  202.396   19.303  170.839   13.734   98.157   4.7680   90.517   3.6787 7.640404 6.022151 
1 1 1   18   26   12 o  139.958   3.0192  412.463   17.281  388.804   25.716  431.944   23.335  136.119   4.5805  143.798   3.9345 -7.678635 6.038325 
1 1 1   18   26   13 o   86.757   3.2652  162.681   10.786  145.287   18.794  171.225   13.172   82.873   5.4983   90.642   3.5233 -7.768234 6.530304 
1 1 1   18   26   14 o   90.297   3.2677  184.098   10.627  143.032   19.445  201.589   12.690   82.133   5.7400   98.460   3.1249 -16.32705 6.535495 
1 1 1   18   26   15 o   98.082   3.1328  201.733   11.919  201.666   20.705  201.766   14.576   97.792   5.1333   98.371   3.5925 -0.5798264 6.265557 
1 1 1   18   26   16 o   69.633   3.1780  102.679   9.0255   95.130   13.500  108.780   12.136   67.189   4.8717   72.078   4.0825 -4.888550 6.356095 
1 1 1   18   26   17 o   76.621   3.4686  123.184   10.856  118.236   14.274  129.973   16.720   74.912   4.6197   78.331   5.1752 -3.418755 6.937162 
1 1 1   18   26   18 o   55.273   3.7937   66.659   8.3891   54.264   12.671   76.333   11.194   50.336   6.1034   60.210   4.5075 -9.874691 7.587454 
1 1 1   18   26   19 o  106.050   2.9650  237.475   12.579  231.291   20.279  241.343   16.037  104.672   4.6973  107.428   3.6193 -2.756058 5.929944 
1 1 1   18   26   20 o   57.974   3.6191   72.258   8.5128   65.663   12.876   77.379   11.346   55.415   5.6337   60.533   4.5446 -5.117878 7.238234 
1 1 1   18   26   21 o   59.740   3.8146   78.968   9.0185   58.166   13.366   96.351   12.219   51.904   6.2437   67.576   4.3840 -15.67130 7.629128 
1 1 1   18   26   22 o   31.864   5.7140   23.716   7.4460   22.082   11.780   24.803   9.6089   30.725   8.8283   33.002   7.2568 -2.276958 11.42807 
1 1 1   18   26   23 o   47.867   4.3080   49.844   8.3615   49.424   13.014   50.140   10.912   47.462   6.6481   48.271   5.4808 -0.8094215 8.616038 
1 1 1   18   26   24 o   21.178   5.7877   7.5619   7.3857   1.6574   11.988   11.175   9.3769   19.418   8.3360   22.938   8.0312 -3.519730 11.57537 
1 1 1   18   26   25 o   24.167   5.6998   12.212   7.5408   1.0894   11.542   20.495   9.9602   18.830   8.1323   29.505   7.9886 -10.67433 11.39965 
1 1 1   18   26   26 o   23.482   6.1287   9.9363   9.0012   19.358   11.424  -5.4883   14.617   28.364   8.8253   18.600   8.5063 9.763487 12.25738 
1 1 1   18   26   27 o   24.245   5.8194   12.113   7.9913  -0.3703   12.118   21.719   10.631   18.491   8.1514   29.998   8.3075 -11.50717 11.63875 
1 1 1   18   26   28 o   19.642   6.0333   1.7158   9.0257   0.9759   13.808   2.2677   11.926   19.974   8.7560   19.310   8.3029 0.6633968 12.06670 
1 1 1   18   26   29 o   29.169   6.7170   21.476   9.2818   22.400   12.741   20.430   13.549   29.784   9.3290   28.554   9.6667 1.229811 13.43405 
1 1 1   18   26   30 o   45.743   4.7595   47.215   8.9106   52.860   13.676   43.051   11.746   47.966   6.9127   43.520   6.5440 4.446701 9.518937 
1 1 1   18   26   31 o   21.947   6.4978   7.6935   9.1195   4.9557   18.123   8.6218   10.553   22.772   10.006   21.123   8.2929 1.648726 12.99564 
1 1 1   18   26   32 o   25.306   6.4348   16.069   8.6526   13.032   13.259   18.322   11.419   23.910   9.3213   26.702   8.8735 -2.792671 12.86956 
1 1 1   18   26   33 o   26.646   7.0501   18.969   10.785   23.126   13.386   11.277   18.209   29.114   9.6040   24.177   10.324 4.936949 14.10010 
1 1 1   18   27    0 o   60.773   3.1543   77.976   11.043   77.976   11.043   77.976   11.043   60.773   4.4609   60.773   4.4609 0.000000 0.000000 
1 1 1   18   27    1 o   32.826   4.9607   23.875   6.5260   28.252   9.3931   19.790   9.0736   35.886   6.5891   29.767   7.4174 6.118769 9.921436 
1 1 1   18   27    2 o   33.109   4.9682   24.273   6.6960   19.353   9.6770   28.792   9.2749   29.399   7.8378   36.820   6.1074 -7.421371 9.936357 
1 1 1   18   27    3 o   54.066   3.6282   62.995   7.8349   54.652   12.217   68.824   10.211   50.790   5.8322   57.341   4.3176 -6.551788 7.256442 
1 1 1   18   27    4 o   25.368   5.1504   15.354   5.8763   5.8596   11.071   19.078   6.9335   21.222   8.4423   29.514   5.9021 -8.292423 10.30081 
1 1 1   18   27    5 o   32.882   6.1977   17.829   6.9087   38.467   17.125   13.817   7.5504   40.744   10.211   25.020   7.0271 15.72426 12.39541 
1 1 1   18   27    6 o   40.612   5.9959   40.187   7.1598   30.832   18.556   41.823   7.7608   36.512   11.229   44.712   4.2084 -8.199970 11.99177 
1 1 1   18   27    7 o   51.594   3.7332   48.032   6.8479   73.458   14.955   41.287   7.7029   58.766   6.1702   44.421   4.2043 14.34478 7.466429 
1 1 1   18   27    8 o   25.813   5.8753   11.393   5.8510   21.063   13.696   9.2343   6.4713   30.719   9.6802   20.907   6.6610 9.812197 11.75053 
1 1 1   18   27    9 o   59.625   3.1547   75.676   7.3228   71.005   12.414   78.168   9.0686   58.018   5.1879   61.232   3.5908 -3.214039 6.309407 
1 1 1   18   27   10 o  122.002   2.4575  308.435   12.203  320.350   19.006  300.079   15.917  123.905   3.7192  120.099   3.2133 3.805832 4.915059 
1 1 1   18   27   11 o   28.022   4.6430   21.277   5.8608   0.6380   11.353   28.775   6.8431   19.004   8.1341   37.039   4.4795 -18.03429 9.286015 
1 1 1   18   27   12 f  110.141   2.7680  252.005   11.163  256.622   21.540  250.309   13.053  110.500   4.7263  109.782   2.8828 0.7181396 5.536075 
1 1 1   18   27   13 o   24.238   4.5539   14.951   5.9855 -14.7573   13.553   22.149   6.6714   16.066   7.6186   32.409   4.9909 -16.34333 9.107788 
1 1 1   18   27   14 o   86.147   3.1688  157.402   9.9017  153.230   19.144  158.926   11.569   84.953   5.4636   87.342   3.2116 -2.389183 6.337666 
1 1 1   18   27   15 o   38.089   5.8660   28.997   8.0818   43.549   16.217   24.189   9.3218   43.343   9.3467   32.835   7.0908 10.50834 11.73204 
1 1 1   18   27   16 o   61.627   3.4318   80.734   8.6304   76.298   12.967   84.262   11.564   59.976   5.2420   63.279   4.4307 -3.303696 6.863661 
1 1 1   18   27   17 o   44.420   5.1439   45.042   8.8607   55.307   12.097   33.160   13.015   50.871   5.7655   37.969   8.5204 12.90275 10.28773 
1 1 1   18   27   18 f   17.919   5.4996   0.3303   6.8314   0.4523   13.049   0.2842   8.0178   19.936   8.6282   15.903   6.8219 4.032850 10.99928 
1 1 1   18   27   19 o   50.018   4.0161   53.695   8.2046   52.853   12.431   54.344   10.921   49.531   6.0850   50.504   5.2429 -0.9730453 8.032152 
1 1 1   18   27   20 o   80.478   3.0694  136.975   10.163  134.233   14.809  139.415   13.973   79.641   4.5083   81.315   4.1664 -1.674500 6.138710 
1 1 1   18   27   21 o   36.054   6.2285   29.678   9.1459   23.212   11.844   39.229   14.394   31.325   8.8022   40.783   8.8147 -9.457495 12.45705 
1 1 1   18   27   22 o   80.173   3.5669  135.492   11.602  126.339   14.918  149.503   18.456   76.998   4.6974   83.348   5.3689 -6.350632 7.133759 
1 1 1   18   27   23 o   57.285   4.5275   73.386   10.462   82.912   14.130   61.827   15.565   61.920   5.5327   52.649   7.1680 9.271294 9.054915 
1 1 1   18   27   24 o   60.277   4.5497   78.942   11.113   73.119   14.244   87.999   17.765   57.766   5.9785   62.789   6.8598 -5.023163 9.099407 
1 1 1   18   27   25 o   21.704   6.0306   8.3499   7.7701   8.1015   12.492   8.5066   9.9233   22.181   8.9184   21.227   8.1200 0.9535217 12.06114 
1 1 1   18   27   26 o   55.934   4.8226   72.935   10.573   84.056   13.832   57.303   16.399   62.125   5.3983   49.743   7.9930 12.38132 9.645154 
1 1 1   18   27   27 o   24.803   6.4319   13.944   8.6812   7.6860   15.396   16.861   10.512   23.110   9.6602   26.497   8.4945 -3.386698 12.86378 
1 1 1   18   27   28 o   21.301   5.8417   4.5124   7.9112   18.284   12.541  -4.5889   10.196   27.179   9.2999   15.424   7.0721 11.75515 11.68343 
1 1 1   18   27   29 o   25.369   6.2965   13.094   9.1872   0.7831   12.817   26.106   13.176   19.005   8.3803   31.733   9.3998 -12.72788 12.59308 
1 1 1   18   27   30 o   32.551   6.2498   27.523   8.6058   25.206   13.259   29.209   11.312   30.875   9.4915   34.227   8.1332 -3.352100 12.49954 
1 1 1   18   27   31 o   21.752   6.5558   1.3735   9.0844   21.830   18.720  -4.9276   10.390   28.267   11.060   15.237   7.0414 13.03051 13.11160 
1 1 1   18   27   32 o   24.744   6.3630   15.413   8.5997   10.948   13.147   18.752   11.369   22.711   9.1430   26.776   8.8519 -4.065739 12.72598 
1 1 1   18   28    0 o   84.500   2.6619  149.004   13.061  149.004   13.061  149.004   13.061   84.500   3.7646   84.500   3.7646 0.000000 0.000000 
1 1 1   18   28    1 o   37.044   4.5239   29.770   6.7424   27.393   9.5776   32.105   9.4934   35.208   6.8421   38.880   5.9201 -3.672760 9.047758 
1 1 1   18   28    2 o   35.895   4.6433   28.135   6.6450   35.455   9.5805   21.349   9.2244   40.905   5.6787   30.886   7.3480 10.01902 9.286580 
1 1 1   18   28    3 o   54.119   3.5561   60.269   7.8314   70.893   12.373   53.167   10.116   57.972   5.1746   50.266   4.8792 7.705948 7.112194 
1 1 1   18   28    4 o   47.547   4.0427   49.727   7.6032   39.021   11.662   57.641   10.027   42.705   6.6211   52.388   4.6406 -9.682823 8.085484 
1 1 1   18   28    5 o  102.552   3.2850  227.204   12.317  206.756   23.097  235.329   14.560   98.780   5.6692  106.324   3.3202 -7.543869 6.569903 
1 1 1   18   28    6 f   30.066   5.1860   21.320   5.9974   15.166   11.900   23.416   6.9437   26.795   9.0594   33.336   5.0503 -6.540449 10.37202 
1 1 1   18   28    7 o  128.487   2.3973  349.277   12.418  313.540   19.124  375.332   16.329  122.560   3.7831  134.413   2.9454 -11.85328 4.794527 
1 1 1   18   28    8 o   79.415   2.6794  133.301   8.3581  126.095   13.950  137.337   10.439   77.562   4.3607   81.268   3.1145 -3.705315 5.358734 
1 1 1   18   28    9 o   46.348   3.8900   49.066   6.5626   37.112   11.675   54.588   7.9349   41.569   6.8094   51.127   3.7629 -9.558159 7.779925 
1 1 1   18   28   10 o   87.006   2.6553  163.204   8.9886  141.827   14.911  175.407   11.266   82.173   4.3996   91.839   2.9741 -9.665993 5.310569 
1 1 1   18   28   11 o   48.874   3.4106   45.628   6.3804   63.989   12.078   38.520   7.5146   54.919   5.3321   42.829   4.2541 12.09060 6.821160 
1 1 1   18   28   12 o   44.493   4.2280   45.704   6.4939   36.634   12.096   49.376   7.6972   40.425   7.5322   48.561   3.8431 -8.135933 8.455915 
1 1 1   18   28   13 o   59.098   3.7346   72.479   7.6962   77.230   16.106   71.073   8.7612   59.889   6.5205   58.306   3.6432 1.583302 7.469280 
1 1 1   18   28   14 o   68.811   3.5843  102.683   8.3490   96.070   17.610  104.600   9.4824   66.803   6.3915   70.820   3.2464 -4.016426 7.168659 
1 1 1   18   28   15 o   32.628   6.4702   26.323   8.1717   13.798   20.770   28.617   8.8886   28.726   11.517   36.530   5.8995 -7.804686 12.94041 
1 1 1   18   28   16 o   38.068   6.7125   37.022   8.8438   24.750   22.231   39.329   9.6394   33.217   12.271   42.919   5.4454 -9.702213 13.42498 
1 1 1   18   28   17 o   53.523   4.7885   62.715   10.504   56.629   15.126   68.383   14.599   50.808   7.2183   56.238   6.2939 -5.429527 9.576923 
1 1 1   18   28   18 o   70.352   3.6987  107.199   10.276  100.314   16.852  111.275   12.966   68.143   5.9960   72.561   4.3324 -4.417984 7.397416 
1 1 1   18   28   19 o   25.325   5.7380   14.776   7.1424   7.3091   11.707   19.202   9.0143   21.816   8.6805   28.835   7.5065 -7.018730 11.47597 
1 1 1   18   28   20 o   28.586   5.9399   19.525   7.5014   15.653   12.176   21.893   9.5232   26.457   9.1581   30.714   7.5669 -4.256912 11.87979 
1 1 1   18   28   21 o   73.531   3.2656  116.862   9.7340  103.782   14.631  127.250   13.038   69.523   5.1025   77.540   4.0769 -8.016891 6.531185 
1 1 1   18   28   22 o   41.082   4.7751   38.177   7.6945   36.822   12.122   39.092   9.9575   39.791   7.6646   42.374   5.6975 -2.583321 9.550270 
1 1 1   18   28   23 o   47.480   4.3539   50.098   8.3323   48.315   13.075   51.318   10.812   46.396   6.8327   48.563   5.3981 -2.167114 8.707791 
1 1 1   18   28   24 f   32.327   5.9564   23.791   7.9169   33.546   13.018   18.066   9.9732   37.157   8.6553   27.497   8.1855 9.660040 11.91288 
1 1 1   18   28   25 o   51.584   4.4185   60.160   9.1701   52.820   13.981   65.702   12.148   48.283   7.0207   54.884   5.3666 -6.601250 8.836905 
1 1 1   18   28   26 o   47.391   5.0264   53.282   9.0963   45.682   14.490   58.224   11.686   43.339   8.4097   51.443   5.5076 -8.103142 10.05270 
1 1 1   18   28   27 o   40.400   5.7409   39.266   9.0587   40.042   14.983   38.820   11.373   39.551   9.3349   41.248   6.6849 -1.697792 11.48171 
1 1 1   18   28   28 o   73.946   3.5895  121.176   10.816  105.866   15.766  134.785   14.865   69.069   5.5345   78.824   4.5724 -9.754944 7.178982 
1 1 1   18   28   29 o   38.374   5.5685   38.705   8.6856   21.342   13.016   52.642   11.662   28.443   9.4746   48.304   5.8535 -19.86090 11.13695 
1 1 1   18   28   30 o   23.768   6.4569   12.803   9.1889   18.233   12.757   6.9485   13.247   26.430   9.3576   21.105   8.8995 5.324484 12.91378 
1 1 1   18   28   31 o   23.209   6.8899   4.0517   11.268   25.443   19.079  -7.4057   13.963   29.480   11.263   16.937   7.9388 12.54295 13.77990 
1 1 1   18   29    0 o   72.602   2.7992  110.435   11.774  110.435   11.774  110.435   11.774   72.602   3.9587   72.602   3.9587 0.000000 0.000000 
1 1 1   18   29    1 o   69.023   2.9171   99.712   8.3006  101.970   11.965   97.617   11.525   69.768   4.1581   68.279   4.0925 1.488823 5.834229 
1 1 1   18   29    2 o   45.391   3.8061   43.896   7.0786   39.930   10.274   47.481   9.7667   43.344   5.7470   47.438   4.9917 -4.094158 7.612158 
1 1 1   18   29    3 o   49.718   3.7793   51.061   7.6516   63.192   11.908   42.529   9.9862   54.639   5.2839   44.798   5.4048 9.841557 7.558524 
1 1 1   18   29    4 o   50.692   5.2670   61.828   8.9720   45.715   16.936   68.115   10.578   44.468   9.5214   56.915   4.5063 -12.44703 10.53391 
1 1 1   18   29    5 o   36.676   5.7519   22.953   8.9206   56.799   16.426   8.7958   10.624   50.957   7.8158   22.395   8.4410 28.56165 11.50379 
1 1 1   18   29    6 o   42.273   4.7203   41.207   7.4942   31.202   11.980   47.639   9.6056   37.061   8.0666   47.486   4.9044 -10.42564 9.440563 
1 1 1   18   29    7 o   61.884   2.9121   79.538   7.0596   83.007   12.149   77.769   8.6746   62.733   4.6954   61.036   3.4458 1.696857 5.824133 
1 1 1   18   29    8 o   62.563   2.8690   79.125   7.0259   91.504   12.371   73.230   8.5362   65.909   4.5507   59.217   3.4950 6.692215 5.737962 
1 1 1   18   29    9 o  113.858   2.6266  270.907   12.253  231.056   16.961  314.419   17.723  105.018   3.9157  122.699   3.5020 -17.68102 5.253282 
1 1 1   18   29   10 o   53.037   3.4910   58.495   7.5417   65.886   11.848   53.460   9.7787   55.746   5.1531   50.327   4.7110 5.418484 6.981916 
1 1 1   18   29   11 o   32.556   5.2156   23.536   6.6839   26.016   10.899   22.041   8.4620   33.739   7.9608   31.373   6.7405 2.366302 10.43114 
1 1 1   18   29   12 o   21.687   5.4916   6.6461   6.1708   16.339   10.884   2.0544   7.4911   27.021   8.6417   16.353   6.7787 10.66790 10.98314 
1 1 1   18   29   13 o   62.340   3.3857   82.599   8.5522   80.831   13.312   83.841   11.160   61.607   5.2391   63.074   4.2898 -1.466454 6.771324 
1 1 1   18   29   14 o   17.680   5.5092  -2.2298   6.6049   4.4491   13.821  -4.2064   7.5190   21.927   9.1583   13.432   6.1264 8.495404 11.01844 
1 1 1   18   29   15 o   44.295   5.0456   45.139   7.9921   40.021   14.596   47.331   9.5510   41.405   8.8175   47.185   4.9077 -5.779972 10.09129 
1 1 1   18   29   16 o   26.674   6.5219   15.938   8.8128   10.841   14.670   18.816   11.024   24.887   9.7755   28.462   8.6360 -3.574499 13.04383 
1 1 1   18   29   17 o   62.244   5.9513   95.499   10.761   77.574   24.738   99.683   11.951   55.858   11.129   68.629   4.2223 -12.77135 11.90258 
1 1 1   18   29   18 o   68.909   3.2323  101.264   9.0788   99.616   13.867  102.501   12.011   68.244   4.9268   69.574   4.1856 -1.329277 6.464697 
1 1 1   18   29   19 o   23.651   5.7681   12.349   6.9555   7.4897   11.569   15.100   8.7044   21.709   8.6318   25.593   7.6535 -3.884630 11.53622 
1 1 1   18   29   20 o   79.930   3.1134  139.627   9.9806  113.247   14.926  160.960   13.422   72.557   4.9877   87.302   3.7277 -14.74496 6.226833 
1 1 1   18   29   21 o   77.903   3.0993  130.655   9.8357  122.439   14.821  137.121   13.148   75.451   4.7626   80.355   3.9673 -4.903397 6.198546 
1 1 1   18   29   22 o   49.639   4.1545   53.434   8.3798   58.399   13.232   50.109   10.828   51.337   6.2491   47.941   5.4762 3.395935 8.308986 
1 1 1   18   29   23 o   44.526   4.5558   43.680   8.2521   47.646   12.969   40.982   10.697   45.990   6.8372   43.062   6.0228 2.927437 9.111646 
1 1 1   18   29   24 o   19.232   5.6242   4.3061   7.4855  -3.1641   12.607   8.3741   9.3030   17.741   8.0293   20.723   7.8775 -2.981146 11.24833 
1 1 1   18   29   25 o   20.321   6.0807   1.1608   9.4312  -9.5179   13.009   12.990   13.692   16.158   7.6020   24.484   9.4927 -8.326162 12.16148 
1 1 1   18   29   26 o   54.232   4.4300   64.106   9.4550   74.480   16.402   58.944   11.571   56.816   6.9996   51.647   5.4319 5.168999 8.860030 
1 1 1   18   29   27 o   56.611   4.1773   69.848   9.5695   84.827   15.477   60.578   12.176   61.181   6.1334   52.041   5.6727 9.139278 8.354540 
1 1 1   18   29   28 o   27.696   6.2719   20.750   8.6522   11.369   14.471   25.969   10.794   23.401   9.5303   31.992   8.1558 -8.590981 12.54371 
1 1 1   18   29   29 o   16.988   5.5588  -9.2146   9.8037 -23.4745   14.243   3.6246   13.515   14.045   6.9194   19.931   8.7019 -5.886178 11.11759 
1 1 1   18   30    0 o   92.060   2.5888  176.820   13.851  176.820   13.851  176.820   13.851   92.060   3.6612   92.060   3.6612 0.000000 0.000000 
1 1 1   18   30    1 o   55.260   3.3504   64.487   7.6312   62.120   10.823   66.826   10.761   54.224   4.8394   56.296   4.6348 -2.072285 6.700800 
1 1 1   18   30    2 o   29.422   5.3351   19.461   6.5279   22.772   9.5521   16.559   8.9419   31.736   7.4289   27.108   7.6592 4.628155 10.67017 
1 1 1   18   30    3 o   25.089   5.2452   12.746   6.3325   22.187   9.3807   4.8418   8.5832   31.328   7.3813   18.851   7.4541 12.47684 10.49032 
1 1 1   18   30    4 o   18.856   5.7247  -0.9220   7.0663   7.2046   14.056  -3.6705   8.1744   23.349   9.4349   14.364   6.4862 8.985682 11.44935 
1 1 1   18   30    5 f   90.252   3.6884  178.398   13.171  149.192   20.718  198.211   17.064   83.423   6.0214   97.082   4.2616 -13.65892 7.376890 
1 1 1   18   30    6 o   33.976   5.2241   27.677   7.1312   17.787   11.473   33.903   9.1033   28.084   8.8608   39.867   5.5362 -11.78304 10.44816 
1 1 1   18   30    7 o   83.560   2.7171  146.924   9.3312  136.098   13.394  157.135   13.007   80.488   4.0347   86.633   3.6403 -6.145454 5.434210 
1 1 1   18   30    8 o   56.385   3.4513   67.825   7.8834   64.927   12.200   69.902   10.329   55.186   5.3601   57.584   4.3492 -2.397827 6.902624 
1 1 1   18   30    9 o   91.585   2.7562  174.931   10.360  187.734   15.620  164.876   13.842   94.510   4.0071   88.660   3.7854 5.850677 5.512329 
1 1 1   18   30   10 o   90.101   2.7468  171.560   10.111  161.000   15.085  180.175   13.625   87.438   4.1830   92.763   3.5612 -5.325333 5.493597 
1 1 1   18   30   11 o   60.328   3.3960   79.329   8.1546   67.115   12.697   87.905   10.639   56.005   5.4966   64.652   3.9898 -8.646233 6.791976 
1 1 1   18   30   12 o   14.326   4.6696  -5.1083   6.0036  -6.1237   10.546  -4.6215   7.3023   15.640   7.1791   13.013   5.9736 2.626594 9.339290 
1 1 1   18   30   13 o   52.866   3.9436   62.957   8.1483   47.500   12.611   74.034   10.676   46.605   6.5607   59.126   4.3779 -12.52124 7.887276 
1 1 1   18   30   14 o   31.011   6.3243   22.874   8.5566   24.531   11.904   21.102   12.308   32.151   8.7453   29.872   9.1382 2.278687 12.64861 
1 1 1   18   30   15 o   87.365   3.7310  163.916   13.320  165.099   20.265  163.016   17.675   87.403   5.6214   87.327   4.9074 0.7605743E-01 7.462099 
1 1 1   18   30   16 o   21.340   6.8508  -3.2621   12.413   2.0277   14.402 -18.5440   24.480   21.031   9.0833   21.649   10.258 -0.6180687 13.70160 
1 1 1   18   30   17 o   28.375   7.4973   15.335   9.8778   25.301   22.298   12.902   11.018   32.338   12.219   24.411   8.6906 7.927477 14.99457 
1 1 1   18   30   18 o   50.033   4.0483   55.400   8.0904   51.260   12.843   58.124   10.417   48.071   6.4774   51.995   4.8577 -3.924152 8.096581 
1 1 1   18   30   19 o   64.630   3.5643   92.384   9.2372   77.954   14.040  103.395   12.265   59.655   5.7065   69.605   4.2724 -9.949848 7.128658 
1 1 1   18   30   20 o   29.640   5.5363   18.120   7.2248   34.791   12.000   8.6407   9.0487   38.355   7.8498   20.926   7.8091 17.42934 11.07255 
1 1 1   18   30   21 o   57.445   3.7003   71.357   8.6559   74.250   13.442   69.308   11.314   58.221   5.5980   56.670   4.8404 1.550766 7.400506 
1 1 1   18   30   22 o   53.269   4.1481   65.382   8.6581   50.305   13.354   76.315   11.372   47.060   6.8804   59.478   4.6356 -12.41858 8.296293 
1 1 1   18   30   23 o   31.998   5.9077   25.276   7.7846   26.008   12.247   24.781   10.084   32.040   8.9322   31.955   7.7344 0.8475494E-01 11.81545 
1 1 1   18   30   24 o   48.670   4.3058   52.539   8.5406   57.597   13.340   49.026   11.118   50.409   6.4162   46.930   5.7439 3.479469 8.611607 
1 1 1   18   30   25 o   41.452   7.2087   55.711   12.696   63.828   14.201   23.392   28.337   52.833   6.5171   30.071   12.860 22.76163 14.41732 
1 1 1   18   30   26 o   17.847   5.7747  -4.6878   9.8323 -13.1518   14.674   2.2089   13.246   16.233   7.7618   19.461   8.5524 -3.228176 11.54942 
1 1 1   18   30   27 o   34.603   6.3668   31.736   9.9942   48.005   14.404   16.633   13.878   43.613   8.3111   25.592   9.6473 18.02056 12.73361 
1 1 1   18   31    0 o  141.302   2.5370  415.721   20.879  415.721   20.879  415.721   20.879  141.302   3.5878  141.302   3.5878 0.000000 0.000000 
1 1 1   18   31    1 o   84.974   2.6539  151.359   9.2949  143.666   13.005  159.392   13.289   82.747   3.8107   87.202   3.6950 -4.455765 5.307895 
1 1 1   18   31    2 o   70.111   2.8840  103.460   8.3349  100.953   11.889  105.882   11.688   69.247   4.1628   70.975   3.9927 -1.728256 5.768056 
1 1 1   18   31    3 o   33.669   4.9699   25.485   6.6792   28.951   9.6946   22.353   9.2151   35.974   6.7827   31.364   7.2661 4.609945 9.939895 
1 1 1   18   31    4 o   25.277   6.1666   13.950   7.4315   8.2948   15.187   15.731   8.5216   24.214   9.7991   26.340   7.4892 -2.125658 12.33325 
1 1 1   18   31    5 o   43.515   4.6357   41.203   8.2901   45.070   11.734   37.350   11.714   45.663   6.2305   41.366   6.8657 4.297546 9.271339 
1 1 1   18   31    6 o   59.588   3.6238   75.902   8.4834   74.804   14.283   76.500   10.545   58.953   5.8741   60.223   4.2454 -1.269608 7.247610 
1 1 1   18   31    7 o   24.018   5.6637   11.792   6.5449   16.753   10.395   8.5328   8.4246   27.102   8.4159   20.935   7.5817 6.166924 11.32736 
1 1 1   18   31    8 o   37.804   4.8941   33.158   7.1727   26.137   11.201   38.040   9.3388   33.486   8.1801   42.123   5.3754 -8.636852 9.788181 
1 1 1   18   31    9 o   38.282   4.8386   33.654   7.2049   28.149   11.234   37.501   9.3906   34.794   7.9959   41.769   5.4509 -6.975185 9.677139 
1 1 1   18   31   10 o   59.664   3.5976   87.999   7.4489   48.553   12.612  109.130   9.2308   47.088   6.4939   72.239   3.0982 -25.15015 7.195130 
1 1 1   18   31   11 o   18.340   5.0271   5.6571   5.1194   0.5828   10.626   7.1909   5.8421   18.042   7.7973   18.638   6.3475 -0.5958786 10.05425 
1 1 1   18   31   12 o   57.100   3.6048   77.748   7.3358   51.634   12.828   90.439   8.9424   48.526   6.4092   65.674   3.3014 -17.14790 7.209503 
1 1 1   18   31   13 o   23.474   4.7394   14.189   5.4553  -1.5806   11.286   18.997   6.2316   17.657   7.8209   29.291   5.3555 -11.63418 9.478865 
1 1 1   18   31   14 o   65.174   3.2168   90.992   8.4984   88.300   13.175   92.911   11.121   64.130   4.9810   66.219   4.0721 -2.088196 6.433671 
1 1 1   18   31   15 o   17.352   4.9993  -6.4946   6.3061   13.393   10.887 -16.5357   7.7359   24.566   8.6503   10.138   5.0144 14.42764 9.998608 
1 1 1   18   31   16 o   26.754   8.1454   7.8778   16.101   0.2826   20.862   19.068   25.322   23.417   10.486   30.091   12.468 -6.674150 16.29074 
1 1 1   18   31   17 o   25.435   6.6994   13.320   9.4146   19.219   14.481   9.0005   12.390   28.307   9.9755   22.564   8.9453 5.742676 13.39887 
1 1 1   18   31   18 o   29.580   6.7398   21.679   9.6315   15.504   14.335   26.761   13.004   26.343   9.8293   32.816   9.2240 -6.473516 13.47955 
1 1 1   18   31   19 o   35.716   5.3705   29.497   7.4878   33.557   12.241   27.071   9.4649   37.330   8.1770   34.103   6.9646 3.226978 10.74105 
1 1 1   18   31   20 o   57.503   3.8138   74.981   8.6739   59.595   13.295   86.384   11.445   51.599   6.2471   63.406   4.3766 -11.80695 7.627615 
1 1 1   18   31   21 o   40.036   5.1460   40.418   7.8301   26.102   12.204   50.435   10.208   32.095   8.9058   47.977   5.1589 -15.88250 10.29210 
1 1 1   18   31   22 o   17.327   5.5017  -2.9547   8.3623  -8.6499   11.783   2.8236   11.869   15.450   7.2580   19.204   8.2703 -3.754350 11.00346 
1 1 1   18   31   23 o   29.459   6.4145   21.472   9.5657   34.716   13.566   8.3781   13.490   36.782   9.0131   22.136   9.1295 14.64612 12.82901 
1 1 1   18   31   24 o   43.109   7.6430   59.257   13.395   64.757   15.040   38.163   29.456   52.641   6.9272   33.576   13.626 19.06541 15.28602 
1 1 1   18   31   25 o   41.872   6.6099   49.914   11.592   30.430   18.167   63.294   15.055   32.004   11.180   51.740   7.0547 -19.73564 13.21986 
1 1 1   18   31   26 o   29.391   6.9489   23.495   9.9142   28.431   14.836   19.513   13.326   31.749   10.083   27.033   9.5649 4.715897 13.89773 
1 1 1   18   32    0 o   15.234   6.1472   6.7706   8.5732   6.7706   8.5732   6.7706   8.5732   15.234   8.6934   15.234   8.6934 0.000000 0.000000 
1 1 1   18   32    1 o   68.640   2.9480   99.649   8.3427   98.734   11.927  100.525   11.674   68.305   4.2335   68.975   4.1036 -0.6700363 5.895980 
1 1 1   18   32    2 o   73.229   2.8580  113.206   8.6303  116.473   12.313  110.051   12.100   74.277   4.0193   72.182   4.0643 2.095505 5.716043 
1 1 1   18   32    3 o   23.275   5.4537   11.148   6.2751   16.769   9.4087   6.6432   8.4218   26.938   7.9333   19.612   7.4856 7.326014 10.90740 
1 1 1   18   32    4 o   45.884   5.5706   48.893   8.7805   46.086   17.367   49.856   10.177   43.529   9.8975   48.239   5.1151 -4.710026 11.14113 
1 1 1   18   32    5 o   54.198   4.1576   62.981   9.2142   75.672   13.796   52.761   12.380   59.171   5.6529   49.224   6.0981 9.947422 8.315170 
1 1 1   18   32    6 o   20.514   5.6467   7.0541   6.6326   5.8265   11.558   7.6568   8.0987   20.958   8.5244   20.069   7.4078 0.8890934 11.29347 
1 1 1   18   32    7 o   52.731   3.6268   58.817   7.7043   63.642   12.484   55.849   9.7912   54.265   5.5779   51.198   4.6368 3.066982 7.253507 
1 1 1   18   32    8 o   34.984   5.0348   30.021   6.9577   18.218   10.927   38.070   9.0235   27.885   8.6238   42.083   5.1988 -14.19853 10.06957 
1 1 1   18   32    9 o   62.425   3.3380   84.663   8.4281   72.359   12.557   94.751   11.370   57.970   5.2518   66.881   4.1218 -8.910995 6.676101 
1 1 1   18   32   10 o   41.719   4.2194   37.675   7.0536   39.466   11.504   36.596   8.9291   42.245   6.6023   41.192   5.2557 1.052906 8.438749 
1 1 1   18   32   11 o   35.433   4.5135   27.654   5.6612   29.212   11.094   27.106   6.5828   35.229   7.8377   35.637   4.4786 -0.4076462 9.027040 
1 1 1   18   32   12 o   34.077   5.0569   28.395   6.0425   22.946   12.255   30.145   6.9454   30.614   9.0647   37.541   4.4857 -6.926798 10.11387 
1 1 1   18   32   13 o   35.220   5.1962   27.938   6.9613   32.568   12.179   25.692   8.4836   36.862   8.2204   33.579   6.3584 3.282440 10.39245 
1 1 1   18   32   14 o   58.382   3.8273   80.602   8.3409   49.750   12.923  102.632   10.920   47.172   6.6423   69.592   3.8045 -22.42030 7.654691 
1 1 1   18   32   15 o   36.932   4.9686   30.921   7.0808   32.372   11.976   30.141   8.7798   36.794   8.1101   37.070   5.7424 -0.2762260 9.937243 
1 1 1   18   32   16 o   35.801   5.7070   30.378   7.6270   30.196   14.608   30.446   8.9427   34.423   9.8116   37.178   5.8320 -2.754589 11.41404 
1 1 1   18   32   17 o   21.673   6.0610   8.1442   7.1287   9.7214   14.661   7.6558   8.1580   23.569   9.5949   19.776   7.4080 3.792057 12.12194 
1 1 1   18   32   18 o   28.284   7.0077   19.429   10.020   25.110   15.620   15.457   13.061   30.899   10.380   25.669   9.4180 5.230165 14.01549 
1 1 1   18   32   19 o   44.620   7.0074   52.190   12.283   50.038   19.974   53.499   15.577   42.467   11.231   46.772   8.3829 -4.304798 14.01471 
1 1 1   18   32   20 f   18.369   5.7884  -0.9121   8.9068   2.3020   12.885  -3.8533   12.326   19.565   8.5206   17.173   7.8372 2.391747 11.57680 
1 1 1   18   32   21 o   32.243   6.6235   27.162   9.8029   37.158   13.996   17.537   13.735   38.004   9.0575   26.483   9.6668 11.52142 13.24706 
1 1 1   18   32   22 o   37.740   6.1600   37.464   10.061   21.867   14.451   52.132   14.015   28.520   9.9712   46.960   7.2359 -18.44031 12.32000 
1 1 1   18   32   23 o   46.247   7.6344   56.028   13.012   72.574   25.358   50.115   15.160   48.173   12.614   44.321   8.6034 3.851208 15.26876 
1 1 1   18   32   24 o   64.267   10.400  113.023   27.567  113.023   27.567   0.0000   0.0000   64.267   10.400  ?   ?       ?      ? 
1 1 1   18   33    0 o   9.9638   4.7791  -3.7787   8.3214  -3.7787   8.3214  -3.7787   8.3214   9.9638   6.7587   9.9638   6.7587 0.000000 0.000000 
1 1 1   18   33    1 o   29.188   5.2640   19.836   6.3882   22.746   9.1516   17.071   8.9215   31.329   7.2294   27.046   7.6535 4.283199 10.52804 
1 1 1   18   33    2 o   54.282   3.4971   63.077   7.6697   80.959   11.262   47.611   10.474   61.652   4.4290   46.912   5.4133 14.74004 6.994278 
1 1 1   18   33    3 o   26.683   6.0783   16.390   7.2878   16.489   13.020   16.344   8.7948   26.890   9.4606   26.476   7.6340 0.4144478 12.15655 
1 1 1   18   33    4 o   29.886   6.3829   22.920   8.1436   12.287   18.581   25.448   9.0602   26.455   10.790   33.317   6.8229 -6.861704 12.76580 
1 1 1   18   33    5 o   38.009   5.4986   35.005   8.3912   23.636   12.514   44.294   11.311   31.126   9.1443   44.891   6.1091 -13.76546 10.99721 
1 1 1   18   33    6 o   19.457   5.3771   6.1071   6.4277   0.9349   10.446   9.2589   8.1542   17.880   7.7291   21.034   7.4777 -3.153742 10.75427 
1 1 1   18   33    7 o   60.818   3.2738   80.082   8.0918   73.926   12.230   84.875   10.792   58.486   5.0699   63.150   4.1434 -4.663322 6.547623 
1 1 1   18   33    8 o  105.036   3.0941  237.903   13.245  254.047   17.847  218.107   19.763  109.376   3.9561  100.696   4.7585 8.679626 6.188205 
1 1 1   18   33    9 o   41.781   4.1970   37.924   7.1431   41.630   11.183   35.370   9.2835   43.336   6.2569   40.227   5.5954 3.109165 8.393917 
1 1 1   18   33   10 o   26.977   5.4416   17.780   6.4452   12.981   10.598   20.596   8.1192   24.135   8.5308   29.819   6.7579 -5.683538 10.88319 
1 1 1   18   33   11 o   74.882   2.9352  119.215   9.0544  124.782   13.202  114.270   12.442   76.510   4.1837   73.254   4.1179 3.256615 5.870302 
1 1 1   18   33   12 o   52.151   3.7725   61.243   7.7797   49.099   11.993   70.064   10.222   47.060   6.1791   57.243   4.3296 -10.18259 7.544983 
1 1 1   18   33   13 o   45.083   4.0944   44.633   7.2747   45.310   12.222   44.261   9.0532   44.915   6.5974   45.251   4.8508 -0.3352280 8.188733 
1 1 1   18   33   14 o   33.650   6.1405   27.518   8.8151   18.847   11.893   38.091   13.132   27.687   9.0485   39.613   8.3033 -11.92593 12.28093 
1 1 1   18   33   15 o   30.336   8.4116   18.248   14.913   6.6715   18.128   42.487   26.231   23.590   10.190   37.082   13.386 -13.49232 16.82321 
1 1 1   18   33   16 o   70.600   3.9592  110.435   11.528  110.102   16.199  110.777   16.409   70.518   5.5695   70.682   5.6286 -0.1641464 7.918416 
1 1 1   18   33   17 o   43.463   5.8200   45.954   10.116   34.742   14.028   58.100   14.600   36.777   9.2553   50.149   7.0588 -13.37194 11.63991 
1 1 1   18   33   18 o   22.231   6.3314   8.3505   9.1927   2.2708   12.935   14.555   13.067   19.522   8.5185   24.940   9.3691 -5.417614 12.66272 
1 1 1   18   33   19 o   45.512   6.6127   59.049   11.964   33.998   19.264   74.780   15.265   33.950   11.526   57.073   6.4849 -23.12289 13.22539 
1 1 1   18   33   20 o   29.513   7.4842   19.040   11.266   41.609   20.448   9.2026   13.500   36.821   11.852   22.206   9.1425 14.61514 14.96842 
1 1 1   18   33   21 o   17.782   6.0013  -8.4360   10.684 -19.0134   22.717  -5.4316   12.107   19.279   9.3286   16.285   7.5523 2.994131 12.00253 
1 1 1   18   33   22 o   35.820   7.3609   40.636   12.392   23.550   23.794   46.996   14.517   28.758   12.014   42.881   8.5083 -14.12311 14.72182 
1 1 1   18   34    0 o   35.927   5.2124   30.819   9.6525   30.819   9.6525   30.819   9.6525   35.927   7.3715   35.927   7.3715 0.000000 0.000000 
1 1 1   18   34    1 o  108.440   2.9873  254.279   13.155  285.284   17.941  218.224   19.347  116.072   3.7476  100.807   4.6532 15.26495 5.974699 
1 1 1   18   34    2 o   57.898   3.3187   72.474   7.8641   63.625   11.255   80.914   10.992   54.250   5.0304   61.547   4.3303 -7.296665 6.637449 
1 1 1   18   34    3 o   31.956   6.3541   21.852   7.8439   33.985   15.762   17.858   9.0432   36.466   10.122   27.446   7.6842 9.020025 12.70827 
1 1 1   18   34    4 o   24.500   6.5880   6.4765   7.4367   26.854   18.050   2.3103   8.1616   32.257   11.151   16.742   7.0185 15.51543 13.17607 
1 1 1   18   34    5 o   41.770   5.0572   40.576   8.3199   30.878   11.828   50.075   11.706   35.869   8.1765   47.671   5.9535 -11.80153 10.11436 
1 1 1   18   34    6 o   61.933   3.1616   82.561   8.0105   78.744   11.935   85.691   10.806   60.454   4.7867   63.412   4.1316 -2.957787 6.323185 
1 1 1   18   34    7 o   17.295   5.0964   1.5609   6.0525   7.1784   9.6016  -2.1429   7.7965   20.267   7.9237   14.322   6.4117 5.945580 10.19288 
1 1 1   18   34    8 o   44.994   3.9883   44.202   7.3141   46.157   11.327   42.803   9.5789   45.654   6.0153   44.334   5.2386 1.320286 7.976616 
1 1 1   18   34    9 o   28.763   5.6451   20.188   6.8916   18.475   10.970   21.305   8.8577   27.531   8.6615   29.995   7.2420 -2.463854 11.29024 
1 1 1   18   34   10 o   19.681   5.1974   7.0101   6.2584  -2.6058   10.573   12.196   7.7646   16.439   7.4044   22.922   7.2956 -6.483021 10.39478 
1 1 1   18   34   11 o   38.793   5.4521   37.010   7.8080   32.283   14.123   39.091   9.3701   35.422   9.4800   42.164   5.3881 -6.741543 10.90424 
1 1 1   18   34   12 o   44.256   5.7971   46.980   10.304   55.982   15.131   39.195   14.072   48.965   7.4925   39.548   8.8481 9.416363 11.59420 
1 1 1   18   34   13 o   22.446   6.1630   8.4389   8.7981   17.428   12.386  -0.7154   12.499   26.579   9.2346   18.312   8.1640 8.266857 12.32595 
1 1 1   18   34   14 o   48.012   5.1959   53.826   10.266   50.158   14.520   57.493   14.517   46.159   7.6265   49.865   7.0586 -3.705418 10.39171 
1 1 1   18   34   15 o   28.369   7.2142   15.911   14.739   39.465   17.921 -33.3128   25.907   37.542   10.919   19.195   9.4323 18.34669 14.42850 
1 1 1   18   34   16 o   28.362   6.6866   21.282   11.160  -2.9115   19.388   33.271   13.648   21.063   9.6927   35.661   9.2137 -14.59809 13.37311 
1 1 1   18   34   17 o   72.375   5.2888  127.430   14.411  116.532   25.203  132.724   17.566   67.788   9.0145   76.962   5.5340 -9.174263 10.57765 
1 1 1   18   34   18 o   30.247   7.6798   25.148   11.570   31.009   20.693   22.483   13.954   31.776   11.819   28.719   9.8099 3.057070 15.35964 
1 1 1   18   34   19 o   18.924   6.1580  -1.9379   10.273  -6.9094   19.565  -0.0455   12.071   19.952   9.3663   17.896   7.9973 2.056330 12.31605 
1 1 1   18   35    0 o   37.193   5.0028   32.705   9.7117   32.705   9.7117   32.705   9.7117   37.193   7.0750   37.193   7.0750 0.000000 0.000000 
1 1 1   18   35    1 o   24.772   5.5432   14.427   6.4587   18.054   9.2276   10.943   9.0432   27.329   7.8012   22.214   7.8772 5.114357 11.08645 
1 1 1   18   35    2 o   18.343   5.1842   3.4608   6.3265   10.333   9.1618  -2.8026   8.7466   21.836   7.9067   14.850   6.7074 6.985971 10.36847 
1 1 1   18   35    3 o   21.408   6.2741   7.0571   7.8535   4.9890   17.584   7.5725   8.7776   22.878   9.9587   19.937   7.6344 2.940771 12.54827 
1 1 1   18   35    4 o   49.269   5.8741   69.688   9.3917   36.536   17.728   82.622   11.073   36.556   10.920   61.981   4.3316 -25.42506 11.74810 
1 1 1   18   35    5 o   34.297   5.5312   28.786   7.6906   33.289   10.687   23.950   11.076   37.565   7.1590   31.030   8.4336 6.535170 11.06241 
1 1 1   18   35    6 o   30.076   5.9332   22.767   7.4162   20.736   13.190   23.705   8.9679   28.552   9.5385   31.601   7.0588 -3.048828 11.86634 
1 1 1   18   35    7 o   74.646   3.5196  121.104   10.206  123.339   17.682  119.988   12.498   74.457   5.7580   74.834   4.0492 -0.3763428 7.039159 
1 1 1   18   35    8 o   31.205   6.1678   22.175   7.6308   31.902   14.416   18.389   8.9943   34.911   9.6763   27.499   7.6508 7.412283 12.33552 
1 1 1   18   35    9 o  107.362   3.1145  244.643   13.312  265.079   22.244  233.241   16.615  110.234   4.8925  104.490   3.8554 5.743607 6.229021 
1 1 1   18   35   10 o   32.945   5.5464   30.718   7.8728   12.261   14.519   38.405   9.3698   24.236   9.6595   41.654   5.4539 -17.41842 11.09287 
1 1 1   18   35   11 o   68.678   5.1747  105.787   14.272  132.903   23.732   90.423   17.864   74.847   7.6877   62.508   6.9289 12.33815 10.34943 
1 1 1   18   35   12 o   29.719   7.2556   24.232   10.785   19.689   19.142   26.345   13.054   27.840   11.093   31.598   9.3555 -3.757854 14.51121 
1 1 1   18   35   13 o   22.322   6.7345   6.1256   10.356   14.459   18.032   2.0242   12.650   25.545   10.547   19.099   8.3767 6.445959 13.46901 
1 1 1   18   35   14 o   21.554   6.6922   4.9145   10.442   6.7435   19.947   4.2240   12.255   23.468   10.396   19.640   8.4298 3.828485 13.38432 
1 1 1   18   35   15 o   30.097   12.669   27.386   26.773   0.0000   0.0000   27.386   26.773  ?   ?    30.097   12.669      ?      ? 
1 1 1   18   35   16 o   33.881   7.4625   34.737   11.934   25.943   21.015   38.922   14.498   29.597   11.676   38.165   9.2964 -8.567900 14.92504 
1 1 1   18   36    0 o   65.987   4.2733   95.974   16.130   95.974   16.130   95.974   16.130   65.987   6.0433   65.987   6.0433 0.000000 0.000000 
1 1 1   18   36    1 o   45.820   5.1534   48.913   9.3995   60.087   13.985   39.706   12.694   51.246   6.6166   40.394   7.9026 10.85239 10.30680 
1 1 1   18   36    2 o   76.267   3.3710  120.464   10.178  150.092   17.628  105.648   12.465   82.580   5.1757   69.955   4.3204 12.62543 6.741930 
1 1 1   18   36    3 o   39.415   6.0540   35.009   9.8418   0.0000   0.0000   35.009   9.8418  ?   ?    39.415   6.0540      ?      ? 
1 1 1   18   36    4 o   63.218   4.8151   97.779   10.353   79.768   20.361  104.059   12.023   56.952   8.6683   69.485   4.1952 -12.53358 9.630118 
1 1 1   18   36    5 o   20.014   5.7228   0.4625   7.8459   17.448   13.004  -9.2608   9.8386   26.378   9.4360   13.649   6.4780 12.72826 11.44564 
1 1 1   18   36    6 o   47.631   6.2051   56.366   11.559   58.714   18.757   54.929   14.678   47.030   9.9787   48.232   7.3782 -1.202274 12.41012 
1 1 1   18   36    7 o   27.881   6.8875   18.022   9.9517   31.464   16.019   9.5741   12.700   33.543   10.453   22.219   8.9717 11.32346 13.77503 
1 1 1   18   36    8 o   43.017   6.5040   52.069   11.376   31.537   18.072   65.543   14.640   32.865   11.164   53.168   6.6761 -20.30310 13.00798 
1 1 1   18   36    9 o   25.510   7.1228   15.653   10.995   16.238   16.789   15.213   14.550   25.895   10.365   25.124   9.7730 0.7714195 14.24566 
1 1 1   18   36   10 o   17.327   5.7480  -8.1638   10.443 -11.9336   15.120  -4.7247   14.441   16.693   7.9534   17.961   8.3008 -1.267496 11.49606 
1 1 1   18   36   11 f   19.626   6.2287   0.9933   10.240  -2.2332   17.213   2.7607   12.740   19.980   9.1714   19.272   8.4304 0.7080402 12.45736 
1 1 1   18   36   12 o   22.772   6.6582   9.4559   10.868  -4.6953   18.864   16.487   13.297   20.112   9.3608   25.431   9.4712 -5.319958 13.31646 
1 1 1   18   36   13 o   38.189   7.2699   42.708   11.763   35.824   19.926   46.391   14.574   33.884   11.716   42.495   8.6100 -8.611115 14.53976 
1 1 1   18   37    1 o   19.809   6.6068  -4.6472   12.206  -1.1333   13.625 -18.9253   27.465   18.479   8.3567   21.139   10.236 -2.659298 13.21365 
1 1 1   18   37    2 o   26.194   7.9559   13.471   13.188   10.558   14.871   24.196   28.537   23.085   9.5587   29.303   12.721 -6.218204 15.91185 
1 1 1   18   37    3 o   24.222   11.338  -0.0561   28.317   0.0000   0.0000  -0.0561   28.317  ?   ?    24.222   11.338      ?      ? 
1 1 1   18   37    4 o   48.290   8.3396   78.401   17.344   89.209   20.676   52.738   31.861   59.797   8.3835   36.782   14.419 23.01427 16.67922 
1 1 1   18   37    5 f   48.681   8.4578   77.432   16.842   83.189   19.733   61.988   32.321   57.851   8.2703   39.510   14.756 18.34150 16.91560 
1 1 1   18   37    6 f   25.109   7.7984   12.008   13.962   13.490   15.583   5.9756   31.444   24.367   9.9028   25.850   12.050 -1.482269 15.59671 
1 1 1   18   37    7 o   59.151   7.9994   89.461   16.988   76.655   19.601  128.116   34.056   55.081   8.6281   63.220   13.473 -8.138863 15.99884 
1 1 1   19    0    1 o   47.603   3.3851   48.175   9.1811   48.175   9.1811   48.175   9.1811   47.603   4.7872   47.603   4.7872 0.000000 0.000000 
1 1 1   19    0    2 o  315.435   2.6728  2054.00   49.161  2054.00   49.161  2054.00   49.161  315.435   3.7800  315.435   3.7800 0.000000 0.000000 
1 1 1   19    0    3 o  185.988   2.1652  714.216   23.475  714.216   23.475  714.216   23.475  185.988   3.0621  185.988   3.0621 0.000000 0.000000 
1 1 1   19    0    4 o  258.761   2.4235  1382.24   36.563  1382.24   36.563  1382.24   36.563  258.761   3.4273  258.761   3.4273 0.000000 0.000000 
1 1 1   19    0    5 o  301.329   2.6033  1874.47   45.740  1874.47   45.740  1874.47   45.740  301.329   3.6816  301.329   3.6816 0.000000 0.000000 
1 1 1   19    0    6 o  180.152   2.5034  670.469   26.283  670.469   26.283  670.469   26.283  180.152   3.5404  180.152   3.5404 0.000000 0.000000 
1 1 1   19    0    7 o   44.780   5.0900   44.523   12.264   44.523   12.264   44.523   12.264   44.780   7.1983   44.780   7.1983 0.000000 0.000000 
1 1 1   19    0    8 o  108.131   3.0442  242.509   19.131  242.509   19.131  242.509   19.131  108.131   4.3052  108.131   4.3052 0.000000 0.000000 
1 1 1   19    0    9 o  158.796   2.4237  521.075   22.425  521.075   22.425  521.075   22.425  158.796   3.4276  158.796   3.4276 0.000000 0.000000 
1 1 1   19    0   10 o   89.852   2.3092  167.247   12.066  167.247   12.066  167.247   12.066   89.852   3.2657   89.852   3.2657 0.000000 0.000000 
1 1 1   19    0   11 o   43.464   3.8677   40.831   9.3838   40.831   9.3838   40.831   9.3838   43.464   5.4698   43.464   5.4698 0.000000 0.000000 
1 1 1   19    0   12 o   45.292   3.6147   43.956   9.2362   43.956   9.2362   43.956   9.2362   45.292   5.1120   45.292   5.1120 0.000000 0.000000 
1 1 1   19    0   13 o   8.8550   4.3378  -6.5178   7.7245  -6.5178   7.7245  -6.5178   7.7245   8.8550   6.1345   8.8550   6.1345 0.000000 0.000000 
1 1 1   19    0   14 o   70.026   2.6313  102.068   10.678  102.068   10.678  102.068   10.678   70.026   3.7212   70.026   3.7212 0.000000 0.000000 
1 1 1   19    0   15 o   25.585   7.1252   18.650   10.210   18.650   10.210   18.650   10.210   25.585   10.077   25.585   10.077 0.000000 0.000000 
1 1 1   19    0   16 o  273.416   3.5727  1545.95   56.934  1545.95   56.934  1545.95   56.934  273.416   5.0526  273.416   5.0526 0.000000 0.000000 
1 1 1   19    0   17 o  145.667   2.3827  438.653   20.220  438.653   20.220  438.653   20.220  145.667   3.3697  145.667   3.3697 0.000000 0.000000 
1 1 1   19    0   18 o  102.940   2.5546  219.550   15.296  219.550   15.296  219.550   15.296  102.940   3.6128  102.940   3.6128 0.000000 0.000000 
1 1 1   19    0   19 o   75.768   3.0456  119.705   13.360  119.705   13.360  119.705   13.360   75.768   4.3071   75.768   4.3071 0.000000 0.000000 
1 1 1   19    0   20 f  302.262   2.7399  1887.34   48.287  1887.34   48.287  1887.34   48.287  302.262   3.8748  302.262   3.8748 0.000000 0.000000 
1 1 1   19    0   21 o   42.152   5.3214   40.107   11.841   40.107   11.841   40.107   11.841   42.152   7.5255   42.152   7.5255 0.000000 0.000000 
1 1 1   19    0   22 o  198.432   2.4907  813.695   28.807  813.695   28.807  813.695   28.807  198.432   3.5224  198.432   3.5224 0.000000 0.000000 
1 1 1   19    0   23 o   88.569   3.0276  163.183   15.557  163.183   15.557  163.183   15.557   88.569   4.2816   88.569   4.2816 0.000000 0.000000 
1 1 1   19    0   24 f  131.914   4.1945  362.413   32.125  362.413   32.125  362.413   32.125  131.914   5.9319  131.914   5.9319 0.000000 0.000000 
1 1 1   19    0   25 f   84.250   3.4494  148.276   16.821  148.276   16.821  148.276   16.821   84.250   4.8782   84.250   4.8782 0.000000 0.000000 
1 1 1   19    0   26 o  211.546   3.2726  927.031   40.337  927.031   40.337  927.031   40.337  211.546   4.6281  211.546   4.6281 0.000000 0.000000 
1 1 1   19    0   27 o   33.810   7.0338   29.212   12.054   29.212   12.054   29.212   12.054   33.810   9.9473   33.810   9.9473 0.000000 0.000000 
1 1 1   19    0   28 o  135.100   2.9162  378.741   22.932  378.741   22.932  378.741   22.932  135.100   4.1241  135.100   4.1241 0.000000 0.000000 
1 1 1   19    0   29 o   28.908   7.5315   23.441   11.755   23.441   11.755   23.441   11.755   28.908   10.651   28.908   10.651 0.000000 0.000000 
1 1 1   19    0   30 o   54.189   4.3957   63.520   13.420   63.520   13.420   63.520   13.420   54.189   6.2165   54.189   6.2165 0.000000 0.000000 
1 1 1   19    0   31 o  120.761   2.8100  303.112   19.744  303.112   19.744  303.112   19.744  120.761   3.9739  120.761   3.9739 0.000000 0.000000 
1 1 1   19    0   32 o  210.294   4.4056  926.977   53.933  926.977   53.933  926.977   53.933  210.294   6.2305  210.294   6.2305 0.000000 0.000000 
1 1 1   19    0   33 o   93.126   3.1002  181.421   16.755  181.421   16.755  181.421   16.755   93.126   4.3843   93.126   4.3843 0.000000 0.000000 
1 1 1   19    0   34 o   28.361   10.729   26.724   24.276   26.724   24.276   26.724   24.276   28.361   15.172   28.361   15.172 0.000000 0.000000 
1 1 1   19    0   35 f   20.944   7.4626   13.977   11.263   13.977   11.263   13.977   11.263   20.944   10.554   20.944   10.554 0.000000 0.000000 
1 1 1   19    0   36 o  114.653   3.1074  274.968   20.711  274.968   20.711  274.968   20.711  114.653   4.3945  114.653   4.3945 0.000000 0.000000 
1 1 1   19    0   37 o   36.094   7.0643   33.496   12.863   33.496   12.863   33.496   12.863   36.094   9.9904   36.094   9.9904 0.000000 0.000000 
1 1 1   19    0   38 o   15.902   6.7529   6.1513   11.276   6.1513   11.276   6.1513   11.276   15.902   9.5500   15.902   9.5500 0.000000 0.000000 
1 1 1   19    0   39 o   8.7869   4.4789 -19.8412   11.536 -19.8412   11.536 -19.8412   11.536   8.7869   6.3341   8.7869   6.3341 0.000000 0.000000 
1 1 1   19    0   40 o   54.048   8.2500   73.156   22.816   73.156   22.816   73.156   22.816   54.048   11.667   54.048   11.667 0.000000 0.000000 
1 1 1   19    0   41 o   29.141   10.519   31.523   22.548   31.523   22.548   31.523   22.548   29.141   14.876   29.141   14.876 0.000000 0.000000 
1 1 1   19    0   42 f   38.958   11.467   52.254   26.007   52.254   26.007   52.254   26.007   38.958   16.217   38.958   16.217 0.000000 0.000000 
1 1 1   19    0   43 o   18.328   8.6484   0.3695   25.245   0.3695   25.245   0.3695   25.245   18.328   12.231   18.328   12.231 0.000000 0.000000 
1 1 1   19    1    0 f   60.724   2.8622   77.103   10.035   77.103   10.035   77.103   10.035   60.724   4.0478   60.724   4.0478 0.000000 0.000000 
1 1 1   19    1    1 o  258.754   2.4163  1381.97   25.786  1390.16   36.692  1373.99   36.245  259.510   3.4281  257.998   3.4062 1.511749 4.832568 
1 1 1   19    1    2 o  229.385   2.2995  1085.80   21.752  1099.46   31.099  1072.72   30.434  230.796   3.2671  227.975   3.2367 2.821884 4.598945 
1 1 1   19    1    3 o  104.906   2.2191  227.136   9.5992  233.947   13.632  220.438   13.519  106.467   3.1044  103.345   3.1718 3.121643 4.438202 
1 1 1   19    1    4 o   28.905   4.7469   17.781   5.8355   10.709   8.2577   24.835   8.2477   23.158   7.5386   34.652   5.7708 -11.49376 9.493806 
1 1 1   19    1    5 o   71.360   2.5278  105.222   7.4258  113.267   10.544   97.305   10.460   74.071   3.4514   68.648   3.6943 5.422531 5.055642 
1 1 1   19    1    6 o   66.277   3.2758   88.861   8.8475   78.727   11.480  103.684   13.885   61.725   4.5093   70.829   4.7529 -9.103424 6.551638 
1 1 1   19    1    7 o  113.399   2.9886  265.535   13.974  271.559   20.076  259.874   19.462  114.645   4.2457  112.154   4.2073 2.491791 5.977221 
1 1 1   19    1    8 o   93.660   3.1274  181.133   12.076  174.604   16.808  188.100   17.361   91.916   4.4335   95.404   4.4121 -3.487373 6.254788 
1 1 1   19    1    9 o  148.957   2.6220  461.668   15.240  447.635   26.002  469.010   18.808  147.183   4.2834  150.732   3.0254 -3.549118 5.244078 
1 1 1   19    1   10 o  116.659   2.3171  277.428   11.034  305.053   17.146  257.901   14.415  121.547   3.4203  111.770   3.1270 9.776253 4.634285 
1 1 1   19    1   11 o  192.494   2.2041  764.778   17.497  775.839   24.985  754.133   24.511  193.859   3.1248  191.129   3.1094 2.730118 4.408252 
1 1 1   19    1   12 o  207.690   2.2409  890.537   19.196  886.926   27.111  894.167   27.183  207.267   3.1714  208.112   3.1668 -0.8447723 4.481821 
1 1 1   19    1   13 o  157.499   2.1407  511.785   13.902  496.697   19.377  527.788   19.956  155.108   3.0289  159.889   3.0261 -4.780930 4.281490 
1 1 1   19    1   14 o  271.295   2.4871  1519.77   27.821  1540.82   39.910  1499.88   38.803  273.118   3.5430  269.472   3.4913 3.646240 4.974099 
1 1 1   19    1   15 o  185.256   2.8919  712.159   21.675  694.297   33.918  724.487   28.179  183.243   4.4879  187.269   3.6483 -4.025986 5.783728 
1 1 1   19    1   16 o  184.016   3.1518  700.158   23.920  692.146   33.600  708.392   34.060  182.949   4.4530  185.083   4.4618 -2.133652 6.303693 
1 1 1   19    1   17 o  336.188   3.1088  2337.60   42.625  2338.08   56.240  2336.96   65.339  336.301   4.0546  336.075   4.7138 0.2255554 6.217675 
1 1 1   19    1   18 o  160.089   2.6682  534.955   17.352  565.389   23.042  495.086   26.372  165.436   3.3769  154.742   4.1321 10.69360 5.336465 
1 1 1   19    1   19 o   73.591   3.1132  112.195   9.4334  105.438   13.408  118.818   13.274   71.386   4.5540   75.797   4.2462 -4.410507 6.226475 
1 1 1   19    1   20 f  174.344   2.4486  628.071   17.603  627.780   25.166  628.349   24.633  174.301   3.5006  174.388   3.4248 -0.8651733E-01 4.897269 
1 1 1   19    1   21 o   83.703   2.9720  144.613   10.248  151.583   14.931  138.406   14.092   85.604   4.2290   81.801   4.1769 3.802269 5.943982 
1 1 1   19    1   22 o  251.426   2.5935  1306.17   26.886  1332.17   38.639  1281.76   37.434  253.847   3.6905  249.005   3.6450 4.841568 5.187045 
1 1 1   19    1   23 o  231.417   3.2219  1113.93   30.107  1134.92   39.006  1083.01   47.352  234.224   4.0377  228.610   5.0220 5.614441 6.443882 
1 1 1   19    1   24 o  103.635   4.1466  224.316   17.416  229.665   22.771  216.778   27.032  105.209   5.2477  102.061   6.4217 3.148575 8.293150 
1 1 1   19    1   25 o   63.661   3.9788   83.765   10.364   99.728   15.247   70.051   14.131   69.293   5.3349   58.029   5.9043 11.26452 7.957514 
1 1 1   19    1   26 o  101.254   2.9145  212.462   12.171  212.816   17.135  212.102   17.290  101.341   4.0995  101.166   4.1439 0.1753082 5.829056 
1 1 1   19    1   27 o  144.643   2.7056  431.382   16.092  407.891   21.752  459.781   23.917  140.326   3.7584  148.960   3.8929 -8.634476 5.411103 
1 1 1   19    1   28 o   92.174   3.4964  180.075   13.054  151.064   19.237  204.833   17.771   85.067   5.4830   99.281   4.3399 -14.21415 6.992743 
1 1 1   19    1   29 o   37.721   6.0204   31.179   9.1360   27.190   12.357   35.988   13.568   35.032   8.6130   40.410   8.4140 -5.377991 12.04071 
1 1 1   19    1   30 o   97.971   3.1576  200.328   12.719  197.774   18.672  202.539   17.374   97.342   4.6509   98.600   4.2722 -1.257851 6.315234 
1 1 1   19    1   31 f  142.917   2.7107  424.836   15.978  429.877   22.709  419.893   22.485  143.757   3.8299  142.076   3.8372 1.681503 5.421494 
1 1 1   19    1   32 o   50.426   4.5426   54.691   9.2974   44.808   13.362   63.966   12.945   45.797   7.0740   55.055   5.7009 -9.257187 9.085183 
1 1 1   19    1   33 o   78.942   3.3843  130.977   11.006  123.405   15.514  138.651   15.618   76.605   4.9101   81.278   4.6589 -4.672890 6.768615 
1 1 1   19    1   34 o   41.025   7.0846   37.633   11.190   42.816   20.272   35.362   13.420   42.506   11.350   39.544   8.4823 2.961861 14.16922 
1 1 1   19    1   35 o   23.157   6.1970   9.0013   8.1111   11.646   12.114   6.8527   10.920   24.755   9.0722   21.559   8.4443 3.195848 12.39402 
1 1 1   19    1   36 o   63.338   7.9581   94.357   13.499   94.354   37.072   94.358   14.494   59.983   15.019   66.692   5.2694 -6.708221 15.91612 
1 1 1   19    1   37 o   30.903   9.0496   12.722   11.570   27.133   40.745   11.459   12.067   37.414   15.683   24.393   9.0348 13.02025 18.09925 
1 1 1   19    1   38 o   84.217   3.6549  151.156   12.569  150.929   16.651  151.457   19.161   84.339   4.7870   84.095   5.5245 0.2439194 7.309899 
1 1 1   19    1   39 o   22.785   6.2230   9.1923   8.3636   6.4914   12.317   11.503   11.393   21.714   8.8116   23.857   8.7896 -2.142950 12.44598 
1 1 1   19    1   40 o   26.466   6.1450   13.795   8.7379   1.9242   12.026   27.069   12.717   19.475   8.3546   33.457   9.0135 -13.98203 12.28993 
1 1 1   19    1   41 o   17.103   5.9361 -33.6547   14.451 -21.7817   20.328 -45.7840   20.546   18.601   8.9567   15.606   7.7927 2.995426 11.87222 
1 1 1   19    1   42 o   41.496   8.3521   47.721   19.904   86.530   26.400  -3.3960   30.298   57.041   11.616   25.951   12.004 31.08988 16.70417 
1 1 1   19    1   43 o   23.129   7.6413 -11.7045   18.583   8.2058   26.525 -30.8977   26.043   26.529   11.855   19.728   9.6445 6.801228 15.28269 
1 1 1   19    1   44 o   47.961   15.145   81.251   33.510   0.0000   0.0000   81.251   33.510  ?   ?    47.961   15.145      ?      ? 
1 1 1   19    2    0 o  444.357   3.3610  4077.15   87.090  4077.15   87.090  4077.15   87.090  444.357   4.7532  444.357   4.7532 0.000000 0.000000 
1 1 1   19    2    1 o   88.580   2.3437  161.902   8.5604  167.222   12.224  156.784   11.991   90.008   3.2929   87.153   3.3360 2.855522 4.687416 
1 1 1   19    2    2 o  330.170   2.7459  2250.91   37.393  2243.25   52.726  2258.66   53.038  329.605   3.8785  330.735   3.8881 -1.129303 5.491827 
1 1 1   19    2    3 o  128.907   2.1250  342.948   11.298  345.737   15.991  340.169   15.964  129.430   2.9956  128.383   3.0148 1.046982 4.250006 
1 1 1   19    2    4 o  166.936   2.1294  575.048   14.660  584.107   20.897  566.269   20.572  168.230   3.0117  165.641   3.0112 2.588760 4.258876 
1 1 1   19    2    5 o   72.953   2.5423  109.884   7.6493  109.282   10.774  110.496   10.863   72.752   3.5904   73.154   3.6002 -0.4027557 5.084573 
1 1 1   19    2    6 o  200.588   2.8235  832.530   22.996  839.564   30.060  822.605   35.705  201.640   3.6145  199.536   4.3386 2.104172 5.646900 
1 1 1   19    2    7 o  223.158   2.9202  1032.76   26.536  1054.91   35.066  1003.09   40.594  226.002   3.7619  220.313   4.4674 5.688980 5.840356 
1 1 1   19    2    8 o  182.252   3.0298  686.325   22.774  692.013   32.362  680.745   32.054  183.000   4.2876  181.505   4.2818 1.495483 6.059513 
1 1 1   19    2    9 o  217.132   2.4368  971.445   21.579  987.292   33.211  959.866   28.388  218.641   3.6828  215.623   3.1921 3.018448 4.873658 
1 1 1   19    2   10 o   49.200   3.3871   49.754   6.8391   52.838   10.303   47.325   9.1443   50.551   4.9416   47.849   4.6336 2.702061 6.774182 
1 1 1   19    2   11 f  293.780   2.5825  1782.35   31.291  1792.32   44.499  1772.59   44.009  294.592   3.6624  292.969   3.6421 1.623840 5.165096 
1 1 1   19    2   12 o   88.207   2.3473  160.688   8.5375  158.662   12.162  162.656   11.987   87.658   3.3641   88.757   3.2745 -1.099380 4.694624 
1 1 1   19    2   13 o  127.566   2.1637  335.931   11.382  327.820   16.002  344.237   16.194  126.007   3.0790  129.125   3.0407 -3.118546 4.327370 
1 1 1   19    2   14 o  262.059   2.4508  1418.38   26.488  1427.23   37.693  1409.76   37.232  262.865   3.4766  261.254   3.4553 1.611450 4.901615 
1 1 1   19    2   15 o  217.018   2.9795  974.855   26.123  966.907   41.246  980.178   33.756  216.227   4.6249  217.810   3.7576 -1.583694 5.958982 
1 1 1   19    2   16 o  259.276   2.7128  1389.42   28.820  1387.31   43.282  1391.09   38.630  259.069   4.0507  259.483   3.6095 -0.4150391 5.425523 
1 1 1   19    2   17 o  151.173   2.5890  469.967   15.955  457.937   20.903  486.760   24.697  148.887   3.4040  153.459   3.9019 -4.572052 5.178066 
1 1 1   19    2   18 o  232.128   2.9450  1114.06   28.193  1107.90   39.563  1120.41   40.187  231.480   4.1439  232.777   4.1858 -1.297073 5.890046 
1 1 1   19    2   19 o  292.936   2.8998  1760.34   34.493  1852.29   54.315  1698.20   44.653  299.236   4.4009  286.636   3.7771 12.59958 5.799519 
1 1 1   19    2   20 o  179.106   2.6456  661.648   19.522  695.554   28.416  631.339   26.867  183.441   3.7558  174.771   3.7272 8.669739 5.291262 
1 1 1   19    2   21 o   31.387   5.7758   21.300   7.7247   27.503   10.885   15.004   10.965   35.674   7.6286   27.099   8.6743 8.574812 11.55160 
1 1 1   19    2   22 o  215.900   3.5020  965.624   31.183  962.063   44.258  969.133   43.943  215.499   4.9794  216.300   4.9257 -0.8009033 7.004063 
1 1 1   19    2   23 o  142.089   2.9092  419.855   16.665  428.236   21.532  407.335   26.316  143.918   3.6275  140.259   4.5491 3.658951 5.818325 
1 1 1   19    2   24 o   70.335   4.3370   97.499   12.175  125.211   20.663   82.760   15.069   77.557   6.4595   63.112   5.7891 14.44585 8.674044 
1 1 1   19    2   25 o   80.720   3.7068  134.606   12.306  122.396   16.766  148.867   18.120   76.766   5.2953   84.674   5.1884 -7.907387 7.413515 
1 1 1   19    2   26 o   31.201   5.8484   19.193   8.8343   36.833   12.821   3.2481   12.190   41.247   7.8227   21.154   8.6960 20.09379 11.69676 
1 1 1   19    2   27 o  148.624   2.6694  457.496   16.360  463.651   23.405  451.615   22.877  149.598   3.7934  147.650   3.7566 1.947891 5.338739 
1 1 1   19    2   28 o   74.844   3.8683  116.965   11.691  116.863   18.509  117.032   15.080   74.723   6.0056   74.965   4.8774 -0.2421265 7.736648 
1 1 1   19    2   29 o   64.281   3.9481   85.171   10.388   74.902   13.737   98.885   15.875   59.827   5.5671   68.735   5.5997 -8.908245 7.896116 
1 1 1   19    2   30 o   95.539   3.0461  190.256   12.000  185.704   17.004  194.773   16.937   94.386   4.3679   96.692   4.2469 -2.305428 6.092225 
1 1 1   19    2   31 o   93.199   3.0814  181.113   11.839  173.652   16.636  188.770   16.853   91.239   4.4208   95.158   4.2939 -3.919632 6.162878 
1 1 1   19    2   32 o   49.070   4.7648   51.241   9.6352   54.180   13.889   48.514   13.378   50.439   6.6762   47.700   6.8000 2.738701 9.529505 
1 1 1   19    2   33 o   56.915   6.5502   72.763   14.905   79.243   20.615   65.665   21.575   60.312   8.2874   53.518   10.146 6.794231 13.10031 
1 1 1   19    2   34 o   32.892   6.9622   26.569   11.058   5.8305   20.769   34.773   13.063   26.523   11.161   39.261   8.3255 -12.73763 13.92449 
1 1 1   19    2   35 o   29.027   6.4474   17.969   8.8254   25.599   13.130   11.680   11.920   33.375   9.2289   24.679   9.0059 8.696569 12.89487 
1 1 1   19    2   36 o   50.170   4.6194   54.178   9.5564   53.125   13.342   55.287   13.694   49.676   6.5121   50.663   6.5535 -0.9871254 9.238798 
1 1 1   19    2   37 o   71.277   4.0722  108.537   11.794  110.513   18.372  107.153   15.383   71.606   6.2206   70.949   5.2569 0.6576462 8.144358 
1 1 1   19    2   38 o   61.810   4.2626   82.804   10.810   87.866   14.892   77.165   15.718   63.986   5.6431   59.635   6.3903 4.351151 8.525232 
1 1 1   19    2   39 o   46.737   5.2111   48.157   9.9674   53.106   15.295   44.504   13.141   48.680   7.6179   44.794   7.1127 3.886696 10.42227 
1 1 1   19    2   40 o   29.490   5.6339   16.019   8.8841   40.357   13.330  -3.4329   11.917   41.529   8.0731   17.452   7.8606 24.07700 11.26782 
1 1 1   19    2   41 o   68.338   6.4689  116.874   14.059  121.738   16.061  100.931   29.080   74.920   5.1976   61.756   11.848 13.16397 12.93771 
1 1 1   19    2   42 o   51.753   8.8941   76.621   19.514   53.061   27.835   99.390   27.364   41.780   13.852   61.725   11.160 -19.94524 17.78829 
1 1 1   19    2   43 o   46.840   9.9295   69.060   20.720   57.880   27.638   83.409   31.310   42.554   13.788   51.125   14.293 -8.571495 19.85893 
1 1 1   19    2   44 o   29.891   12.921   22.376   29.192   0.0000   0.0000   22.376   29.192  ?   ?    29.891   12.921      ?      ? 
1 1 1   19    3    0 o   35.003   4.8558   28.036   8.8244   28.036   8.8244   28.036   8.8244   35.003   6.8671   35.003   6.8671 0.000000 0.000000 
1 1 1   19    3    1 o  148.085   2.1144  452.573   12.914  450.912   18.242  454.242   18.285  147.812   2.9923  148.357   2.9882 -0.5449677 4.228838 
1 1 1   19    3    2 o   78.560   2.4601  127.399   7.9623  119.415   11.165  135.660   11.358   76.054   3.5595   81.066   3.3970 -5.012001 4.920268 
1 1 1   19    3    3 f  336.624   2.7775  2339.97   38.561  2349.01   54.792  2331.09   54.278  337.267   3.9389  335.981   3.9169 1.286560 5.554923 
1 1 1   19    3    4 o  252.664   2.3909  1317.70   24.913  1331.32   35.548  1304.56   34.924  253.945   3.3940  251.383   3.3684 2.562485 4.781749 
1 1 1   19    3    5 o  319.233   2.8971  2108.17   37.887  2132.76   50.874  2077.56   56.769  321.358   3.8383  317.108   4.3404 4.250061 5.794162 
1 1 1   19    3    6 o  137.085   2.6840  389.287   14.962  395.347   19.665  380.959   23.054  138.374   3.4457  135.797   4.1162 2.576889 5.368038 
1 1 1   19    3    7 o  190.126   2.7905  749.521   21.573  764.297   28.390  729.328   33.188  192.381   3.5780  187.872   4.2831 4.509018 5.580901 
1 1 1   19    3    8 o  296.369   3.3516  1804.59   39.861  1863.86   64.767  1768.44   50.574  300.183   5.2312  292.556   4.1914 7.627472 6.703205 
1 1 1   19    3    9 o   67.330   2.7722   93.412   7.6432   95.532   11.578   91.776   10.175   67.999   4.1283   66.661   3.7010 1.338028 5.544392 
1 1 1   19    3   10 o   37.901   4.2723   30.615   6.3985   27.514   9.6911   33.012   8.5193   35.851   6.8029   39.951   5.1702 -4.100380 8.544564 
1 1 1   19    3   11 o  160.461   2.3404  534.298   15.335  510.939   23.101  552.701   20.505  157.294   3.5608  163.628   3.0383 -6.333237 4.680842 
1 1 1   19    3   12 o  107.638   2.4133  237.109   10.521  228.479   13.538  250.272   16.719  105.199   3.1201  110.077   3.6826 -4.878387 4.826663 
1 1 1   19    3   13 o  315.781   2.6865  2060.18   34.990  2058.26   49.431  2062.11   49.536  315.634   3.7971  315.928   3.8016 -0.2942200 5.373044 
1 1 1   19    3   14 o  295.409   2.8372  1789.32   33.781  1868.79   54.359  1739.32   43.119  300.650   4.3837  290.169   3.6029 10.48181 5.674312 
1 1 1   19    3   15 o   87.831   3.0104  160.526   10.069  156.706   18.027  162.259   12.139   87.025   5.0224   88.637   3.3206 -1.612663 6.020854 
1 1 1   19    3   16 o  234.557   2.6189  1136.16   25.197  1143.16   37.712  1130.51   33.866  235.186   3.8877  233.928   3.5101 1.258286 5.237855 
1 1 1   19    3   17 o   53.488   4.0162   58.574   8.8035   52.906   11.680   66.029   13.396   50.531   5.6041   56.444   5.7543 -5.912743 8.032318 
1 1 1   19    3   18 o   62.024   3.4337   79.803   8.7627   84.912   12.277   74.498   12.511   64.061   4.6467   59.986   5.0567 4.075165 6.867409 
1 1 1   19    3   19 o  113.306   3.4475  266.266   16.053  259.271   23.546  272.342   21.945  111.892   5.1021  114.719   4.6380 -2.827621 6.895050 
1 1 1   19    3   20 f  158.842   2.4424  521.339   16.001  523.196   22.622  519.479   22.635  159.126   3.4468  158.558   3.4612 0.5676117 4.884717 
1 1 1   19    3   21 f  220.417   2.7225  1005.98   24.453  1014.17   32.252  994.907   37.500  221.519   3.5301  219.314   4.1457 2.205032 5.445045 
1 1 1   19    3   22 o   75.051   5.0457  134.550   12.816   85.348   24.095  153.962   15.135   63.841   9.1510   86.261   4.2541 -22.42022 10.09149 
1 1 1   19    3   23 o  169.538   4.4991  595.146   31.460  595.146   31.460   0.0000   0.0000  169.538   4.4991  ?   ?       ?      ? 
1 1 1   19    3   24 f   87.165   4.2073  157.418   14.950  192.450   21.898  126.832   20.461   96.267   5.5152   78.062   6.3551 18.20521 8.414583 
1 1 1   19    3   25 o   96.516   3.0219  193.172   12.012  189.848   17.376  196.215   16.625   95.707   4.4018   97.326   4.1416 -1.619606 6.043894 
1 1 1   19    3   26 o   88.396   3.2081  162.313   11.638  159.943   17.273  164.283   15.750   87.776   4.7713   89.015   4.2898 -1.239197 6.416203 
1 1 1   19    3   27 o   40.307   6.3649   40.688   11.730   61.713   14.785   4.9695   19.271   54.312   6.6003   26.302   10.885 28.01002 12.72989 
1 1 1   19    3   28 f  124.742   2.8250  322.397   14.484  330.693   21.509  315.514   19.591  126.178   4.1330  123.307   3.8522 2.871742 5.649916 
1 1 1   19    3   29 o   33.934   7.1676   18.612   10.077   42.857   20.315   10.700   11.605   43.465   11.246   24.404   8.8893 19.06106 14.33526 
1 1 1   19    3   30 o   22.458   6.0957   6.9795   8.0905   11.820   11.736   2.5953   11.169   25.023   8.9628   19.893   8.2643 5.129881 12.19136 
1 1 1   19    3   31 o   61.782   3.8661   80.181   9.8386   84.721   13.901   75.624   13.927   63.568   5.3021   59.996   5.6281 3.572037 7.732243 
1 1 1   19    3   32 o   28.030   6.2663   17.014   8.2882   12.303   11.983   21.334   11.476   25.228   9.0547   30.832   8.6647 -5.603832 12.53253 
1 1 1   19    3   33 o   42.176   6.7504   41.799   10.709   44.204   12.599   35.543   20.325   45.458   6.7200   38.895   11.710 6.563133 13.50081 
1 1 1   19    3   34 o   27.962   6.3009   17.316   10.116 -17.6485   20.723   28.255   11.592   20.539   9.6411   35.386   8.1151 -14.84753 12.60178 
1 1 1   19    3   35 o  111.331   3.9916  268.319   16.265  252.135   30.654  274.660   19.189  108.157   6.8718  114.506   4.0631 -6.348869 7.983104 
1 1 1   19    3   36 o   21.501   6.0507   6.3961   8.0400   6.1149   11.697   6.6479   11.069   21.555   8.6429   21.448   8.4701 0.1070690 12.10133 
1 1 1   19    3   37 o   42.996   5.4553   42.242   9.2576   31.349   13.270   52.571   12.922   36.661   8.8717   49.332   6.3508 -12.67056 10.91052 
1 1 1   19    3   38 o   80.296   3.7178  137.580   12.269  135.656   16.621  139.884   18.186   79.787   5.0508   80.804   5.4568 -1.016327 7.435523 
1 1 1   19    3   39 o   48.104   4.9602   51.980   9.4827   42.903   13.328   61.285   13.495   43.195   7.7668   53.014   6.1717 -9.819691 9.920307 
1 1 1   19    3   40 o   26.497   6.4879   15.628   8.9220   9.7936   12.764   21.203   12.476   23.311   9.1297   29.682   9.2206 -6.371372 12.97578 
1 1 1   19    3   41 o   30.065   8.0794   18.390   11.387   15.499   12.606   31.214   26.547   26.022   9.2926   34.109   13.220 -8.086895 16.15883 
1 1 1   19    3   42 o   50.712   8.4741   68.094   17.664   48.081   23.084   96.367   27.437   41.059   12.506   60.366   11.439 -19.30737 16.94816 
1 1 1   19    3   43 o   37.407   11.125   48.603   27.180   64.337   52.753   42.916   31.714   38.702   17.037   36.113   14.313 2.588520 22.25095 
1 1 1   19    3   44 o   25.492   8.6535 -10.9135   26.229 -58.9487   53.144   4.5559   30.158   24.825   12.417   26.159   12.056 -1.333771 17.30701 
1 1 1   19    4    0 o  379.850   3.0032  2979.04   66.521  2979.04   66.521  2979.04   66.521  379.850   4.2472  379.850   4.2472 0.000000 0.000000 
1 1 1   19    4    1 o  203.314   2.2141  853.192   18.567  857.091   26.337  849.340   26.178  203.775   3.1336  202.852   3.1289 0.9231567 4.428277 
1 1 1   19    4    2 o  254.206   2.3970  1334.03   25.131  1337.21   35.579  1330.87   35.504  254.508   3.3894  253.904   3.3903 0.6036377 4.793978 
1 1 1   19    4    3 o  420.275   3.2242  3649.66   55.887  3638.50   78.700  3661.01   79.377  419.630   4.5472  420.921   4.5723 -1.291199 6.448455 
1 1 1   19    4    4 o  284.326   2.7190  1670.42   31.603  1676.02   42.028  1663.12   47.939  284.903   3.5767  283.748   4.0963 1.154449 5.438016 
1 1 1   19    4    5 o  228.794   2.4744  1080.00   23.111  1074.78   30.544  1087.00   35.349  228.168   3.2457  229.421   3.7357 -1.253143 4.948731 
1 1 1   19    4    6 o  166.742   2.7187  577.144   18.460  593.726   24.446  555.146   28.158  169.566   3.4955  163.919   4.1649 5.646973 5.437344 
1 1 1   19    4    7 o  208.791   2.8527  904.094   24.248  923.519   32.022  877.983   37.127  211.462   3.6715  206.120   4.3672 5.342499 5.705446 
1 1 1   19    4    8 o  124.774   2.3193  322.489   11.797  314.277   17.993  328.680   15.623  123.365   3.5363  126.184   3.0019 -2.819283 4.638656 
1 1 1   19    4    9 o  172.169   2.3085  614.020   16.251  595.727   24.452  628.492   21.749  169.851   3.4904  174.488   3.0221 -4.637344 4.616939 
1 1 1   19    4   10 o  280.742   2.7120  1627.31   31.083  1632.67   47.499  1623.29   41.108  281.115   4.0967  280.369   3.5549 0.7450867 5.424044 
1 1 1   19    4   11 o  263.466   2.6345  1431.07   28.289  1450.73   43.619  1416.80   37.166  264.995   3.9909  261.938   3.4402 3.057098 5.268951 
1 1 1   19    4   12 o  388.753   3.0630  3123.69   49.111  3126.95   69.571  3120.46   69.337  388.954   4.3367  388.552   4.3267 0.4022827 6.125957 
1 1 1   19    4   13 o  182.988   2.5683  691.734   19.383  695.679   27.377  687.770   27.446  183.513   3.6170  182.464   3.6470 1.048615 5.136507 
1 1 1   19    4   14 o  174.236   2.7182  620.937   18.077  643.944   32.721  610.831   21.686  176.473   4.4956  171.999   3.0570 4.474167 5.436481 
1 1 1   19    4   15 o  132.715   2.6632  361.606   13.558  370.250   24.241  357.671   16.356  133.816   4.3922  131.615   3.0130 2.200958 5.326312 
1 1 1   19    4   16 o  132.354   2.7378  354.104   14.733  317.513   18.983  409.517   23.361  123.957   3.7131  140.750   4.0242 -16.79331 5.475514 
1 1 1   19    4   17 o  222.695   2.7992  1025.71   25.692  1043.71   35.857  1006.73   36.830  224.714   3.8689  220.675   4.0466 4.039825 5.598476 
1 1 1   19    4   18 o   72.894   3.5976  109.664   10.798  102.484   14.808  117.821   15.782   70.352   5.1031   75.435   5.0724 -5.082512 7.195214 
1 1 1   19    4   19 f  157.648   2.6137  514.201   16.828  509.764   25.597  517.579   22.333  157.024   3.9524  158.273   3.4211 -1.249359 5.227345 
1 1 1   19    4   20 o   41.599   5.0670   38.060   8.1215   20.865   11.340   56.168   11.637   31.136   8.5632   52.062   5.4194 -20.92567 10.13400 
1 1 1   19    4   21 o   84.060   3.0391  146.076   10.528  138.035   14.677  154.599   15.110   81.675   4.3569   86.445   4.2380 -4.769676 6.078118 
1 1 1   19    4   22 o   39.366   5.2133   33.294   8.1870   42.106   11.640   24.666   11.518   45.022   6.2683   33.709   8.3319 11.31232 10.42652 
1 1 1   19    4   23 o  127.150   3.4696  337.672   16.545  341.440   19.724  328.730   30.389  128.490   3.7220  125.810   5.8565 2.679207 6.939127 
1 1 1   19    4   24 o  133.301   2.6838  368.526   14.710  354.732   21.411  380.860   20.246  130.912   3.9654  135.689   3.6176 -4.777679 5.367625 
1 1 1   19    4   25 o  143.545   3.4724  423.742   20.375  456.244   31.383  400.058   26.789  148.216   5.1337  138.873   4.6771 9.342773 6.944752 
1 1 1   19    4   26 o  110.431   3.0229  253.310   13.658  249.010   20.568  256.702   18.266  109.551   4.5520  111.310   3.9788 -1.759102 6.045743 
1 1 1   19    4   27 o  179.397   3.5077  670.445   25.916  698.409   36.233  641.153   37.083  183.284   4.7930  175.510   5.1228 7.774445 7.015436 
1 1 1   19    4   28 o  193.562   2.6852  777.568   21.364  775.818   31.516  779.056   29.060  193.311   3.9528  193.814   3.6353 -0.5028076 5.370303 
1 1 1   19    4   29 o   86.825   3.1755  157.095   11.362  155.481   16.350  158.603   15.802   86.374   4.5895   87.276   4.3898 -0.9018478 6.350930 
1 1 1   19    4   30 o  133.882   5.1827  380.873   28.484  333.645   39.514  431.964   41.098  125.062   7.6606  142.702   6.9827 -17.64087 10.36548 
1 1 1   19    4   31 o   68.426   3.5394   98.029   9.9874   99.479   14.084   96.563   14.165   68.946   4.9529   67.907   5.0574 1.039169 7.078766 
1 1 1   19    4   32 o  112.859   2.8998  266.204   13.487  264.076   19.418  268.188   18.747  112.391   4.1890  113.327   4.0109 -0.9355164 5.799583 
1 1 1   19    4   33 o   93.617   4.4108  192.939   14.773  200.252   17.287  173.143   28.443   97.795   4.2859   89.438   7.7104 8.356972 8.821544 
1 1 1   19    4   34 f   49.844   4.4841   52.969   9.2167   51.924   12.893   54.061   13.181   49.343   6.3350   50.345   6.3478 -1.001858 8.968111 
1 1 1   19    4   35 o   77.542   3.5070  127.029   11.212  126.235   16.031  127.790   15.688   77.278   5.0297   77.805   4.8888 -0.5268784 7.014082 
1 1 1   19    4   36 o   42.450   5.8718   40.764   10.024   37.184   14.739   43.845   13.672   40.058   9.1248   44.842   7.3925 -4.784401 11.74359 
1 1 1   19    4   37 o   98.418   4.4854  209.319   18.205  205.266   25.692  213.407   25.800   97.426   6.3937   99.411   6.2925 -1.985634 8.970823 
1 1 1   19    4   38 o   31.634   6.1798   23.147   8.5950   31.404   12.478   15.692   11.856   36.678   8.4258   26.589   9.0425 10.08834 12.35963 
1 1 1   19    4   39 o   40.143   5.7274   37.578   9.2784   44.500   12.929   30.226   13.324   44.812   6.9951   35.474   9.0709 9.337849 11.45478 
1 1 1   19    4   40 o   32.468   7.6815   20.003   11.050   12.063   12.718   44.456   22.318   24.391   9.2252   40.546   12.285 -16.15524 15.36292 
1 1 1   19    4   41 o   38.103   7.4699   39.939   11.696   43.079   13.008   26.684   26.723   43.581   7.2366   32.625   13.070 10.95631 14.93970 
1 1 1   19    4   42 o   23.977   7.6799  -2.0495   16.267 -10.8490   21.464   9.8257   24.935   20.971   9.8337   26.983   11.799 -6.012314 15.35979 
1 1 1   19    4   43 o   29.839   9.6469   14.720   26.429 -13.2785   52.742   24.108   30.540   28.767   13.988   30.911   13.289 -2.144352 19.29387 
1 1 1   19    4   44 o   41.175   11.686   49.420   27.291  146.777   55.697   18.661   31.306   53.313   19.466   29.037   12.935 24.27567 23.37138 
1 1 1   19    5    0 o  178.347   2.1566  656.817   22.419  656.817   22.419  656.817   22.419  178.347   3.0498  178.347   3.0498 0.000000 0.000000 
1 1 1   19    5    1 o  128.868   2.1222  342.685   11.276  354.167   16.080  331.573   15.818  130.992   2.9762  126.744   3.0260 4.248947 4.244336 
1 1 1   19    5    2 o  353.213   2.8613  2577.03   41.684  2574.21   58.902  2579.86   58.998  353.020   4.0454  353.407   4.0476 -0.3868713 5.722603 
1 1 1   19    5    3 o  432.298   3.5542  3861.61   62.660  3848.71   82.590  3879.11   96.183  431.530   4.6404  433.066   5.3849 -1.535919 7.108468 
1 1 1   19    5    4 o  187.772   2.3318  728.838   17.910  735.092   23.903  720.831   27.045  188.706   3.0712  186.838   3.5096 1.867920 4.663637 
1 1 1   19    5    5 o  194.177   2.3608  774.517   18.662  754.705   24.361  802.664   29.036  191.203   3.0891  197.150   3.5708 -5.947250 4.721579 
1 1 1   19    5    6 o  266.184   3.1383  1464.09   33.811  1463.08   43.789  1465.59   53.210  266.125   3.9894  266.243   4.8456 -0.1177063 6.276567 
1 1 1   19    5    7 o  243.295   2.7253  1222.51   27.345  1234.75   38.984  1210.65   38.366  244.493   3.8660  242.097   3.8423 2.396042 5.450564 
1 1 1   19    5    8 o  221.421   2.4669  1009.37   22.228  1030.63   34.523  994.325   29.051  223.383   3.7471  219.458   3.2095 3.924500 4.933744 
1 1 1   19    5    9 o  358.043   3.1313  2643.93   45.612  2681.84   70.800  2617.04   59.638  360.172   4.7660  355.915   4.0627 4.257813 6.262589 
1 1 1   19    5   10 o  199.394   2.3696  823.262   19.369  798.014   28.785  844.150   26.182  196.578   3.5503  202.211   3.1393 -5.633408 4.739229 
1 1 1   19    5   11 o  231.731   2.4944  1108.49   23.623  1112.81   35.953  1105.21   31.336  232.105   3.7557  231.357   3.2839 0.7488708 4.988881 
1 1 1   19    5   12 o  294.979   2.8017  1795.42   33.670  1781.74   44.215  1814.29   51.949  293.689   3.6502  296.270   4.2513 -2.580780 5.603333 
1 1 1   19    5   13 o  425.365   3.5336  3744.55   61.403  3750.54   81.452  3736.66   93.454  425.856   4.6374  424.873   5.3330 0.9830933 7.067271 
1 1 1   19    5   14 o  147.393   3.3150  444.616   16.280  457.348   36.157  441.378   18.233  148.577   5.9004  146.209   3.0235 2.368164 6.629939 
1 1 1   19    5   15 o   66.930   3.1581   91.600   8.2089   95.721   14.402   89.617   9.9909   68.002   5.1348   65.858   3.6781 2.144020 6.316230 
1 1 1   19    5   16 o  191.717   2.6086  759.477   20.626  764.460   29.356  754.618   28.986  192.337   3.7006  191.098   3.6776 1.239700 5.217245 
1 1 1   19    5   17 o  148.970   2.4891  458.323   15.255  461.181   22.421  455.860   20.814  149.393   3.6389  148.548   3.3973 0.8452454 4.978249 
1 1 1   19    5   18 o   28.635   5.9805   15.594   7.9230   7.7057   10.391   26.549   12.246   22.280   8.3577   34.989   8.5567 -12.70983 11.96108 
1 1 1   19    5   19 o   43.654   4.7383   40.963   8.1155   49.981   11.325   31.445   11.635   49.105   5.5918   38.202   7.6511 10.90288 9.476686 
1 1 1   19    5   20 o  194.834   2.6861  784.737   21.584  785.834   30.672  783.661   30.378  194.967   3.8143  194.701   3.7829 0.2658844 5.372127 
1 1 1   19    5   21 o  127.710   3.4691  337.517   18.187  340.918   27.124  334.738   24.515  128.268   5.1270  127.152   4.6746 1.116753 6.938117 
1 1 1   19    5   22 o  115.315   2.7058  274.755   12.860  260.559   17.928  289.802   18.457  112.245   3.8726  118.384   3.7800 -6.139229 5.411659 
1 1 1   19    5   23 o  260.336   3.4571  1407.98   35.784  1416.72   45.059  1393.07   58.880  261.612   4.1760  259.059   5.5107 2.552643 6.914246 
1 1 1   19    5   24 o   83.114   3.1811  143.584   10.872  134.546   15.640  152.037   15.124   80.556   4.7072   85.672   4.2803 -5.116272 6.362269 
1 1 1   19    5   25 o  209.251   2.9899  906.558   25.601  914.686   38.792  900.286   34.075  210.018   4.4784  208.484   3.9627 1.533691 5.979897 
1 1 1   19    5   26 o   84.499   5.0526  151.253   17.379  134.909   25.811  164.808   23.506   80.150   7.8081   88.848   6.4147 -8.698219 10.10514 
1 1 1   19    5   27 o  167.293   3.7575  600.045   23.320  543.972   42.736  623.820   27.828  161.156   6.4296  173.429   3.8904 -12.27219 7.515007 
1 1 1   19    5   28 o  124.070   3.2918  331.216   16.031  281.159   25.910  362.263   20.406  116.011   5.4151  132.128   3.7445 -16.11751 6.583622 
1 1 1   19    5   29 o   94.268   3.0320  185.006   11.785  185.959   16.898  184.104   16.444   94.495   4.3357   94.042   4.2396 0.4524536 6.064007 
1 1 1   19    5   30 o   41.468   5.4886   36.916   9.1591   31.415   12.323   43.707   13.691   37.616   8.1762   45.320   7.3245 -7.703518 10.97713 
1 1 1   19    5   31 o   87.028   3.1527  158.141   11.310  157.971   15.719  158.323   16.284   86.998   4.3807   87.058   4.5352 -0.5952454E-01 6.305460 
1 1 1   19    5   32 o  105.492   3.6542  237.508   15.004  224.610   25.490  244.347   18.560  102.882   6.0070  108.102   4.1628 -5.219917 7.308458 
1 1 1   19    5   33 o  110.777   3.0535  257.492   13.876  261.570   18.764  252.572   20.612  111.843   4.0677  109.711   4.5553 2.132652 6.107069 
1 1 1   19    5   34 o   31.689   6.0403   22.358   8.1858   28.836   12.075   16.849   11.135   35.687   8.3520   27.692   8.7284 7.994923 12.08062 
1 1 1   19    5   35 o   50.978   6.2881   59.858   11.323   55.993   21.550   61.332   13.308   48.402   11.039   53.554   6.0248 -5.151325 12.57625 
1 1 1   19    5   36 o   57.640   4.5701   72.953   10.507   65.219   16.570   78.154   13.588   54.674   7.3481   60.607   5.4358 -5.933601 9.140111 
1 1 1   19    5   37 o   50.082   5.3059   58.962   9.8948   34.853   14.313   81.031   13.694   38.543   9.1420   61.621   5.3882 -23.07825 10.61173 
1 1 1   19    5   38 o   16.721   5.1823  -7.4780   7.9133 -24.3964   11.773   6.4672   10.688   12.569   6.2110   20.872   8.2975 -8.302734 10.36460 
1 1 1   19    5   39 o   24.419   6.3781   12.080   8.4808   10.388   11.508   14.090   12.546   23.228   8.7780   25.610   9.2556 -2.381935 12.75616 
1 1 1   19    5   40 o   42.541   7.2082   54.259   12.427   63.001   14.049   22.831   26.638   53.360   6.3837   31.721   12.926 21.63912 14.41638 
1 1 1   19    5   41 o   22.610   7.1662   1.0234   11.070  -0.2224   12.310   6.2888   25.308   18.668   8.2233   26.552   11.739 -7.884291 14.33239 
1 1 1   19    5   42 o   45.903   8.7100   60.511   17.074   68.544   23.303   51.199   25.088   50.357   11.476   41.449   13.106 8.908070 17.41991 
1 1 1   19    5   43 o   26.924   8.8988  -0.9993   25.134 -53.8100   51.828   15.240   28.740   25.339   12.608   28.509   12.561 -3.170444 17.79753 
1 1 1   19    5   44 o   24.543   11.471 -40.6591   25.070 -163.8526   50.975  -1.3557   28.792  ?   ?    24.543   11.471      ?      ? 
1 1 1   19    5   45 o   40.850   14.682   64.866   31.516   0.0000   0.0000   64.866   31.516  ?   ?    40.850   14.682      ?      ? 
1 1 1   19    6    0 o  275.107   2.4833  1562.55   39.834  1562.55   39.834  1562.55   39.834  275.107   3.5119  275.107   3.5119 0.000000 0.000000 
1 1 1   19    6    1 o  315.130   2.6703  2050.95   34.706  2040.94   48.816  2061.19   49.352  314.353   3.7651  315.906   3.7877 -1.552795 5.340662 
1 1 1   19    6    2 o  324.426   2.7179  2172.67   36.346  2138.02   50.383  2210.26   52.482  321.737   3.7968  327.115   3.8900 -5.377625 5.435766 
1 1 1   19    6    3 o  413.739   3.4401  3539.28   58.127  3539.65   77.006  3538.79   88.621  413.839   4.5115  413.639   5.1945 0.1992493 6.880208 
1 1 1   19    6    4 o  233.582   2.4883  1127.39   23.757  1131.93   31.587  1121.48   36.049  234.146   3.2708  233.019   3.7509 1.126541 4.976694 
1 1 1   19    6    5 o  226.606   2.7872  1060.47   24.666  1059.85   30.341  1061.68   42.356  226.570   3.2468  226.641   4.5311 -0.7151794E-01 5.574329 
1 1 1   19    6    6 o  150.131   2.4471  464.652   15.139  446.702   20.888  484.518   21.974  147.082   3.4432  153.179   3.4781 -6.097183 4.894152 
1 1 1   19    6    7 o  175.675   2.4790  637.288   17.962  636.678   25.367  637.901   25.437  175.591   3.5028  175.759   3.5090 -0.1682281 4.958073 
1 1 1   19    6    8 o   53.415   3.4985   59.173   7.6568   51.000   10.756   67.571   10.902   49.655   5.2519   57.175   4.6233 -7.519867 6.996917 
1 1 1   19    6    9 o  227.173   2.3160  1065.46   21.699  1057.76   30.525  1073.33   30.852  226.344   3.2698  228.003   3.2807 -1.658600 4.631967 
1 1 1   19    6   10 o  129.038   2.2734  342.597   11.985  352.194   18.363  335.474   15.819  130.597   3.4091  127.478   3.0086 3.118805 4.546839 
1 1 1   19    6   11 o  217.992   2.4400  980.895   21.741  985.457   33.073  977.423   28.850  218.417   3.6713  217.567   3.2151 0.8495483 4.880085 
1 1 1   19    6   12 o   55.815   2.9209   64.391   6.7230   64.598   9.4388   64.178   9.5783   55.906   4.0934   55.723   4.1677 0.1838875 5.841706 
1 1 1   19    6   13 o  239.944   2.5427  1189.90   24.936  1184.91   37.857  1193.73   33.141  239.472   3.8329  240.417   3.3423 -0.9451141 5.085425 
1 1 1   19    6   14 o  186.219   2.7083  708.193   19.366  739.437   34.720  694.082   23.333  189.100   4.4517  183.339   3.0857 5.761780 5.416538 
1 1 1   19    6   15 o  314.723   2.9130  2052.44   37.555  2005.45   56.142  2090.48   50.522  311.406   4.3712  318.039   3.8516 -6.633057 5.825950 
1 1 1   19    6   16 o   50.129   3.8833   51.924   8.0186   55.207   11.682   49.000   11.026   51.623   5.4868   48.634   5.4968 2.989304 7.766591 
1 1 1   19    6   17 o  156.996   2.8794  503.681   17.560  527.093   30.805  492.411   21.372  159.602   4.6797  154.389   3.3563 5.213043 5.758824 
1 1 1   19    6   18 f  173.594   2.6519  619.888   18.692  606.491   24.258  639.464   29.325  171.329   3.4329  175.859   4.0430 -4.530655 5.303841 
1 1 1   19    6   19 o  138.362   2.8209  400.184   15.682  416.794   20.266  375.391   24.759  142.025   3.4596  134.699   4.4566 7.326218 5.641853 
1 1 1   19    6   20 o  283.607   3.0043  1663.50   35.134  1642.27   49.062  1685.85   50.337  281.756   4.2219  285.459   4.2754 -3.702393 6.008609 
1 1 1   19    6   21 o   70.933   3.2701  104.086   9.5620   99.658   13.331  108.779   13.723   69.378   4.6588   72.487   4.5901 -3.109291 6.540143 
1 1 1   19    6   22 o  243.890   3.2639  1230.26   30.492  1227.59   36.820  1236.07   54.397  243.660   3.6638  244.120   5.4027 -0.4605103 6.527803 
1 1 1   19    6   23 o  156.059   3.0365  510.268   19.286  553.280   25.998  457.631   28.760  163.521   3.8548  148.597   4.6926 14.92473 6.072904 
1 1 1   19    6   24 o  178.163   2.5304  656.243   18.587  636.570   25.879  677.205   26.714  175.408   3.5771  180.919   3.5800 -5.511353 5.060873 
1 1 1   19    6   25 o   90.794   3.6804  175.328   13.091  157.736   21.662  185.450   16.431   87.001   6.0367   94.588   4.2116 -7.587196 7.360711 
1 1 1   19    6   26 o  180.329   4.9891  675.890   37.107   0.0000   0.0000  675.890   37.107  ?   ?   180.329   4.9891      ?      ? 
1 1 1   19    6   27 o  120.232   3.5286  302.952   17.383  323.874   23.835  279.179   25.407  124.777   4.6315  115.687   5.3249 9.089897 7.057264 
1 1 1   19    6   28 o  128.872   2.6930  344.814   14.314  343.963   20.304  345.655   20.182  128.711   3.8247  129.034   3.7922 -0.3235626 5.385957 
1 1 1   19    6   29 o   51.549   4.3910   55.977   9.3330   55.425   13.319   56.510   13.082   51.284   6.2968   51.814   6.1216 -0.5298882 8.781996 
1 1 1   19    6   30 o   54.254   4.5017   63.094   9.8974   69.144   13.273   55.517   14.854   57.371   5.6095   51.138   7.0424 6.233055 9.003452 
1 1 1   19    6   31 o  121.174   2.7700  305.981   13.844  307.172   19.598  304.795   19.558  121.410   3.9137  120.937   3.9209 0.4729919 5.539942 
1 1 1   19    6   32 f  120.771   3.7409  303.410   16.664  298.263   19.533  317.177   31.943  119.504   3.9630  122.039   6.3461 -2.535301 7.481856 
1 1 1   19    6   33 o   61.475   3.8800   79.946   9.8242   85.430   14.001   74.626   13.789   63.594   5.3378   59.357   5.6325 4.237289 7.759954 
1 1 1   19    6   34 o   38.563   5.5207   32.859   8.6221   41.428   12.508   25.100   11.902   43.914   6.9057   33.212   8.6153 10.70129 11.04142 
1 1 1   19    6   35 o   35.860   7.3552   30.592   10.550   26.425   22.282   31.796   11.978   34.298   12.343   37.423   8.0025 -3.125214 14.71041 
1 1 1   19    6   36 o   65.001   4.0105   87.747   10.601  107.953   16.715   74.150   13.711   71.075   5.7018   58.927   5.6414 12.14803 8.021015 
1 1 1   19    6   37 o   53.548   4.4684   61.893   9.7538   74.868   14.192   50.278   13.428   59.045   5.8276   48.052   6.7752 10.99290 8.936721 
1 1 1   19    6   38 o   48.671   4.7346   52.093   9.4513   51.070   14.023   52.944   12.794   48.061   7.0745   49.282   6.2942 -1.220776 9.469186 
1 1 1   19    6   39 o   50.837   5.2439   59.770   10.335   73.759   14.334   44.622   14.915   58.192   5.9721   43.482   8.6213 14.70994 10.48775 
1 1 1   19    6   40 o   76.738   5.6593  145.067   14.534  154.706   16.790  116.252   29.030   84.813   4.7997   68.663   10.251 16.14987 11.31869 
1 1 1   19    6   41 o   23.949   7.3695   3.3041   11.039  -0.0408   12.339   16.716   24.709   18.739   8.2445   29.160   12.218 -10.42123 14.73902 
1 1 1   19    6   42 f   19.679   6.7194 -24.1248   16.677 -13.7064   22.375 -37.1458   25.015   20.725   9.8165   18.633   9.1780 2.091343 13.43873 
1 1 1   19    6   43 o   29.914   9.1250   16.115   21.276   40.781   31.690  -4.1257   28.707   35.280   14.198   24.549   11.467 10.73030 18.25005 
1 1 1   19    6   44 o   28.025   8.7838   5.6057   25.307 -100.7341   50.716   40.860   29.202   21.678   10.998   34.371   13.699 -12.69202 17.56751 
1 1 1   19    6   45 o   37.237   14.362   53.986   31.215   0.0000   0.0000   53.986   31.215  ?   ?    37.237   14.362      ?      ? 
1 1 1   19    7    0 o  161.026   2.1242  535.548   19.936  535.548   19.936  535.548   19.936  161.026   3.0041  161.026   3.0041 0.000000 0.000000 
1 1 1   19    7    1 f  132.760   2.1232  363.846   11.625  366.470   16.409  361.202   16.473  133.241   2.9859  132.279   3.0194 0.9626923 4.246439 
1 1 1   19    7    2 o   91.256   2.4240  172.919   9.0386  180.002   12.136  164.096   13.545   93.376   3.1512   89.137   3.6842 4.238777 4.848038 
1 1 1   19    7    3 o   78.519   2.8863  127.054   8.8931  126.343   10.983  128.409   15.155   78.222   3.4042   78.816   4.6621 -0.5933762 5.772690 
1 1 1   19    7    4 o  127.315   2.5717  338.548   12.825  347.346   15.939  322.390   21.601  129.719   2.9791  124.912   4.1927 4.806137 5.143360 
1 1 1   19    7    5 o   94.208   3.0688  183.442   11.921  186.330   16.777  180.496   16.942   94.960   4.2837   93.456   4.3954 1.503456 6.137577 
1 1 1   19    7    6 o  133.227   2.6980  368.227   14.585  357.306   22.582  376.044   19.105  131.505   4.1634  134.950   3.4325 -3.445145 5.395914 
1 1 1   19    7    7 o   90.076   2.6157  167.523   9.7157  172.278   13.864  162.933   13.619   91.332   3.6804   88.820   3.7178 2.512787 5.231359 
1 1 1   19    7    8 o  132.432   2.2990  363.068   12.417  355.433   18.930  368.833   16.450  131.195   3.4984  133.670   2.9839 -2.474915 4.598077 
1 1 1   19    7    9 o  106.008   2.2082  232.047   9.6528  227.351   13.675  236.710   13.627  104.937   3.1597  107.078   3.0856 -2.140862 4.416373 
1 1 1   19    7   10 o  189.556   2.3511  742.605   18.232  737.263   27.544  746.771   24.324  188.932   3.5347  190.181   3.1010 -1.248459 4.702123 
1 1 1   19    7   11 o   67.864   2.8749   95.093   8.0429   98.112   11.597   92.295   11.164   68.900   4.0810   66.827   4.0504 2.072624 5.749824 
1 1 1   19    7   12 o  191.051   2.6698  760.487   20.011  733.218   33.706  775.330   24.868  188.326   4.3394  193.775   3.1115 -5.449387 5.339666 
1 1 1   19    7   13 o   46.249   6.5466   60.092   8.7736   24.284   22.494   66.516   9.5282   35.769   12.444   56.730   4.0723 -20.96059 13.09324 
1 1 1   19    7   14 o   55.726   3.6292   64.308   8.3257   63.899   12.130   64.671   11.448   55.552   5.2941   55.900   4.9655 -0.3484268 7.258348 
1 1 1   19    7   15 o  289.523   2.6874  1731.52   31.151  1736.01   50.564  1728.77   39.547  289.750   4.2311  289.296   3.3144 0.4542236 5.374711 
1 1 1   19    7   16 o  110.126   2.6154  250.657   11.848  250.153   17.393  251.092   16.183  110.014   3.8332  110.237   3.5592 -0.2233124 5.230807 
1 1 1   19    7   17 o  323.021   3.0055  2159.15   39.788  2147.53   59.643  2168.46   53.409  322.184   4.4884  323.858   3.9985 -1.673767 6.011085 
1 1 1   19    7   18 f  259.285   2.8048  1390.97   29.653  1396.69   39.141  1383.27   45.431  259.961   3.6505  258.608   4.2593 1.353302 5.609646 
1 1 1   19    7   19 o   55.824   7.2151   82.865   14.366  107.499   17.499   31.925   25.163   71.988   5.8936   39.660   13.172 32.32801 14.43013 
1 1 1   19    7   20 o   74.285   3.0792  113.988   9.4110  103.239   13.036  125.688   13.600   70.626   4.4752   77.943   4.2306 -7.316223 6.158375 
1 1 1   19    7   21 o  119.028   2.5808  292.884   12.669  291.014   17.826  294.793   18.010  118.645   3.6429  119.411   3.6567 -0.7668076 5.161623 
1 1 1   19    7   22 o  283.487   3.5467  1667.90   39.987  1672.98   50.334  1659.19   65.841  284.274   4.2930  282.700   5.6468 1.573303 7.093372 
1 1 1   19    7   23 o  189.470   2.5222  742.558   19.709  750.721   27.905  734.432   27.842  190.511   3.5514  188.428   3.5825 2.083237 5.044462 
1 1 1   19    7   24 o   67.575   3.5979   95.172   9.9611   82.289   14.036  108.243   14.138   62.920   5.4088   72.229   4.7459 -9.308521 7.195737 
1 1 1   19    7   25 o   81.559   3.8761  137.355   12.262  141.445   21.479  135.377   14.935   82.334   6.3250   80.783   4.4824 1.550766 7.752270 
1 1 1   19    7   26 o  148.272   3.0731  456.597   18.420  455.206   29.061  457.532   23.814  147.986   4.7614  148.559   3.8866 -0.5729828 6.146274 
1 1 1   19    7   27 o  127.543   4.3954  365.594   20.930  412.468   25.821  275.799   35.738  140.833   4.4453  114.253   7.5841 26.58059 8.790862 
1 1 1   19    7   28 o  124.611   2.7217  322.642   13.973  303.525   19.657  342.169   19.866  120.856   3.9435  128.365   3.7524 -7.509285 5.443444 
1 1 1   19    7   29 o   73.829   3.4604  114.332   10.501  106.393   15.093  121.783   14.621   71.285   5.1334   76.372   4.6418 -5.086639 6.920789 
1 1 1   19    7   30 o   84.714   3.2149  149.948   11.222  144.691   16.016  155.018   15.729   83.227   4.6659   86.202   4.4240 -2.974289 6.429814 
1 1 1   19    7   31 o   21.291   6.0124   4.5524   8.1378  -0.2093   11.031   10.239   12.054   18.467   7.9627   24.115   9.0105 -5.648205 12.02473 
1 1 1   19    7   32 o   95.076   4.2011  187.969   14.438  183.868   16.715  200.020   28.655   93.706   4.3250   96.446   7.2035 -2.740227 8.402154 
1 1 1   19    7   33 o   37.562   5.5888   32.302   8.5472   21.390   12.473   41.962   11.736   30.790   9.1515   44.334   6.4180 -13.54457 11.17767 
1 1 1   19    7   34 o   63.598   3.7140   85.707   9.7105   77.818   13.715   93.637   13.751   60.585   5.4885   66.612   5.0051 -6.026276 7.427963 
1 1 1   19    7   35 o   61.924   7.7888   95.495   13.525   81.298   34.211   98.124   14.724   55.831   14.667   68.017   5.2486 -12.18570 15.57758 
1 1 1   19    7   36 o   19.363   5.7284   2.7900   7.6747   1.7372   11.054   3.7698   10.664   19.044   8.0853   19.682   8.1171 -0.6379242 11.45682 
1 1 1   19    7   37 o   32.736   6.3143   25.132   8.7550   25.497   12.668   24.799   12.114   32.928   9.0485   32.543   8.8093 0.3843613 12.62854 
1 1 1   19    7   38 o   62.457   4.0452   83.897   10.393   91.931   15.342   77.084   14.128   65.214   5.7037   59.700   5.7379 5.514389 8.090480 
1 1 1   19    7   39 o   59.717   6.5224   92.901   13.135  105.372   15.720   64.046   23.911   69.817   5.4590   49.617   11.848 20.19964 13.04486 
1 1 1   19    7   40 o   29.982   7.8715   21.566   11.776   22.758   13.109   16.585   26.805   30.329   9.4566   29.635   12.586 0.6938133 15.74308 
1 1 1   19    7   41 o   28.440   7.9528   14.068   11.080   10.491   12.217   30.661   26.312   23.167   8.9708   33.713   13.134 -10.54630 15.90557 
1 1 1   19    7   42 o   30.117   7.2595   24.932   13.400   36.754   15.110 -18.6169   29.000   37.660   9.6759   22.574   10.825 15.08596 14.51902 
1 1 1   19    7   43 o   28.543   9.0154   14.879   21.662   12.887   32.015   16.561   29.418   28.370   12.822   28.716   12.677 -0.3454781 18.03078 
1 1 1   19    7   44 o   26.792   8.9037   4.0857   25.870 -42.7984   52.506   19.116   29.729   25.161   12.547   28.422   12.636 -3.260748 17.80749 
1 1 1   19    8    0 o  140.752   2.9939  410.057   24.529  410.057   24.529  410.057   24.529  140.752   4.2340  140.752   4.2340 0.000000 0.000000 
1 1 1   19    8    1 o  379.848   3.8754  2990.40   59.650  2957.09   93.242  3013.48   77.609  377.935   5.9818  381.760   4.9290 -3.824646 7.750888 
1 1 1   19    8    2 o   40.430   3.7711   33.625   6.2606   29.494   8.5388   38.427   9.2066   37.756   5.4834   43.104   5.1786 -5.348106 7.542274 
1 1 1   19    8    3 o   94.551   2.3757  183.094   9.2017  172.612   12.193  196.964   14.025   91.437   3.2331   97.665   3.4818 -6.228134 4.751413 
1 1 1   19    8    4 o  212.524   2.5999  925.916   22.671  998.992   34.244  868.891   30.250  219.926   3.7752  205.122   3.5756 14.80370 5.199702 
1 1 1   19    8    5 o  260.203   2.7976  1398.07   30.014  1378.20   41.803  1419.22   43.120  258.299   3.9239  262.108   3.9887 -3.808563 5.595260 
1 1 1   19    8    6 o  107.206   2.4922  237.344   11.018  242.733   15.618  232.004   15.546  108.419   3.4925  105.993   3.5562 2.425812 4.984418 
1 1 1   19    8    7 o   70.486   2.9365  102.720   8.5312   98.976   12.115  106.403   12.016   69.208   4.2441   71.764   4.0596 -2.555847 5.873044 
1 1 1   19    8    8 o  200.664   2.3889  830.411   19.543  838.627   30.076  824.407   25.710  201.502   3.6189  199.826   3.1194 1.675888 4.777812 
1 1 1   19    8    9 o  128.671   2.2915  341.204   12.028  346.372   18.490  337.414   15.836  129.502   3.4618  127.840   3.0034 1.661606 4.583078 
1 1 1   19    8   10 o  129.728   2.3291  346.941   12.304  343.744   16.131  351.388   19.027  129.029   3.0312  130.427   3.5371 -1.398361 4.658178 
1 1 1   19    8   11 f  136.650   2.2762  386.501   12.751  376.991   18.981  394.324   17.214  135.103   3.4063  138.197   3.0201 -3.093491 4.552308 
1 1 1   19    8   12 o  151.553   2.5351  478.497   15.182  460.173   25.156  488.994   19.040  149.212   4.0876  153.894   2.9997 -4.681549 5.070202 
1 1 1   19    8   13 o  141.618   2.7533  409.850   15.517  431.886   25.867  397.463   19.393  144.521   4.3396  138.715   3.3897 5.806076 5.506587 
1 1 1   19    8   14 o  258.687   2.6445  1381.40   27.847  1392.30   43.075  1373.57   36.501  259.520   4.0242  257.854   3.4321 1.665985 5.289052 
1 1 1   19    8   15 o  100.503   2.4469  209.648   9.8569  204.499   15.841  212.902   12.591   99.469   3.8613  101.537   3.0066 -2.068222 4.893834 
1 1 1   19    8   16 o  169.086   2.4754  590.008   17.188  598.313   25.609  583.201   23.186  170.153   3.6491  168.019   3.3458 2.134537 4.950793 
1 1 1   19    8   17 o  191.366   2.5196  757.531   19.815  747.369   29.184  766.223   26.991  190.156   3.7210  192.576   3.3982 -2.419662 5.039265 
1 1 1   19    8   18 o   91.057   3.2037  168.461   11.733  158.439   14.830  185.231   19.183   87.530   4.1079   94.584   4.9174 -7.054634 6.407444 
1 1 1   19    8   19 o   92.924   3.0398  175.729   11.485  162.479   14.828  195.600   18.158   88.634   4.0561   97.214   4.5287 -8.580429 6.079509 
1 1 1   19    8   20 o  111.951   3.0663  262.066   13.698  270.721   17.464  248.230   22.081  114.431   3.7003  109.472   4.8906 4.959610 6.132676 
1 1 1   19    8   21 o  158.394   2.8911  521.016   18.708  534.140   24.981  504.257   28.229  160.713   3.7688  156.075   4.3852 4.637589 5.782205 
1 1 1   19    8   22 o  161.108   2.9386  540.809   19.366  570.895   26.239  504.805   28.704  166.109   3.8298  156.107   4.4581 10.00179 5.877244 
1 1 1   19    8   23 o  171.651   2.9320  614.290   20.597  652.533   28.023  569.361   30.374  177.555   3.8267  165.748   4.4432 11.80730 5.863910 
1 1 1   19    8   24 o  145.919   2.5799  440.581   15.524  430.743   21.696  450.900   22.220  144.251   3.6467  147.587   3.6504 -3.335999 5.159833 
1 1 1   19    8   25 o   83.626   3.8053  146.483   12.415  142.437   21.187  148.599   15.320   82.617   6.2178   84.636   4.3888 -2.018814 7.610694 
1 1 1   19    8   26 o  206.766   2.9016  886.641   24.609  895.169   36.857  879.782   33.057  207.594   4.3047  205.938   3.8919 1.656464 5.803205 
1 1 1   19    8   27 o   66.837   3.7494   92.486   10.262   99.807   15.672   86.991   13.578   69.101   5.4991   64.573   5.0983 4.527992 7.498793 
1 1 1   19    8   28 o   74.645   3.3559  116.273   10.332  116.808   14.671  115.746   14.552   74.814   4.7545   74.476   4.7375 0.3378677 6.711897 
1 1 1   19    8   29 o   44.771   4.9345   42.992   8.8319   50.622   12.835   36.131   12.172   48.960   6.3561   40.582   7.5497 8.378265 9.869098 
1 1 1   19    8   30 o   29.044   5.0759   15.431   8.1406  -6.5719   11.698   36.093   11.336   16.824   7.6612   41.264   6.6606 -24.43980 10.15175 
1 1 1   19    8   31 o   98.841   3.2168  204.768   12.961  204.528   17.079  205.095   19.902   98.896   4.1872   98.786   4.8846 0.1095810 6.433656 
1 1 1   19    8   32 o   19.136   6.3052  -7.9400   9.6448  -7.2698   10.772 -10.6494   21.657   15.686   7.2208   22.587   10.338 -6.900268 12.61035 
1 1 1   19    8   33 o   73.040   3.5130  112.272   10.536   98.712   14.652  126.790   15.160   68.405   5.1932   77.674   4.7322 -9.268814 7.025918 
1 1 1   19    8   34 o   28.528   6.2971   18.165   8.2061   19.682   12.046   16.852   11.209   29.495   9.0436   27.560   8.7651 1.934988 12.59418 
1 1 1   19    8   35 o   33.929   8.5877   18.199   10.736   43.408   31.495   14.885   11.420   41.565   14.705   26.293   8.8750 15.27151 17.17531 
1 1 1   19    8   36 o   78.792   3.4260  131.412   11.111  143.481   16.022  120.231   15.421   82.328   4.7186   75.257   4.9683 7.070465 6.851943 
1 1 1   19    8   37 o   91.125   3.4771  176.920   13.033  160.991   18.300  193.312   18.564   86.846   5.1091   95.404   4.7178 -8.557755 6.954204 
1 1 1   19    8   38 f   30.423   6.1923   21.914   8.7966   11.515   12.772   31.300   12.133   24.337   9.2352   36.509   8.2517 -12.17245 12.38466 
1 1 1   19    8   39 o   21.070   6.7374  -0.9560   11.146   2.8284   12.495 -15.6942   24.658   20.082   8.5628   22.057   10.404 -1.974926 13.47480 
1 1 1   19    8   40 o   26.126   7.6361   12.561   12.031   15.321   13.249  -0.4088   28.726   26.049   9.4965   26.204   11.961 -0.1549511 15.27217 
1 1 1   19    8   41 o   42.270   7.6961   49.421   12.667   51.972   14.332   40.314   27.080   47.665   7.2902   36.875   13.556 10.78966 15.39228 
1 1 1   19    8   42 o   17.301   5.9888 -19.0110   12.240 -11.8293   13.596 -49.7137   28.111   16.020   7.6065   18.581   9.2522 -2.561256 11.97760 
1 1 1   19    8   43 o   37.161   9.1367   35.774   22.224 -14.0563   31.475   85.318   31.384   23.600   11.307   50.722   14.355 -27.12189 18.27334 
1 1 1   19    8   44 o   31.628   9.5183   31.384   26.163 -37.6156   52.774   53.869   30.126   25.396   12.651   37.860   14.225 -12.46426 19.03664 
1 1 1   19    9    0 o  440.968   3.8537  4018.40   99.088  4018.40   99.088  4018.40   99.088  440.968   5.4500  440.968   5.4500 0.000000 0.000000 
1 1 1   19    9    1 o  204.094   2.5292  860.042   21.287  849.202   29.835  871.284   30.383  202.785   3.5671  205.403   3.5864 -2.618103 5.058313 
1 1 1   19    9    2 o  120.456   2.3914  299.558   11.880  302.552   16.928  296.654   16.676  121.048   3.3907  119.863   3.3732 1.184883 4.782788 
1 1 1   19    9    3 o  324.977   3.1343  2181.26   41.986  2144.93   58.215  2220.65   60.612  322.166   4.3812  327.788   4.4833 -5.621338 6.268574 
1 1 1   19    9    4 o  236.256   2.9609  1157.73   28.460  1181.54   37.511  1125.42   43.689  239.171   3.8026  233.342   4.5396 5.828812 5.921827 
1 1 1   19    9    5 o  417.178   4.1375  3612.75   70.182  3663.29   92.201  3543.11  108.217  420.799   5.3124  413.558   6.3445 7.240692 8.274917 
1 1 1   19    9    6 o  150.903   3.0332  470.434   18.874  481.622   27.003  459.745   26.393  152.657   4.2887  149.149   4.2904 3.507462 6.066335 
1 1 1   19    9    7 o  204.969   2.4006  864.769   20.027  884.925   31.105  850.498   26.174  206.980   3.6436  202.958   3.1267 4.022278 4.801275 
1 1 1   19    9    8 o  102.257   2.3667  215.045   9.8889  222.360   15.159  209.626   13.047  103.755   3.5423  100.758   3.1397 2.997307 4.733460 
1 1 1   19    9    9 o  272.958   2.4869  1538.98   27.998  1535.55   39.508  1542.44   39.682  272.653   3.5133  273.263   3.5208 -0.6106873 4.973877 
1 1 1   19    9   10 o  123.875   2.1250  316.821   10.857  316.174   15.314  317.474   15.394  123.748   3.0004  124.002   3.0100 -0.2537003 4.249996 
1 1 1   19    9   11 o   99.063   2.3833  201.975   9.6803  209.001   14.607  196.473   12.926  100.587   3.5209   97.539   3.2132 3.047554 4.766685 
1 1 1   19    9   12 o  125.154   2.5510  317.343   12.543  343.957   21.660  303.917   15.385  128.993   4.0713  121.315   3.0747 7.678276 5.101909 
1 1 1   19    9   13 o  118.773   2.6979  300.186   12.435  264.624   20.870  319.760   15.483  113.109   4.4736  124.437   3.0168 -11.32787 5.395803 
1 1 1   19    9   14 o  169.599   2.3662  596.067   16.352  581.539   24.985  606.954   21.628  167.762   3.6109  171.436   3.0588 -3.674332 4.732317 
1 1 1   19    9   15 o  196.756   2.3649  799.975   18.727  798.674   29.948  800.810   23.997  196.587   3.6936  196.925   2.9545 -0.3383484 4.729872 
1 1 1   19    9   16 o  208.390   2.4129  898.961   20.242  889.245   32.270  905.264   25.991  207.416   3.7722  209.363   3.0100 -1.947510 4.825885 
1 1 1   19    9   17 o  215.403   2.5857  958.340   22.849  964.749   34.174  953.158   30.728  216.030   3.8355  214.775   3.4688 1.254364 5.171422 
1 1 1   19    9   18 o  140.489   2.4899  407.937   14.425  405.271   20.537  410.533   20.267  140.033   3.5558  140.945   3.4864 -0.9120331 4.979836 
1 1 1   19    9   19 o  123.724   2.7911  312.459   14.001  295.560   18.002  338.332   22.275  119.571   3.6504  127.878   4.2233 -8.307083 5.582284 
1 1 1   19    9   20 o  122.655   2.5965  310.471   13.122  298.615   18.060  323.727   19.097  120.182   3.6435  125.128   3.7004 -4.946548 5.193100 
1 1 1   19    9   21 o   40.202   6.6145   39.205   10.325   45.894   12.111   21.410   19.753   46.978   6.2506   33.425   11.659 13.55311 13.22904 
1 1 1   19    9   22 o  349.108   3.4752  2528.72   50.024  2575.44   70.336  2480.89   71.160  352.404   4.8391  345.813   4.9892 6.590271 6.950474 
1 1 1   19    9   23 o  220.021   2.5494  1001.85   23.134  1000.42   32.819  1003.26   32.616  219.862   3.6191  220.180   3.5916 -0.3180389 5.098782 
1 1 1   19    9   24 o   89.461   3.0009  166.045   11.030  147.673   15.434  185.224   15.769   84.377   4.4348   94.544   4.0439 -10.16693 6.001772 
1 1 1   19    9   25 o  100.193   3.2677  210.806   13.174  197.550   20.699  219.832   17.080   97.428   5.1510  102.959   4.0221 -5.531052 6.535356 
1 1 1   19    9   26 o  108.468   3.9007  245.825   17.444  253.258   24.644  238.361   24.695  110.134   5.4253  106.801   5.6062 3.332916 7.801486 
1 1 1   19    9   27 f   97.070   3.1061  198.211   12.296  176.730   18.129  216.513   16.733   92.066   4.7742  102.074   3.9747 -10.00803 6.212220 
1 1 1   19    9   28 o   72.011   3.4445  108.506   10.214  105.861   14.761  110.936   14.147   71.136   5.0310   72.886   4.7062 -1.749893 6.889055 
1 1 1   19    9   29 o   65.930   3.5943   91.140   9.7548   88.453   14.112   93.598   13.499   64.962   5.2669   66.899   4.8925 -1.936523 7.188659 
1 1 1   19    9   30 o   56.681   4.0677   68.624   9.3895   59.986   13.784   76.102   12.826   53.187   6.2834   60.175   5.1676 -6.988094 8.135431 
1 1 1   19    9   31 o   80.771   9.2887  125.503   20.459  115.503   21.760  201.732   60.080   73.309   7.1966   88.234   17.127 -14.92535 18.57742 
1 1 1   19    9   32 o   38.550   8.1983   34.967   14.102   33.319   19.845   36.648   20.044   37.714   11.615   39.386   11.574 -1.672028 16.39665 
1 1 1   19    9   33 o   56.238   4.1429   67.138   9.5903   73.040   13.769   61.578   13.365   58.683   5.6890   53.792   6.0240 4.891293 8.285743 
1 1 1   19    9   34 o   39.712   5.8982   35.279   9.2979   42.244   14.264   30.133   12.261   43.139   8.3184   36.284   8.3641 6.855137 11.79635 
1 1 1   19    9   35 o   43.683   5.2713   42.164   9.2972   45.023   13.549   39.620   12.781   45.425   7.2317   41.941   7.6713 3.483807 10.54262 
1 1 1   19    9   36 o   49.211   5.3738   59.198   9.6038   29.424   14.123   84.805   13.098   35.255   9.4991   63.167   5.0275 -27.91183 10.74751 
1 1 1   19    9   37 o   29.978   6.5246   20.910   8.7873   23.601   13.478   18.919   11.589   31.447   9.5506   28.509   8.8919 2.938530 13.04914 
1 1 1   19    9   38 o   28.836   6.4803   19.630   8.6660   19.411   12.240   19.851   12.271   28.697   9.1628   28.974   9.1662 -0.2763634 12.96055 
1 1 1   19    9   39 o   31.660   7.8439   24.897   11.707   25.790   13.244   21.708   25.030   32.296   9.3845   31.025   12.571 1.270306 15.68789 
1 1 1   19    9   40 o   25.127   8.0587   6.9730   12.135   9.9730   12.485 -44.1932   51.562   23.064   9.0305   27.190   13.350 -4.125700 16.11732 
1 1 1   19    9   41 o   24.943   7.8879   2.3701   12.638  -1.5679   13.890   21.304   30.457   19.054   8.5421   30.833   13.263 -11.77937 15.77590 
1 1 1   19    9   42 o   27.889   7.6654   19.419   12.931   24.537   14.747   2.3932   26.896   30.506   10.081   25.272   11.550 5.234636 15.33077 
1 1 1   19    9   43 o   33.192   9.7245   35.934   21.754   44.635   32.293   28.704   29.435   35.281   14.285   31.103   13.199 4.177885 19.44905 
1 1 1   19    9   44 o   38.630   10.919   61.642   24.831   80.531   50.870   55.733   28.450   38.298   16.797   38.962   13.955 -0.6643867 21.83782 
1 1 1   19   10    0 o   54.117   4.0175   62.475   12.362   62.475   12.362   62.475   12.362   54.117   5.6816   54.117   5.6816 0.000000 0.000000 
1 1 1   19   10    1 o  163.200   2.6893  550.265   17.753  550.648   22.969  549.697   27.978  163.297   3.4104  163.103   4.1590 0.1941986 5.378520 
1 1 1   19   10    2 o   49.321   3.4216   50.483   6.9083   58.075   9.8335   43.085   9.7073   53.005   4.4980   45.638   5.1572 7.367615 6.843157 
1 1 1   19   10    3 o   78.904   2.6409  128.760   8.5829  122.255   12.213  135.108   12.064   76.928   3.8493   80.879   3.6166 -3.950951 5.281723 
1 1 1   19   10    4 o  126.662   2.2525  329.693   11.656  342.289   17.894  320.408   15.363  128.744   3.3698  124.580   2.9900 4.164719 4.505080 
1 1 1   19   10    5 o  222.315   2.6173  1020.83   23.996  1032.06   34.228  1009.98   33.651  223.516   3.7128  221.114   3.6899 2.402206 5.234550 
1 1 1   19   10    6 o   37.320   4.4715   29.466   6.6937   32.380   9.3716   26.432   9.5640   39.540   5.7465   35.099   6.8525 4.441055 8.943083 
1 1 1   19   10    7 o   71.429   2.6673  105.152   7.8114  107.739   11.765  103.113   10.446   72.206   3.9504   70.651   3.5849 1.554276 5.334538 
1 1 1   19   10    8 o  273.234   2.6805  1542.59   29.907  1541.95   45.619  1543.06   39.605  273.148   4.0493  273.319   3.5133 -0.1710815 5.360973 
1 1 1   19   10    9 o  166.502   2.3201  572.346   15.745  571.343   20.729  573.714   24.208  166.348   3.0213  166.656   3.5219 -0.3084869 4.640253 
1 1 1   19   10   10 o   60.952   2.7366   76.763   6.8787   76.270   9.6340   77.276   9.8247   60.753   3.8448   61.150   3.8954 -0.3976212 5.473278 
1 1 1   19   10   11 o  205.978   2.7782  876.533   22.072  877.977   38.849  875.845   26.821  206.021   4.5719  205.935   3.1578 0.8644104E-01 5.556414 
1 1 1   19   10   12 o  275.554   3.8932  1566.62   33.400  1582.73   80.629  1563.28   36.697  275.996   7.0831  275.112   3.2341 0.8844910 7.786484 
1 1 1   19   10   13 o  132.023   2.6323  357.047   13.444  369.278   23.711  351.251   16.322  133.629   4.3021  130.418   3.0343 3.210571 5.264531 
1 1 1   19   10   14 o   92.012   2.5971  176.754   9.5548  167.359   15.324  182.729   12.221   89.966   4.1298   94.059   3.1503 -4.092781 5.194217 
1 1 1   19   10   15 o  223.577   2.4433  1028.35   21.800  1050.44   35.838  1015.38   27.466  225.421   3.8546  221.732   3.0033 3.688858 4.886546 
1 1 1   19   10   16 o  151.822   2.3468  474.217   14.323  484.997   23.111  467.495   18.250  153.188   3.6579  150.457   2.9409 2.731049 4.693525 
1 1 1   19   10   17 o  273.349   2.7899  1544.84   31.268  1546.38   46.840  1543.61   41.995  273.432   4.1534  273.265   3.7261 0.1668701 5.579785 
1 1 1   19   10   18 o  201.938   2.5546  843.899   21.219  828.985   31.017  857.021   29.093  200.239   3.7556  203.636   3.4639 -3.396790 5.109150 
1 1 1   19   10   19 o  117.293   3.9224  301.925   16.058  318.579   18.633  253.849   31.658  124.137   3.6392  110.449   6.9496 13.68814 7.844781 
1 1 1   19   10   20 o   99.100   3.4022  193.536   13.051  176.640   15.639  232.289   23.685   92.389   4.1042  105.810   5.4273 -13.42063 6.804439 
1 1 1   19   10   21 o  111.384   3.8591  256.445   17.491  250.661   22.821  264.681   27.231  109.926   5.0335  112.842   5.8509 -2.916336 7.718124 
1 1 1   19   10   22 o   27.246   6.2933   15.067   8.1193   15.536   11.934   14.663   11.079   27.663   9.0652   26.828   8.7318 0.8347740 12.58661 
1 1 1   19   10   23 o   55.053   3.9828   63.091   9.0414   64.116   12.729   62.046   12.845   55.511   5.5595   54.595   5.7046 0.9165344 7.965571 
1 1 1   19   10   24 o   74.177   3.3414  114.272   10.219  118.010   14.496  110.579   14.409   75.390   4.6621   72.964   4.7881 2.425690 6.682877 
1 1 1   19   10   25 o   76.830   3.6373  123.241   11.364  121.599   17.537  124.429   14.920   76.319   5.5714   77.341   4.6774 -1.022171 7.274519 
1 1 1   19   10   26 f  175.788   3.3976  644.648   24.511  636.134   36.387  651.721   33.164  174.628   5.0521  176.948   4.5443 -2.319321 6.795126 
1 1 1   19   10   27 o   31.068   5.9086   20.941   8.2506   10.700   11.608   31.398   11.729   24.364   8.8879   37.772   7.7878 -13.40750 11.81712 
1 1 1   19   10   28 o  139.014   3.3584  404.786   19.208  430.554   26.907  378.008   27.429  143.615   4.5426  134.414   4.9476 9.200287 6.716731 
1 1 1   19   10   29 o   49.879   4.4349   52.570   9.1218   51.600   12.932   53.530   12.869   49.407   6.3461   50.351   6.1967 -0.9442177 8.869739 
1 1 1   19   10   30 o   50.540   4.4722   54.616   9.2704   49.349   13.318   59.566   12.912   48.065   6.7182   53.016   5.9050 -4.950611 8.944421 
1 1 1   19   10   31 o  115.149   5.4518  280.223   25.892  280.223   25.892   0.0000   0.0000  115.149   5.4518  ?   ?       ?      ? 
1 1 1   19   10   32 o  133.874   3.4544  377.834   18.872  371.846   28.719  382.385   25.035  132.734   5.2459  135.013   4.4958 -2.278885 6.908835 
1 1 1   19   10   33 o   61.134   3.9091   79.130   9.8419   83.740   14.401   75.089   13.481   62.790   5.5610   59.478   5.4955 3.311401 7.818220 
1 1 1   19   10   34 o   49.562   4.8278   52.746   9.7579   55.536   15.112   50.751   12.779   50.532   7.2506   48.593   6.3763 1.939716 9.655545 
1 1 1   19   10   35 o   14.201   4.7622 -11.7441   7.5318 -16.4149   11.464  -8.1973   9.9903   13.841   6.6803   14.561   6.7888 -0.7194033 9.524405 
1 1 1   19   10   36 o   87.866   4.0764  161.979   13.493  176.013   25.148  156.306   15.989   89.781   6.7914   85.952   4.5104 3.829453 8.152718 
1 1 1   19   10   37 o   66.387   4.0565   93.555   10.987  114.917   16.784   77.539   14.533   72.981   5.5761   59.794   5.8930 13.18656 8.112958 
1 1 1   19   10   38 f   66.687   3.8848   96.274   10.661   95.047   15.541   97.364   14.652   66.170   5.6944   67.205   5.2860 -1.034454 7.769674 
1 1 1   19   10   39 o   28.694   7.9499   16.435   11.939   13.792   13.579   25.433   25.056   25.333   9.5443   32.055   12.716 -6.721363 15.89977 
1 1 1   19   10   40 o   32.818   8.4181   29.375   13.196   32.814   13.634 -21.5387   52.460   36.382   9.1071   29.254   14.160 7.127903 16.83621 
1 1 1   19   10   41 o   30.162   8.2154   4.1883   12.407  -7.6274   13.630   61.327   29.973   17.090   7.9553   43.233   14.377 -26.14246 16.43080 
1 1 1   19   10   42 o   24.961   7.6442   9.8155   12.268   9.8843   13.602   9.5155   28.407   22.907   9.2724   27.016   12.156 -4.108927 15.28837 
1 1 1   19   10   43 o   30.661   9.1745   25.082   21.777  -0.7109   32.213   46.792   29.554   25.284   11.916   36.038   13.953 -10.75363 18.34894 
1 1 1   19   10   44 o   30.656   9.3951   28.986   22.003   41.982   32.640   18.162   29.790   33.446   14.029   27.866   12.500 5.580198 18.79013 
1 1 1   19   11    0 o  136.575   2.3759  385.639   18.901  385.639   18.901  385.639   18.901  136.575   3.3600  136.575   3.3600 0.000000 0.000000 
1 1 1   19   11    1 o  290.678   2.9321  1746.29   35.153  1743.96   49.668  1748.63   49.760  290.483   4.1456  290.872   4.1478 -0.3885193 5.864283 
1 1 1   19   11    2 o   67.004   2.8371   92.900   7.8266   86.718   11.087   99.040   11.050   64.774   4.1501   69.234   3.8696 -4.459297 5.674225 
1 1 1   19   11    3 o  199.905   2.3747  822.165   19.335  844.954   29.977  805.930   25.302  202.247   3.5937  197.564   3.1052 4.683380 4.749414 
1 1 1   19   11    4 o  122.214   2.6794  306.143   13.268  321.410   21.036  296.058   17.097  124.705   4.0899  119.723   3.4625 4.981956 5.358754 
1 1 1   19   11    5 o  218.905   2.9032  989.157   25.696  996.716   40.638  984.122   33.167  219.554   4.4877  218.257   3.6845 1.297089 5.806476 
1 1 1   19   11    6 o  146.586   2.6506  444.507   15.830  447.656   20.866  440.236   24.298  147.220   3.4365  145.952   4.0365 1.268372 5.301171 
1 1 1   19   11    7 o   70.170   2.6993  100.434   7.7439  111.471   11.952   92.449   10.166   73.445   3.9457   66.895   3.6847 6.550476 5.398670 
1 1 1   19   11    8 o  121.448   2.2926  304.575   11.367  304.834   17.359  304.381   15.040  121.480   3.4647  121.415   3.0033 0.6542206E-01 4.585145 
1 1 1   19   11    9 o  236.451   2.3285  1154.75   22.708  1158.18   32.174  1151.35   32.054  236.800   3.2943  236.102   3.2917 0.6980133 4.656970 
1 1 1   19   11   10 o  191.521   2.1928  757.390   17.320  743.816   24.332  771.331   24.659  189.781   3.1085  193.261   3.0936 -3.479538 4.385606 
1 1 1   19   11   11 o   38.215   4.2455   31.255   6.3966   27.391   9.6527   34.280   8.5411   35.738   6.7970   40.692   5.0891 -4.953316 8.491098 
1 1 1   19   11   12 o  214.072   2.7836  943.292   23.062  958.838   40.471  935.817   28.064  215.286   4.5579  212.857   3.1967 2.428894 5.567139 
1 1 1   19   11   13 o  198.036   2.7294  814.421   21.064  799.108   36.141  822.299   25.922  196.542   4.4584  199.529   3.1499 -2.987900 5.458849 
1 1 1   19   11   14 o  106.945   2.6978  236.601   11.879  233.088   17.246  239.772   16.385  106.181   3.9379  107.709   3.6884 -1.528358 5.395532 
1 1 1   19   11   15 o  134.977   2.4874  376.179   13.809  380.329   20.354  372.640   18.795  135.656   3.6379  134.297   3.3933 1.359283 4.974811 
1 1 1   19   11   16 o  124.956   2.3996  315.014   11.974  352.372   20.020  294.209   14.940  130.563   3.7177  119.349   3.0351 11.21405 4.799284 
1 1 1   19   11   17 o  227.769   2.6237  1073.73   24.568  1056.68   36.067  1088.49   33.557  226.055   3.8684  229.482   3.5454 -3.426849 5.247361 
1 1 1   19   11   18 o  160.085   2.6490  529.116   17.477  505.598   24.208  554.721   25.259  156.374   3.7534  163.797   3.7390 -7.422150 5.297911 
1 1 1   19   11   19 o  147.209   2.4690  447.831   14.987  436.632   20.977  459.508   21.420  145.329   3.4997  149.089   3.4835 -3.760147 4.937913 
1 1 1   19   11   20 o   75.698   3.8615  119.052   11.445  119.226   14.130  118.718   19.518   75.860   4.5160   75.537   6.2649 0.3230133 7.722905 
1 1 1   19   11   21 o   57.540   4.6190   69.683   10.431   71.290   12.988   66.763   17.507   58.583   5.3755   56.498   7.5130 2.085022 9.238020 
1 1 1   19   11   22 o   77.766   3.2449  125.537   10.401  121.230   14.785  129.756   14.633   76.434   4.6901   79.097   4.4856 -2.662926 6.489762 
1 1 1   19   11   23 o  163.039   2.6983  550.285   18.138  539.902   25.246  561.363   26.076  161.454   3.7912  164.623   3.8405 -3.168381 5.396521 
1 1 1   19   11   24 o  100.458   3.1086  207.494   12.654  220.617   20.103  198.881   16.286  103.006   4.7318   97.910   4.0329 5.095810 6.217258 
1 1 1   19   11   25 o  150.695   2.6437  470.054   16.398  455.081   22.358  487.485   24.123  148.122   3.6597  153.267   3.8162 -5.144196 5.287398 
1 1 1   19   11   26 o   56.297   5.0830   69.488   10.798   60.524   18.947   73.799   13.141   53.196   8.6355   59.398   5.3641 -6.201450 10.16594 
1 1 1   19   11   27 o   88.201   3.0734  162.374   11.164  157.660   16.083  166.757   15.508   86.933   4.4856   89.469   4.2026 -2.535675 6.146775 
1 1 1   19   11   28 f   72.791   3.5385  110.960   10.563  110.167   15.770  111.606   14.225   72.496   5.2740   73.086   4.7189 -0.5899582 7.076968 
1 1 1   19   11   29 o   64.043   3.6765   86.296   9.6844   94.421   13.799   78.410   13.595   67.064   4.9889   61.022   5.4015 6.042816 7.352912 
1 1 1   19   11   30 o   26.496   6.1905   14.950   7.8778   16.113   11.044   13.746   11.240   27.230   8.7048   25.763   8.8042 1.466566 12.38091 
1 1 1   19   11   31 o   32.388   7.2226   22.956   10.118   22.128   12.007   24.983   18.795   31.257   8.8907   33.520   11.385 -2.263348 14.44523 
1 1 1   19   11   32 o   63.926   3.9984   86.571   10.478   86.123   14.056   87.132   15.720   63.835   5.3389   64.018   5.9536 -0.1835747 7.996793 
1 1 1   19   11   33 o   67.807   3.6875   97.085   10.291  104.117   15.153   91.065   14.020   70.066   5.2435   65.547   5.1861 4.518753 7.374916 
1 1 1   19   11   34 o   31.365   6.3992   22.663   8.7403   24.445   12.631   21.027   12.107   32.464   9.0789   30.266   9.0206 2.198036 12.79834 
1 1 1   19   11   35 o   36.755   5.8908   31.003   8.7209   34.996   12.829   27.572   11.891   39.023   8.2301   34.487   8.4304 4.535767 11.78158 
1 1 1   19   11   36 o   48.647   6.7988   62.867   11.377   41.983   22.593   69.961   13.168   40.280   12.391   57.014   5.5999 -16.73421 13.59762 
1 1 1   19   11   37 f   38.936   5.8601   35.953   9.2530   28.533   13.759   42.079   12.503   34.295   9.4326   43.577   6.9563 -9.281799 11.72030 
1 1 1   19   11   38 o   44.416   7.4344   54.031   12.715   59.392   14.729   38.346   25.193   51.544   6.9284   37.289   13.156 14.25544 14.86870 
1 1 1   19   11   39 o   44.184   7.6199   41.563   12.334   31.229   14.097   75.307   25.473   35.340   9.4766   53.028   11.935 -17.68773 15.23984 
1 1 1   19   11   40 o   43.138   7.9007   44.352   11.868   40.435   13.168   61.309   27.397   41.105   8.0551   45.172   13.594 -4.067078 15.80135 
1 1 1   19   11   41 o   23.555   7.4913   4.4492   12.486   4.8855   13.768   2.4284   29.628   21.026   8.9773   26.084   11.995 -5.057682 14.98255 
1 1 1   19   11   42 o   52.679   8.2094   85.018   15.868   91.375   18.302   65.776   31.843   62.595   7.0891   42.763   14.810 19.83186 16.41886 
1 1 1   19   11   43 f   18.654   6.5771 -45.5492   20.116 -41.2507   29.949 -49.0824   27.152   19.540   9.6996   17.768   8.8854 1.771906 13.15416 
1 1 1   19   12    0 o  285.337   2.9020  1681.92   48.276  1681.92   48.276  1681.92   48.276  285.337   4.1040  285.337   4.1040 0.000000 0.000000 
1 1 1   19   12    1 o   74.699   2.6843  115.501   8.2477  105.700   11.666  125.296   11.662   71.519   3.9549   77.880   3.6306 -6.360565 5.368661 
1 1 1   19   12    2 o  307.043   2.8350  1948.04   35.549  1950.19   54.217  1946.42   47.082  307.147   4.2798  306.940   3.7191 0.2065125 5.669947 
1 1 1   19   12    3 o  119.221   2.2493  293.631   10.973  292.563   16.575  294.465   14.641  119.018   3.3766  119.425   2.9725 -0.4065552 4.498558 
1 1 1   19   12    4 o   36.722   4.4642   28.803   6.4451   38.149   9.2837   20.107   8.9547   42.932   5.2430   30.513   7.2268 12.41902 8.928340 
1 1 1   19   12    5 o   62.596   3.0034   80.971   7.7364   88.550   11.090   73.787   10.797   65.453   4.1082   59.739   4.3822 5.714294 6.006748 
1 1 1   19   12    6 o  151.288   2.4334  472.740   15.182  483.492   21.579  462.202   21.364  152.993   3.4197  149.584   3.4629 3.409500 4.866826 
1 1 1   19   12    7 o   42.454   3.8940   39.913   6.2523   27.773   9.4421   49.392   8.3437   36.029   6.5972   48.879   4.1387 -12.85006 7.787942 
1 1 1   19   12    8 o   66.671   2.7773   93.537   7.4863   81.127   11.285  103.289   10.004   62.632   4.3687   70.710   3.4304 -8.077366 5.554555 
1 1 1   19   12    9 o  278.507   2.7010  1606.08   30.807  1577.16   46.180  1629.26   41.353  276.206   4.0538  280.809   3.5705 -4.602844 5.402011 
1 1 1   19   12   10 o  192.986   2.3625  771.148   18.674  753.213   27.934  785.640   25.110  190.931   3.5472  195.040   3.1215 -4.108566 4.725084 
1 1 1   19   12   11 o  228.709   2.8795  1077.64   25.609  1092.97   44.496  1070.05   31.316  229.825   4.6942  227.593   3.3361 2.231659 5.758902 
1 1 1   19   12   12 o  152.408   2.6586  483.636   15.822  468.977   26.953  491.343   19.543  150.576   4.3400  154.240   3.0721 -3.664307 5.317260 
1 1 1   19   12   13 o  265.654   2.9519  1456.56   29.460  1466.60   54.438  1452.40   35.033  266.145   4.9593  265.163   3.2033 0.9820251 5.903887 
1 1 1   19   12   14 f  108.953   2.7325  247.910   11.253  239.099   20.351  251.791   13.505  107.489   4.5904  110.417   2.9656 -2.927704 5.465044 
1 1 1   19   12   15 o  140.437   2.3655  410.489   13.343  393.944   21.229  421.292   17.155  138.048   3.7286  142.826   2.9122 -4.778091 4.731066 
1 1 1   19   12   16 o  160.297   2.3506  530.325   15.139  533.734   24.370  528.183   19.318  160.680   3.6773  159.914   2.9289 0.7661438 4.701232 
1 1 1   19   12   17 o  292.413   3.3945  1767.44   40.083  1787.75   63.675  1754.10   51.586  293.677   5.2569  291.148   4.2959 2.528534 6.788945 
1 1 1   19   12   18 o  160.181   2.6355  530.622   17.411  525.406   24.640  535.824   24.606  159.392   3.7480  160.970   3.7063 -1.577560 5.271071 
1 1 1   19   12   19 o  260.114   2.9204  1399.25   31.303  1369.75   43.194  1431.89   45.428  257.243   4.0712  262.984   4.1882 -5.741791 5.840853 
1 1 1   19   12   20 o  230.994   4.8817  1088.39   31.414  1079.60   33.656  1147.85   87.526  228.443   3.5721  233.545   9.0866 -5.102341 9.763498 
1 1 1   19   12   21 o  150.556   2.8658  465.583   17.234  454.000   21.684  485.448   28.397  148.115   3.5496  152.997   4.5001 -4.881638 5.731554 
1 1 1   19   12   22 o  263.237   2.6721  1435.04   29.011  1439.13   41.104  1430.98   40.952  263.611   3.7805  262.865   3.7772 0.7460938 5.344148 
1 1 1   19   12   23 o  128.121   2.6303  340.082   13.896  329.556   19.517  350.903   19.789  126.105   3.7525  130.137   3.6869 -4.031326 5.260618 
1 1 1   19   12   24 o   30.801   6.3884   19.524   8.7573   28.048   13.543   13.398   11.480   35.591   9.1694   26.012   8.8978 9.578915 12.77689 
1 1 1   19   12   25 o  160.999   3.1638  541.228   20.336  546.142   25.783  533.139   33.079  162.165   3.8549  159.834   5.0178 2.330811 6.327629 
1 1 1   19   12   26 o   38.790   6.6023   33.254   9.6207   34.008   18.375   32.970   11.292   38.754   10.990   38.825   7.3203 -0.7091522E-01 13.20460 
1 1 1   19   12   27 o   37.771   5.6041   31.392   8.4351   34.296   12.467   28.941   11.455   39.401   7.9457   36.141   7.9050 3.260216 11.20818 
1 1 1   19   12   28 o  108.396   2.9944  244.669   13.278  248.590   20.169  241.669   17.641  109.087   4.4827  107.706   3.9711 1.380486 5.988704 
1 1 1   19   12   29 o   20.489   5.8146   3.8973   7.7570   9.5410   11.072  -1.5441   10.871   23.201   8.6420   17.777   7.7818 5.423775 11.62924 
1 1 1   19   12   30 o   56.465   5.3029   62.733   11.364   54.282   13.318   85.362   21.793   50.443   6.4015   62.487   8.4560 -12.04341 10.60576 
1 1 1   19   12   31 o   41.368   5.1254   37.329   8.5339   37.917   12.607   36.831   11.594   41.278   7.6880   41.458   6.7805 -0.1805573 10.25082 
1 1 1   19   12   32 o   98.913   3.3693  204.391   13.497  196.845   17.369  215.889   21.442   96.809   4.3501  101.018   5.1464 -4.209122 6.738631 
1 1 1   19   12   33 o   28.624   6.5269   17.980   8.7519   21.508   13.186   15.202   11.701   30.676   9.4712   26.572   8.9833 4.103275 13.05385 
1 1 1   19   12   34 o   43.582   5.3096   43.034   9.1409   34.159   13.193   51.227   12.676   38.446   8.5422   48.719   6.3087 -10.27297 10.61922 
1 1 1   19   12   35 o   66.431   3.8127   94.116   10.428  102.127   15.138   86.881   14.387   69.151   5.3076   63.711   5.4749 5.440086 7.625344 
1 1 1   19   12   36 o   26.412   7.4100   11.576   10.505   17.058   21.915   9.9401   11.969   29.582   11.841   23.242   8.9114 6.340754 14.81998 
1 1 1   19   12   37 o   58.640   4.1198   74.802   9.9456   74.245   14.469   75.301   13.694   58.333   6.0138   58.946   5.6325 -0.6122437 8.239559 
1 1 1   19   12   38 o   20.235   6.4579  -2.8545   11.424   4.7046   13.193 -25.5121   22.840   21.084   8.8853   19.386   9.3739 1.697908 12.91580 
1 1 1   19   12   39 f   78.196   5.2284  140.442   15.334  142.300   18.411  136.235   27.703   80.702   5.5313   75.690   8.8741 5.012108 10.45683 
1 1 1   19   12   40 f   37.950   8.7124   35.106   13.504   28.400   15.261   59.301   28.988   32.844   10.197   43.056   14.130 -10.21140 17.42484 
1 1 1   19   12   41 o   35.850   9.9633   34.119   15.262   34.119   15.262   0.0000   0.0000   35.850   9.9633  ?   ?       ?      ? 
1 1 1   19   12   42 o   30.965   8.5110   19.038   13.024   10.462   14.542   53.810   29.281   23.151   9.5052   38.780   14.121 -15.62891 17.02200 
1 1 1   19   12   43 o   45.132   10.326   78.300   23.334   57.560   33.940   96.887   32.132   37.518   14.827   52.746   14.376 -15.22773 20.65227 
1 1 1   19   13    0 o   29.045   5.8704   21.219   8.6205   21.219   8.6205   21.219   8.6205   29.045   8.3021   29.045   8.3021 0.000000 0.000000 
1 1 1   19   13    1 o  264.756   2.6212  1450.10   28.409  1433.50   42.744  1463.23   38.022  263.365   3.9351  266.147   3.4638 -2.782440 5.242414 
1 1 1   19   13    2 o  204.318   2.3838  859.607   19.850  879.387   30.672  845.352   26.038  206.310   3.6046  202.325   3.1203 3.985092 4.767523 
1 1 1   19   13    3 o  115.785   2.2653  277.743   10.738  269.197   16.058  284.656   14.443  114.157   3.4105  117.412   2.9825 -3.255180 4.530596 
1 1 1   19   13    4 o  280.563   2.8911  1627.26   33.455  1627.23   47.255  1627.30   47.369  280.561   4.0837  280.565   4.0935 -0.4364014E-02 5.782177 
1 1 1   19   13    5 o  165.194   2.4365  563.762   16.600  567.983   23.470  559.535   23.484  165.814   3.4318  164.574   3.4597 1.240158 4.873047 
1 1 1   19   13    6 o   98.241   2.3511  198.817   9.4429  203.400   14.411  195.369   12.501   99.221   3.5214   97.262   3.1162 1.958794 4.702249 
1 1 1   19   13    7 o  132.696   2.2672  364.502   12.284  357.707   18.650  369.709   16.326  131.586   3.4365  133.806   2.9582 -2.220139 4.534365 
1 1 1   19   13    8 f   97.899   2.3633  197.051   9.4382  204.116   14.569  191.942   12.390   99.393   3.5540   96.404   3.1160 2.988335 4.726510 
1 1 1   19   13    9 o   50.107   3.0839   51.890   6.3705   53.992   9.1409   49.904   8.8832   51.094   4.3377   49.120   4.3848 1.973934 6.167811 
1 1 1   19   13   10 o  265.326   2.9516  1444.78   29.069  1481.07   55.050  1430.74   34.230  267.462   4.9903  263.190   3.1533 4.271729 5.903108 
1 1 1   19   13   11 o  135.632   2.2790  379.805   12.454  380.953   19.878  379.064   15.978  135.776   3.5496  135.488   2.8593 0.2885284 4.558039 
1 1 1   19   13   12 f  129.815   2.3550  348.190   12.364  347.996   19.498  348.320   15.989  129.762   3.6432  129.869   2.9851 -0.1066742 4.709981 
1 1 1   19   13   13 o  235.521   2.8197  1144.28   24.989  1153.54   46.062  1140.42   29.746  236.068   4.7309  234.975   3.0694 1.092529 5.639362 
1 1 1   19   13   14 o  224.495   3.5693  1051.15   25.633  1032.59   59.356  1055.40   28.419  222.950   6.4549  226.040   3.0483 -3.090347 7.138516 
1 1 1   19   13   15 o  174.025   2.6738  627.036   17.580  624.019   32.074  628.332   21.018  173.634   4.4788  174.417   2.9218 -0.7824097 5.347522 
1 1 1   19   13   16 o  165.917   2.4365  567.072   16.472  580.931   25.481  557.122   21.590  167.626   3.6856  164.208   3.1879 3.418365 4.872997 
1 1 1   19   13   17 o   26.179   6.2242   13.402   7.9704   15.333   11.356   11.527   11.190   27.407   8.8335   24.952   8.7711 2.455036 12.44842 
1 1 1   19   13   18 o  149.137   2.9266  463.064   17.753  477.564   23.462  443.639   27.155  151.936   3.7440  146.337   4.4991 5.598740 5.853195 
1 1 1   19   13   19 o  269.993   3.0058  1504.85   33.334  1456.44   44.854  1564.58   49.820  265.201   4.1007  274.786   4.3958 -9.584534 6.011582 
1 1 1   19   13   20 o  103.178   4.8075  226.562   18.413  232.417   21.899  212.436   34.016  105.793   5.0187  100.562   8.2013 5.230064 9.615009 
1 1 1   19   13   21 o  193.492   3.4696  782.792   24.327  788.654   28.370  766.508   47.285  195.201   3.5238  191.784   5.9778 3.416473 6.939138 
1 1 1   19   13   22 o   95.873   3.5299  197.492   13.170  170.237   21.799  213.161   16.528   90.342   5.8502  101.404   3.9518 -11.06197 7.059863 
1 1 1   19   13   23 o  102.889   3.1037  220.579   12.997  216.650   19.974  223.465   17.117  102.024   4.7468  103.755   3.9999 -1.730965 6.207334 
1 1 1   19   13   24 o   91.546   3.0226  174.513   11.397  182.279   15.973  166.458   16.267   93.648   4.1354   89.444   4.4095 4.204109 6.045273 
1 1 1   19   13   25 f  108.141   2.8408  242.712   12.657  230.183   17.438  256.659   18.399  105.197   4.0190  111.084   4.0158 -5.886131 5.681506 
1 1 1   19   13   26 o  117.802   3.6242  290.618   17.607  292.193   25.124  289.098   24.681  118.104   5.1578  117.499   5.0929 0.6042328 7.248465 
1 1 1   19   13   27 o   43.474   6.0853   41.395   10.104   41.285   12.358   41.616   17.550   44.128   6.7897   42.820   10.101 1.308163 12.17053 
1 1 1   19   13   28 f   45.682   4.8653   45.465   8.8681   39.421   12.706   51.207   12.383   42.236   7.5719   49.128   6.1114 -6.892208 9.730521 
1 1 1   19   13   29 o   25.318   6.2785   11.840   8.3409   18.767   12.424   6.1561   11.254   29.162   9.2229   21.474   8.5215 7.687925 12.55698 
1 1 1   19   13   30 o   18.503   6.0717  -9.3254   9.3681 -10.7831   10.795  -4.8792   18.853   14.693   6.9164   22.314   9.9814 -7.620712 12.14349 
1 1 1   19   13   31 o   69.387   3.5667  101.688   10.169   99.866   14.960  103.252   13.865   68.735   5.2772   70.038   4.7996 -1.303246 7.133332 
1 1 1   19   13   32 o   33.565   6.0530   25.774   8.5826   33.419   12.346   18.623   11.939   38.365   8.0587   28.766   9.0339 9.599102 12.10597 
1 1 1   19   13   33 o   57.906   4.4304   71.719   10.545   77.591   15.730   66.927   14.211   60.011   6.3554   55.801   6.1745 4.209419 8.860899 
1 1 1   19   13   34 o   73.152   3.4932  113.612   10.537  113.177   15.050  114.031   14.757   72.989   4.9995   73.315   4.8801 -0.3253479 6.986432 
1 1 1   19   13   35 o   42.866   5.1940   41.205   9.0047   41.783   12.808   40.640   12.663   43.487   7.1408   42.244   7.5444 1.242542 10.38790 
1 1 1   19   13   36 f   28.714   7.4186   13.506   10.261   32.287   20.927   7.5618   11.773   35.536   12.014   21.892   8.7067 13.64373 14.83717 
1 1 1   19   13   37 o   20.182   5.9959   3.8935   8.4779   2.0448   12.411   5.5106   11.608   19.691   8.4684   20.673   8.4906 -0.9813862 11.99187 
1 1 1   19   13   38 o   23.083   7.1889   3.4853   11.771   3.4747   13.530   3.5183   23.867   20.773   8.8852   25.393   11.304 -4.619627 14.37788 
1 1 1   19   13   39 o   25.932   8.6543   3.4976   12.589   3.5468   12.965   2.6854   52.662   20.362   8.7031   31.502   14.961 -11.14048 17.30866 
1 1 1   19   13   40 o   51.181   7.9930   60.666   14.529   48.982   16.553   99.853   30.316   43.812   9.4392   58.549   12.902 -14.73726 15.98608 
1 1 1   19   13   41 o   21.532   9.1660   6.0486   14.275   6.0486   14.275   0.0000   0.0000   21.532   9.1660  ?   ?       ?      ? 
1 1 1   19   13   42 o   63.109   7.8278  112.105   16.619  114.391   19.277  105.491   32.794   70.078   6.6696   56.139   14.164 13.93843 15.65552 
1 1 1   19   14    0 o   97.318   2.1974  196.049   12.445  196.049   12.445  196.049   12.445   97.318   3.1076   97.318   3.1076 0.000000 0.000000 
1 1 1   19   14    1 o  137.369   2.2361  390.789   12.569  380.918   18.878  398.648   16.845  135.793   3.3707  138.945   2.9393 -3.152847 4.472272 
1 1 1   19   14    2 o  112.477   2.2585  261.613   10.395  258.717   15.672  263.888   13.890  111.910   3.3954  113.045   2.9791 -1.135582 4.517008 
1 1 1   19   14    3 o   93.638   2.6014  175.312   9.5876  200.557   16.660  162.812   11.723   98.492   4.1012   88.785   3.2015 9.706749 5.202845 
1 1 1   19   14    4 o  241.624   2.6983  1206.49   26.887  1198.87   37.688  1214.40   38.368  240.849   3.7939  242.398   3.8378 -1.548935 5.396513 
1 1 1   19   14    5 o   86.448   2.6149  154.747   9.2881  171.089   13.182  138.634   13.089   90.999   3.5123   81.898   3.8750 9.101196 5.229889 
1 1 1   19   14    6 o  246.939   2.5570  1259.03   25.765  1267.05   39.480  1253.08   34.005  247.587   3.8662  246.290   3.3476 1.297592 5.114073 
1 1 1   19   14    7 o   68.317   2.6804   96.896   7.4886   92.824   11.214  100.173   10.060   67.004   4.0579   69.629   3.5032 -2.624611 5.360828 
1 1 1   19   14    8 f  372.771   2.9768  2873.01   45.754  2903.12   65.620  2844.52   63.830  374.662   4.2465  370.880   4.1728 3.781738 5.953544 
1 1 1   19   14    9 o  172.696   2.3129  615.636   16.316  619.476   24.896  612.746   21.601  173.147   3.4862  172.245   3.0405 0.9025116 4.625847 
1 1 1   19   14   10 o   60.653   3.5826   77.139   7.9481   74.101   15.157   78.291   9.3344   59.759   6.1497   61.547   3.6772 -1.787800 7.165213 
1 1 1   19   14   11 o   93.688   2.5648  184.430   9.6723  165.714   14.983  197.802   12.665   89.520   4.0580   97.857   3.1379 -8.337448 5.129698 
1 1 1   19   14   12 o  133.786   2.3481  366.893   12.734  385.195   20.160  354.744   16.425  136.519   3.5804  131.052   3.0388 5.466858 4.696169 
1 1 1   19   14   13 o   63.746   3.4234   88.069   8.1204   74.732   14.540   94.114   9.7894   60.012   5.8744   67.480   3.5173 -7.467823 6.846899 
1 1 1   19   14   14 o  144.548   2.6710  433.242   14.994  428.364   25.953  435.686   18.370  143.871   4.3738  145.225   3.0670 -1.354294 5.341903 
1 1 1   19   14   15 o  123.181   2.7006  316.842   12.674  305.731   22.602  321.938   15.307  121.523   4.5094  124.839   2.9728 -3.316216 5.401156 
1 1 1   19   14   16 o  121.908   2.6079  306.810   13.075  314.204   19.330  300.572   17.753  123.248   3.8026  120.567   3.5701 2.681763 5.215885 
1 1 1   19   14   17 o   65.760   3.4527   90.880   9.2356   77.045   13.447  103.232   12.706   60.922   5.3517   70.598   4.3638 -9.675297 6.905315 
1 1 1   19   14   18 o  107.953   2.7073  240.708   12.033  249.211   17.662  233.343   16.437  109.720   3.9029  106.185   3.7532 3.535400 5.414669 
1 1 1   19   14   19 o   77.455   3.2141  124.339   10.262  121.793   14.231  127.097   14.812   76.634   4.5025   78.276   4.5878 -1.642494 6.428114 
1 1 1   19   14   20 o  199.167   3.5218  838.159   28.310  741.492   43.228  910.750   37.460  188.763   5.5524  209.571   4.3338 -20.80754 7.043552 
1 1 1   19   14   21 o   82.435   3.7148  141.971   12.573  155.622   17.644  127.889   17.920   86.519   4.9445   78.351   5.5453 8.168457 7.429602 
1 1 1   19   14   22 f  147.059   3.5634  443.892   21.086  421.661   26.722  480.575   34.327  142.392   4.5501  151.727   5.4853 -9.334381 7.126896 
1 1 1   19   14   23 o  164.001   3.7915  571.633   24.880  517.137   39.225  608.319   32.183  157.057   6.0553  170.946   4.5646 -13.88844 7.583039 
1 1 1   19   14   24 f   88.160   3.0627  161.984   11.122  171.318   15.729  152.649   15.729   90.727   4.2033   85.593   4.4556 5.134399 6.125329 
1 1 1   19   14   25 o   29.406   6.0658   18.541   8.0854   25.738   11.663   11.883   11.218   33.984   8.3751   24.828   8.7768 9.156673 12.13159 
1 1 1   19   14   26 o   69.842   4.1404   97.162   11.118  117.987   20.472   88.450   13.241   74.664   6.6479   65.021   4.9374 9.643066 8.280802 
1 1 1   19   14   27 o   91.703   3.0018  175.818   11.344  167.720   16.051  183.900   16.035   89.564   4.3450   93.843   4.1428 -4.279198 6.003548 
1 1 1   19   14   28 o   67.852   3.5466   97.299   9.8763   87.706   14.113  106.505   13.825   64.480   5.3069   71.225   4.7063 -6.745621 7.093122 
1 1 1   19   14   29 o  166.949   3.2073  584.955   22.080  580.875   31.505  588.894   30.953  166.341   4.5921  167.558   4.4790 -1.216385 6.414689 
1 1 1   19   14   30 o   33.184   6.8019   26.361   9.8836   30.531   11.885   17.012   17.796   36.822   8.0505   29.546   10.966 7.276083 13.60379 
1 1 1   19   14   31 o   96.997   3.1792  198.401   12.660  175.725   17.808  221.572   18.001   91.277   4.7302  102.716   4.2491 -11.43893 6.358441 
1 1 1   19   14   32 o   67.508   4.0547   97.491   11.214   94.869   16.710   99.640   15.127   66.535   6.0892   68.480   5.3557 -1.945129 8.109378 
1 1 1   19   14   33 o   42.910   8.7941   45.621   12.623   46.556   13.246   36.368   41.668   46.208   6.9503   39.613   16.157 6.595016 17.58821 
1 1 1   19   14   34 o   65.106   5.1492  101.020   12.345  116.749   15.325   71.945   20.836   74.035   5.0187   56.176   8.9927 17.85888 10.29836 
1 1 1   19   14   35 o   55.959   4.2323   68.159   9.7312   61.621   13.752   74.715   13.772   53.124   6.2765   58.793   5.6793 -5.669140 8.464537 
1 1 1   19   14   36 o   29.761   7.7529   19.213   11.647   24.809   21.695   16.947   13.805   32.152   12.073   27.369   9.7297 4.782553 15.50588 
1 1 1   19   14   37 o   28.886   7.8050   15.698   11.759   10.052   13.716   31.353   22.840   23.598   9.3938   34.175   12.467 -10.57716 15.61009 
1 1 1   19   14   38 o   33.491   8.0382   23.401   11.685   16.429   13.313   46.784   24.382   26.608   9.5446   40.374   12.937 -13.76627 16.07647 
1 1 1   19   14   39 o   51.397   7.3714   71.338   13.401   74.774   15.607   61.691   26.148   57.487   6.5823   45.308   13.192 12.17893 14.74283 
1 1 1   19   14   40 o   28.751   7.9314   21.259   13.414   24.999   15.208   8.1486   28.471   30.666   10.242   26.837   12.113 3.829239 15.86285 
1 1 1   19   14   41 o   30.805   13.624   27.219   34.124   27.219   34.124   0.0000   0.0000   30.805   13.624  ?   ?       ?      ? 
1 1 1   19   14   42 o   38.846   8.1108   47.925   13.852   50.362   15.998   40.625   27.688   43.793   9.1519   33.900   13.393 9.893150 16.22151 
1 1 1   19   15    0 o  313.828   2.6640  2034.16   48.748  2034.16   48.748  2034.16   48.748  313.828   3.7674  313.828   3.7674 0.000000 0.000000 
1 1 1   19   15    1 o  100.107   2.1799  206.854   8.9980  212.832   12.900  201.189   12.557  101.515   3.0811   98.699   3.0846 2.815834 4.359830 
1 1 1   19   15    2 o   67.222   2.6757   92.166   7.3691  105.635   11.209   81.913   9.7798   71.490   3.8015   62.954   3.7665 8.535732 5.351407 
1 1 1   19   15    3 o  121.001   2.4133  302.503   12.043  305.898   17.019  299.098   17.044  121.682   3.3911  120.319   3.4346 1.362953 4.826596 
1 1 1   19   15    4 o  113.433   2.6919  264.146   12.397  275.974   19.508  256.134   16.055  115.528   4.0942  111.338   3.4963 4.189987 5.383872 
1 1 1   19   15    5 o   87.101   2.5960  156.777   9.3253  155.682   13.094  157.904   13.284   86.793   3.6579   87.409   3.6847 -0.6159821 5.192039 
1 1 1   19   15    6 o   67.718   2.7173   94.028   7.5120   99.979   11.617   89.751   9.8481   69.536   4.0505   65.900   3.6232 3.635483 5.434579 
1 1 1   19   15    7 o  112.883   2.7370  270.434   11.813  244.146   20.547  283.412   14.437  108.620   4.5865  117.145   2.9880 -8.524803 5.473960 
1 1 1   19   15    8 o   98.165   2.2553  199.263   9.1199  188.708   12.940  209.683   12.856   95.575   3.2826  100.756   3.0936 -5.181656 4.510602 
1 1 1   19   15    9 o  245.373   2.8481  1253.89   26.488  1222.23   47.801  1267.92   31.821  242.988   4.7696  247.757   3.1140 -4.768997 5.696166 
1 1 1   19   15   10 o  134.274   2.3098  375.265   12.478  359.426   19.749  385.789   16.098  131.869   3.6311  136.679   2.8557 -4.809891 4.619541 
1 1 1   19   15   11 o  137.327   2.3421  391.424   13.071  378.965   20.120  400.522   17.194  135.402   3.6028  139.251   2.9937 -3.847961 4.684254 
1 1 1   19   15   12 o  286.992   2.6826  1701.58   30.802  1709.00   50.111  1697.08   39.049  287.403   4.2274  286.581   3.3037 0.8219910 5.365222 
1 1 1   19   15   13 o  370.334   3.0933  2841.75   45.948  2824.12   74.056  2852.78   58.589  369.244   4.8628  371.425   3.8245 -2.181335 6.186557 
1 1 1   19   15   14 o  152.388   2.6080  484.934   15.143  467.667   26.996  492.862   18.292  150.308   4.3547  154.468   2.8711 -4.160294 5.216015 
1 1 1   19   15   15 o   54.732   3.7993   64.735   7.7840   55.802   13.857   68.853   9.4088   51.781   6.4884   57.684   3.9547 -5.903084 7.598599 
1 1 1   19   15   16 o   73.990   2.8309  112.160   8.3527  117.822   13.843  108.919   10.474   75.410   4.4507   72.570   3.4995 2.840477 5.661716 
1 1 1   19   15   17 o  125.688   2.5909  327.304   13.398  320.687   19.534  333.182   18.411  124.470   3.8051  126.906   3.5174 -2.435966 5.181762 
1 1 1   19   15   18 o  109.471   2.7876  248.351   12.574  251.433   17.463  245.034   18.119  110.188   3.8425  108.754   4.0394 1.434990 5.575129 
1 1 1   19   15   19 o  108.537   2.6744  243.978   11.971  240.260   16.922  247.703   16.937  107.705   3.8094  109.368   3.7547 -1.662346 5.348741 
1 1 1   19   15   20 o   44.229   5.9532   46.264   9.8917   55.464   12.366   29.917   16.483   51.567   5.8142   36.891   10.390 14.67589 11.90647 
1 1 1   19   15   21 o   42.759   5.2947   38.368   9.0619   34.472   11.766   44.049   14.208   39.831   7.4354   45.687   7.5399 -5.856098 10.58940 
1 1 1   19   15   22 o   85.376   3.4193  154.647   11.717  166.097   15.281  138.310   18.252   89.399   4.1442   81.352   5.4398 8.046394 6.838530 
1 1 1   19   15   23 o   44.453   5.1345   43.279   8.9574   37.889   13.689   47.315   11.845   41.456   8.2957   47.451   6.0525 -5.995625 10.26898 
1 1 1   19   15   24 o   97.051   2.8997  196.089   11.605  198.860   16.613  193.449   16.218   97.715   4.1221   96.386   4.0795 1.328934 5.799464 
1 1 1   19   15   25 o   96.027   2.9288  192.694   11.556  175.381   16.457  209.537   16.232   91.708   4.3508  100.345   3.9221 -8.637260 5.857674 
1 1 1   19   15   26 o   62.902   6.1707   84.964   11.715   89.983   28.107   83.909   12.887   62.560   11.309   63.244   4.9405 -0.6844521 12.34137 
1 1 1   19   15   27 o   73.940   5.6770  127.785   13.218  103.474   29.204  134.048   14.823   67.909   10.427   79.972   4.4939 -12.06385 11.35391 
1 1 1   19   15   28 o   87.244   4.0584  165.846   13.807  145.998   22.842  177.273   17.332   82.582   6.7064   91.906   4.5725 -9.323318 8.116840 
1 1 1   19   15   29 o   21.258   6.1610   0.5760   10.091   12.604   11.833 -31.4924   19.321   25.250   9.0046   17.265   8.4113 7.984465 12.32205 
1 1 1   19   15   30 o   61.998   3.7965   81.254   9.6826   84.833   14.324   78.243   13.139   63.211   5.4943   60.785   5.2408 2.425968 7.593021 
1 1 1   19   15   31 o   33.296   6.0711   25.589   8.3643   24.346   12.658   26.553   11.144   32.464   9.0920   34.127   8.0478 -1.663124 12.14212 
1 1 1   19   15   32 o   56.036   4.4781   69.374   9.9958   59.975   15.622   75.890   13.007   52.366   7.2329   59.707   5.2819 -7.340973 8.956246 
1 1 1   19   15   33 o   50.458   4.9561   55.473   10.280   53.061   13.879   58.404   15.301   49.324   6.8226   51.592   7.1905 -2.268410 9.912204 
1 1 1   19   15   34 o   52.556   4.5523   60.144   9.8370   63.314   14.620   57.522   13.297   53.743   6.5958   51.370   6.2760 2.372894 9.104529 
1 1 1   19   15   35 o   33.197   6.2380   26.436   8.7058   24.431   12.468   28.342   12.161   31.885   9.0567   34.510   8.5806 -2.625219 12.47594 
1 1 1   19   15   36 o   36.540   5.8768   32.842   9.1288   19.256   13.393   44.631   12.476   28.371   9.6110   44.708   6.7657 -16.33652 11.75357 
1 1 1   19   15   37 o   71.609   5.2088  113.439   13.730  109.458   16.072  124.191   26.411   70.836   5.5011   72.382   8.8467 -1.545822 10.41759 
1 1 1   19   15   38 o   71.839   5.9415  100.042   15.104   81.471   16.915  173.102   33.550   59.980   6.8375   83.698   9.7187 -23.71748 11.88291 
1 1 1   19   15   39 o   61.366   7.6682  100.367   16.754  102.218   19.920   95.889   30.976   66.346   7.2795   56.387   13.499 9.959435 15.33649 
1 1 1   19   15   40 o   36.073   8.3532   40.344   14.394   43.354   16.250   29.379   31.018   40.443   9.8365   31.702   13.504 8.741098 16.70647 
1 1 1   19   15   41 o   21.259   7.0008  -1.1449   12.517  -0.7205   14.032  -2.7984   27.694   18.848   8.5060   23.670   11.122 -4.821676 14.00170 
1 1 1   19   16    0 o   8.7155   4.2395  -5.1543   7.0691  -5.1543   7.0691  -5.1543   7.0691   8.7155   5.9956   8.7155   5.9956 0.000000 0.000000 
1 1 1   19   16    1 o   70.975   2.4685  104.089   7.2259  103.940   10.197  104.239   10.241   70.924   3.4858   71.026   3.4961 -0.1017609 4.936948 
1 1 1   19   16    2 o  123.886   2.1045  317.024   10.751  311.488   15.253  322.491   15.157  122.809   3.0114  124.964   2.9407 -2.154526 4.209097 
1 1 1   19   16    3 o  127.814   2.4112  337.439   12.707  333.666   17.731  341.424   18.221  127.081   3.3828  128.546   3.4368 -1.465103 4.822365 
1 1 1   19   16    4 o   47.855   3.5223   47.416   6.9516   46.638   9.7891   48.208   9.8735   47.458   5.0011   48.252   4.9612 -0.7939835 7.044501 
1 1 1   19   16    5 o   55.794   3.2465   64.512   7.4529   69.793   10.556   59.261   10.524   58.082   4.4063   53.506   4.7690 4.576199 6.493038 
1 1 1   19   16    6 o  146.277   2.2598  442.085   13.517  441.420   20.494  442.597   17.982  146.163   3.3996  146.391   2.9783 -0.2276917 4.519679 
1 1 1   19   16    7 o   37.950   3.7759   29.813   5.9063   30.742   8.5456   28.964   8.1726   38.514   5.3796   37.387   5.3000 1.127750 7.551856 
1 1 1   19   16    8 o  113.393   2.6925  267.496   11.399  261.916   21.136  269.784   13.536  112.491   4.5556  114.294   2.8715 -1.803070 5.385099 
1 1 1   19   16    9 o  124.845   2.6420  320.028   12.368  327.539   23.021  316.980   14.664  125.803   4.4367  123.887   2.8700 1.916183 5.284030 
1 1 1   19   16   10 o   92.693   2.5112  175.072   9.3376  188.213   15.315  167.297   11.781   95.401   3.8922   89.986   3.1741 5.415047 5.022427 
1 1 1   19   16   11 o  273.079   2.7056  1543.75   30.171  1529.95   45.916  1554.23   40.024  271.950   4.0936  274.209   3.5389 -2.258392 5.411271 
1 1 1   19   16   12 o   99.991   2.4788  206.474   9.9382  207.570   16.080  205.796   12.642  100.177   3.8918   99.804   3.0711 0.3729782 4.957618 
1 1 1   19   16   13 o  185.258   2.4078  701.920   18.005  745.476   28.952  674.453   22.991  189.854   3.6974  180.663   3.0855 9.190643 4.815695 
1 1 1   19   16   14 o  102.677   2.7556  221.458   10.783  209.426   19.112  227.077   13.060  100.529   4.6095  104.825   3.0208 -4.296043 5.511126 
1 1 1   19   16   15 o   40.015   4.6383   30.372   7.1242   41.916   13.392   25.815   8.4136   44.795   7.2483   35.235   5.7894 9.559883 9.276566 
1 1 1   19   16   16 o   50.675   3.7542   53.597   7.4170   52.623   12.710   54.099   9.1336   50.261   6.1310   51.089   4.3345 -0.8280182 7.508470 
1 1 1   19   16   17 o   93.712   2.8008  182.131   10.799  178.742   15.751  185.136   14.833   92.872   4.1121   94.552   3.8036 -1.679787 5.601503 
1 1 1   19   16   18 o  109.524   2.8534  248.428   12.883  243.699   17.873  253.542   18.586  108.445   3.9960  110.603   4.0744 -2.157814 5.706877 
1 1 1   19   16   19 o  118.909   3.0807  294.105   14.853  296.596   19.359  290.540   23.160  119.598   3.9246  118.221   4.7499 1.377304 6.161465 
1 1 1   19   16   20 o   77.860   3.1487  127.184   9.9868  105.026   14.185  148.961   14.063   71.017   4.8428   84.704   4.0253 -13.68675 6.297317 
1 1 1   19   16   21 o   25.914   6.0705   13.584   7.7488   8.9627   11.362   17.604   10.595   23.324   8.7414   28.503   8.4257 -5.178864 12.14099 
1 1 1   19   16   22 o   62.506   4.1890   82.033   10.798   83.165   15.415   80.942   15.131   62.927   5.9394   62.086   5.9088 0.8409920 8.377982 
1 1 1   19   16   23 o   48.189   4.6219   50.546   8.6898   37.421   12.322   63.532   12.256   41.341   7.5030   55.037   5.3994 -13.69608 9.243817 
1 1 1   19   16   24 o   63.172   3.5243   83.169   9.1610   91.388   13.409   75.975   12.545   66.099   4.9187   60.245   5.0487 5.853977 7.048587 
1 1 1   19   16   25 o   76.100   3.2155  121.159   10.061  120.969   14.815  121.321   13.707   76.002   4.7262   76.199   4.3614 -0.1970901 6.431101 
1 1 1   19   16   26 o   27.729   6.1957   16.826   7.9511   15.356   11.516   18.164   10.992   26.857   8.9101   28.601   8.6113 -1.743481 12.39132 
1 1 1   19   16   27 o   60.308   4.8315   78.374   10.705   76.915   20.264   78.939   12.608   59.385   8.2735   61.231   4.9923 -1.846092 9.663005 
1 1 1   19   16   28 o   65.675   3.7214   91.721   9.9773   77.605   14.196  105.499   14.025   60.517   5.6876   70.833   4.8008 -10.31612 7.442869 
1 1 1   19   16   29 o   41.062   6.4760   37.996   10.223   36.461   12.518   41.071   17.713   40.315   7.8107   41.808   10.332 -1.493786 12.95201 
1 1 1   19   16   30 o   29.570   6.5875   19.261   9.1374   25.447   13.378   13.852   12.511   33.126   9.3713   26.014   9.2607 7.112011 13.17503 
1 1 1   19   16   31 o   67.862   3.9198   98.521   10.752   96.813   16.873   99.688   13.952   67.129   6.0941   68.595   4.9316 -1.465752 7.839557 
1 1 1   19   16   32 f   22.773   5.9244   8.6043   7.9651  -0.4729   11.796   16.211   10.798   18.671   8.1413   26.875   8.6089 -8.204069 11.84882 
1 1 1   19   16   33 o   23.223   6.0280   5.0875   8.7761   21.864   13.215  -8.1501   11.738   30.437   9.4953   16.010   7.4288 14.42745 12.05602 
1 1 1   19   16   34 o   32.642   6.0876   24.570   8.6435   35.911   12.886   15.295   11.654   39.163   8.2390   26.120   8.9641 13.04240 12.17523 
1 1 1   19   16   35 o   37.389   6.0559   33.261   9.0937   35.166   13.678   31.752   12.174   38.200   8.8541   36.577   8.2645 1.623173 12.11183 
1 1 1   19   16   36 o   34.155   7.6025   26.585   10.577   40.060   21.826   22.449   12.092   38.067   12.244   30.242   9.0153 7.825651 15.20503 
1 1 1   19   16   37 o   53.000   7.7691   73.440   16.689   84.277   23.148   61.708   24.083   58.798   9.5451   47.201   12.261 11.59731 15.53812 
1 1 1   19   16   38 o   33.105   7.5802   29.990   11.461   31.520   13.318   25.623   22.503   35.233   9.1009   30.977   12.125 4.256685 15.16041 
1 1 1   19   16   39 o   39.749   8.7943   42.294   14.322   36.148   16.441   61.636   29.165   36.485   10.412   43.013   14.175 -6.528831 17.58868 
1 1 1   19   16   40 o   23.472   7.4284   0.3523   12.306  -6.6581   13.966   24.695   26.025   17.256   8.0392   29.688   12.494 -12.43231 14.85685 
1 1 1   19   16   41 o   26.676   7.9071   16.798   12.945   16.238   14.509   18.984   28.657   25.403   9.7931   27.950   12.417 -2.547300 15.81421 
1 1 1   19   17    0 o   77.008   2.3889  123.119   10.684  123.119   10.684  123.119   10.684   77.008   3.3785   77.008   3.3785 0.000000 0.000000 
1 1 1   19   17    1 o  192.167   2.1809  762.742   17.285  757.389   24.324  768.201   24.568  191.486   3.0798  192.847   3.0888 -1.361038 4.361856 
1 1 1   19   17    2 o  213.798   2.2508  944.294   19.848  943.848   28.060  944.740   28.079  213.748   3.1828  213.849   3.1835 -0.1008453 4.501653 
1 1 1   19   17    3 o  117.324   2.3213  284.364   11.129  284.125   14.766  284.677   16.932  117.282   3.0526  117.366   3.4979 -0.8393097E-01 4.642591 
1 1 1   19   17    4 o  273.119   2.6808  1541.48   29.879  1537.14   39.466  1547.31   45.736  272.719   3.5087  273.519   4.0542 -0.8005066 5.361627 
1 1 1   19   17    5 o  330.834   2.7576  2262.97   37.622  2282.41   53.739  2244.28   52.689  332.222   3.9219  329.445   3.8777 2.776611 5.515213 
1 1 1   19   17    6 o  128.945   2.1172  343.382   11.259  347.603   16.063  339.305   15.785  129.723   3.0023  128.167   2.9862 1.556580 4.234489 
1 1 1   19   17    7 o  279.246   2.7075  1614.19   30.932  1598.24   46.683  1626.67   41.299  277.966   4.0720  280.526   3.5695 -2.560242 5.414987 
1 1 1   19   17    8 o  109.605   2.7343  248.812   11.283  247.487   20.709  249.372   13.455  109.335   4.5924  109.875   2.9690 -0.5404892 5.468596 
1 1 1   19   17    9 o   35.483   4.8420   30.063   6.4620   17.269   10.783   37.233   8.0720   28.561   8.5134   42.405   4.6153 -13.84333 9.683981 
1 1 1   19   17   10 o  129.174   2.3683  347.245   12.405  331.160   19.152  358.868   16.281  126.551   3.6694  131.798   2.9951 -5.247086 4.736553 
1 1 1   19   17   11 o  174.005   2.4900  626.291   17.854  593.748   25.175  659.222   25.325  169.445   3.6022  178.565   3.4386 -9.120224 4.979946 
1 1 1   19   17   12 o   85.725   2.8617  157.157   9.7847  119.972   14.527  188.031   13.238   76.087   4.6293   95.364   3.3656 -19.27725 5.723391 
1 1 1   19   17   13 o  132.824   2.3618  368.993   12.618  344.613   19.836  385.564   16.353  129.053   3.7266  136.596   2.9026 -7.542877 4.723603 
1 1 1   19   17   14 o   81.751   2.7461  138.001   8.8800  139.660   14.872  137.082   11.070   82.087   4.3927   81.415   3.2967 0.6718140 5.492157 
1 1 1   19   17   15 o   29.022   5.5957   19.029   6.5968   13.834   12.519   21.026   7.7620   26.825   9.2860   31.219   6.2463 -4.393923 11.19130 
1 1 1   19   17   16 o   50.690   4.1021   56.847   7.6448   45.746   13.717   61.847   9.2071   46.751   7.1140   54.629   4.0863 -7.878483 8.204114 
1 1 1   19   17   17 o  166.213   2.8147  570.863   19.099  560.703   25.170  584.652   29.324  164.531   3.7091  167.896   4.2346 -3.365601 5.629382 
1 1 1   19   17   18 o   97.099   2.8113  196.956   11.163  182.700   16.525  208.925   15.141   93.799   4.2715  100.398   3.6564 -6.598953 5.622676 
1 1 1   19   17   19 o   87.340   3.4507  160.667   12.126  167.740   15.729  150.301   19.040   89.843   4.2446   84.836   5.4417 5.007019 6.901343 
1 1 1   19   17   20 o  120.761   2.5751  302.658   12.824  299.898   18.231  305.361   18.043  120.209   3.6772  121.313   3.6060 -1.104805 5.150221 
1 1 1   19   17   21 o   92.130   2.8704  176.681   10.879  175.135   15.932  178.032   14.890   91.721   4.2116   92.538   3.9013 -0.8171539 5.740833 
1 1 1   19   17   22 o   37.631   6.2954   31.730   9.6327   34.473   13.617   28.983   13.628   39.326   8.6323   35.936   9.1657 3.389889 12.59075 
1 1 1   19   17   23 o   35.881   5.4394   25.355   8.9473   4.7799   11.738   53.888   13.823   21.298   8.6163   50.464   6.6414 -29.16566 10.87879 
1 1 1   19   17   24 o   44.770   4.5060   41.925   8.2619   48.051   12.605   37.312   10.939   47.587   6.4224   41.952   6.3221 5.634766 9.012015 
1 1 1   19   17   25 o   55.545   3.9684   66.224   8.9438   55.574   13.062   75.625   12.272   51.126   6.1942   59.964   4.9622 -8.837788 7.936711 
1 1 1   19   17   26 o   32.519   5.9541   24.398   8.1926   18.145   12.256   29.450   11.015   28.729   9.1682   36.309   7.5994 -7.580223 11.90827 
1 1 1   19   17   27 o   61.391   5.1481   80.979   12.540   82.186   20.799   80.289   15.718   61.386   8.2149   61.396   6.2070 -0.9178162E-02 10.29620 
1 1 1   19   17   28 o   55.014   4.3251   65.168   9.7124   57.437   14.149   72.056   13.356   51.739   6.6305   58.289   5.5555 -6.550068 8.650229 
1 1 1   19   17   29 o   60.747   5.3314   87.614   11.753  104.220   14.942   60.665   19.034   70.127   5.1660   51.367   9.3278 18.75964 10.66277 
1 1 1   19   17   30 f   56.281   4.2077   67.917   9.6417   67.446   14.821   68.263   12.696   55.938   6.4239   56.624   5.4361 -0.6864853 8.415308 
1 1 1   19   17   31 o   75.578   3.8655  122.263   11.590  120.996   19.119  123.000   14.572   74.900   6.1890   76.256   4.6332 -1.356300 7.731081 
1 1 1   19   17   32 o   58.267   4.1460   73.015   9.9265   82.223   14.448   64.783   13.661   61.821   5.6664   54.714   6.0539 7.106915 8.292024 
1 1 1   19   17   33 o   26.656   6.7024   16.054   9.9376  -3.9044   20.499   22.186   11.362   22.699   10.259   30.613   8.6281 -7.913582 13.40489 
1 1 1   19   17   34 o   68.459   4.0961  101.544   11.537   96.422   15.657  107.629   17.065   66.636   5.6968   70.282   5.8871 -3.646049 8.192169 
1 1 1   19   17   35 o   45.696   4.9628   47.073   9.3331   47.258   13.648   46.910   12.792   45.650   7.2487   45.741   6.7804 -0.9175491E-01 9.925601 
1 1 1   19   17   36 o   38.875   7.5445   39.984   11.774   41.130   13.690   36.726   23.073   41.462   8.2952   36.288   12.604 5.173622 15.08893 
1 1 1   19   17   37 f   25.516   7.8079   8.2646   15.227   2.0544   21.184   14.902   21.901   23.582   10.562   27.449   11.502 -3.867870 15.61578 
1 1 1   19   17   38 o   27.575   6.7166   17.203   11.992   33.288   14.610 -16.0108   20.994   35.659   9.6839   19.491   9.3098 16.16796 13.43317 
1 1 1   19   17   39 o   29.554   7.4907   24.269   13.601   35.544   16.207  -2.5752   25.008   35.844   10.371   23.264   10.811 12.58035 14.98146 
1 1 1   19   17   40 o   27.444   8.0099   18.100   13.155   15.694   15.103   25.664   26.777   25.287   9.9231   29.602   12.576 -4.314913 16.01971 
1 1 1   19   18    0 o   50.104   3.0843   53.026   8.8568   53.026   8.8568   53.026   8.8568   50.104   4.3619   50.104   4.3619 0.000000 0.000000 
1 1 1   19   18    1 f  167.607   2.1228  580.219   14.674  587.039   20.891  573.578   20.615  168.579   3.0046  166.636   2.9995 1.943542 4.245589 
1 1 1   19   18    2 o   30.607   4.5530   20.084   5.6998   27.062   8.1391   13.367   7.9847   36.126   5.4626   25.088   7.2855 11.03761 9.105974 
1 1 1   19   18    3 o   47.489   3.3444   46.133   6.5100   41.343   8.6520   52.384   9.8834   44.683   4.6947   50.294   4.7645 -5.610874 6.688843 
1 1 1   19   18    4 o  152.994   2.2891  483.542   14.293  482.874   18.889  484.436   21.862  152.892   2.9955  153.096   3.4622 -0.2039337 4.578221 
1 1 1   19   18    5 o   74.389   2.4482  114.391   7.5098  111.454   10.610  117.339   10.631   73.430   3.5033   75.348   3.4208 -1.917931 4.896486 
1 1 1   19   18    6 o  196.068   2.2042  794.098   17.822  783.623   24.958  804.997   25.458  194.750   3.1072  197.386   3.1272 -2.635712 4.408397 
1 1 1   19   18    7 o  133.460   2.6440  373.316   13.290  356.055   24.113  380.846   15.927  131.135   4.4583  135.785   2.8439 -4.650040 5.288098 
1 1 1   19   18    8 o  194.177   2.6770  780.542   19.591  778.390   35.914  781.453   23.374  193.866   4.4916  194.488   2.9139 -0.6215210 5.354014 
1 1 1   19   18    9 o  199.585   2.4231  827.672   19.791  786.964   29.471  861.110   26.711  195.056   3.6633  204.114   3.1728 -9.058243 4.846278 
1 1 1   19   18   10 o   56.419   3.2840   65.792   7.3204   66.612   12.292   65.341   9.1127   56.650   5.2608   56.188   3.9322 0.4626312 6.568007 
1 1 1   19   18   11 o  191.138   2.3534  759.131   18.171  736.773   28.533  774.385   23.568  188.704   3.6661  193.573   2.9520 -4.869171 4.706851 
1 1 1   19   18   12 o   43.313   3.9617   39.032   6.7465   38.928   11.404   39.088   8.3679   43.215   6.3983   43.412   4.6735 -0.1970253 7.923337 
1 1 1   19   18   13 o  229.349   2.4703  1087.40   22.698  1092.99   36.803  1083.97   28.834  229.731   3.8841  228.966   3.0533 0.7650757 4.940589 
1 1 1   19   18   14 o  151.465   2.3952  475.934   14.718  467.721   22.880  481.731   19.224  150.300   3.6909  152.630   3.0538 -2.330231 4.790455 
1 1 1   19   18   15 o   87.868   3.0673  173.234   10.016  126.400   17.084  197.761   12.364   77.951   5.3138   97.786   3.0655 -19.83422 6.134675 
1 1 1   19   18   16 o   89.550   2.9020  166.920   9.8963  164.908   17.764  167.826   11.917   89.054   4.8363   90.047   3.2087 -0.9929962 5.803925 
1 1 1   19   18   17 o  145.791   2.6907  440.427   16.162  470.473   23.252  412.341   22.480  150.610   3.7431  140.971   3.8664 9.638504 5.381444 
1 1 1   19   18   18 o   65.401   3.4827   88.256   9.3452  101.030   14.013   78.024   12.541   69.626   4.8797   61.176   4.9705 8.450756 6.965429 
1 1 1   19   18   19 o   65.787   4.0443   93.620   10.535  104.240   13.659   78.020   16.554   70.715   4.6831   60.859   6.5949 9.856239 8.088548 
1 1 1   19   18   20 o   32.523   5.5974   23.067   7.5018   29.566   11.134   17.664   10.152   36.646   7.6150   28.400   8.2058 8.246128 11.19480 
1 1 1   19   18   21 o   38.137   5.5302   32.070   8.3110   29.878   13.440   33.427   10.575   36.503   8.9873   39.772   6.4467 -3.269676 11.06037 
1 1 1   19   18   22 o   47.320   4.9228   47.452   9.2749   38.187   12.434   59.074   13.926   41.760   7.4944   52.880   6.3852 -11.12017 9.845595 
1 1 1   19   18   23 o   23.770   6.2439   9.4437   8.1905   6.1368   10.923   13.691   12.379   21.333   8.4173   26.208   9.2246 -4.874893 12.48776 
1 1 1   19   18   24 o  113.528   2.9831  270.704   13.800  277.175   18.291  262.155   21.025  115.245   3.8482  111.812   4.5591 3.432953 5.966100 
1 1 1   19   18   25 o   37.523   5.4636   29.070   8.2974   46.394   13.364   18.202   10.585   46.490   6.9697   28.555   8.4158 17.93417 10.92715 
1 1 1   19   18   26 o   94.817   3.5219  190.160   13.349  192.884   16.992  185.770   21.575   95.961   4.2932   93.674   5.5842 2.286545 7.043775 
1 1 1   19   18   27 o   39.989   6.7246   36.420   10.005   37.389   19.378   36.068   11.682   39.666   11.299   40.312   7.2950 -0.6462631 13.44915 
1 1 1   19   18   28 o   38.824   6.4411   36.218   10.290   42.521   13.057   25.888   16.717   44.249   7.1544   33.399   10.713 10.85019 12.88218 
1 1 1   19   18   29 f   32.943   6.1331   25.788   8.5354   19.596   13.480   29.932   11.027   29.497   9.6334   36.388   7.5931 -6.890667 12.26611 
1 1 1   19   18   30 o   80.138   5.2573  136.465   16.893  161.698   28.117  122.210   21.133   85.358   7.9865   74.918   6.8391 10.44057 10.51464 
1 1 1   19   18   31 o   21.165   6.0321   5.6627   8.2872   0.6626   12.513   9.5693   11.061   19.544   8.4538   22.787   8.6070 -3.243244 12.06428 
1 1 1   19   18   32 o   64.090   5.0218   95.233   12.163  104.173   15.037   78.310   20.687   69.670   5.2330   58.510   8.5726 11.16031 10.04356 
1 1 1   19   18   33 o   30.500   5.4781   22.036   8.4139   3.0186   12.854   36.294   11.130   20.457   8.7028   40.543   6.6559 -20.08551 10.95625 
1 1 1   19   18   34 o   22.924   6.2629   8.9145   8.7587   2.2681   12.271   15.817   12.505   19.609   8.4264   26.240   9.2676 -6.630676 12.52571 
1 1 1   19   18   35 o   20.691   5.9233   2.7501   8.4241   14.572   12.740  -6.4343   11.229   25.529   9.3115   15.852   7.3238 9.677602 11.84664 
1 1 1   19   18   36 o   63.137   5.7259   94.361   13.075   95.711   15.393   90.862   24.777   65.926   5.6612   60.349   9.9546 5.577724 11.45175 
1 1 1   19   18   37 f   25.833   7.5220   6.7167   14.589   29.297   20.757 -15.3283   20.509   32.276   11.868   19.389   9.2448 12.88662 15.04397 
1 1 1   19   18   38 o   18.426   6.2054 -10.9798   12.031  -7.4859   14.181 -19.9530   22.726   17.326   8.0817   19.525   9.4188 -2.198259 12.41079 
1 1 1   19   18   39 o   24.007   7.3848   9.7124   12.936   11.259   15.192   5.6335   24.674   23.515   9.6920   24.500   11.145 -0.9850559 14.76963 
1 1 1   19   18   40 o   34.263   8.5513   36.736   14.264   35.945   16.348   39.260   29.196   35.369   10.469   33.157   13.524 2.211372 17.10259 
1 1 1   19   19    0 o  132.794   2.3742  364.778   18.363  364.778   18.363  364.778   18.363  132.794   3.3577  132.794   3.3577 0.000000 0.000000 
1 1 1   19   19    1 o  206.726   2.2317  882.853   19.024  869.627   26.574  896.757   27.247  205.141   3.1408  208.312   3.1713 -3.171097 4.463419 
1 1 1   19   19    2 o   72.646   2.4871  109.109   7.4514  110.826   10.581  107.421   10.495   73.214   3.5042   72.079   3.5303 1.135040 4.974138 
1 1 1   19   19    3 o  157.151   2.2873  510.226   14.670  508.994   19.383  511.878   22.446  156.954   2.9942  157.348   3.4587 -0.3936768 4.574679 
1 1 1   19   19    4 o   87.960   2.7464  160.983   9.9024  143.001   14.177  178.115   13.838   83.117   4.1354   92.803   3.6153 -9.685791 5.492829 
1 1 1   19   19    5 o  235.743   2.3397  1148.60   22.746  1133.28   31.824  1164.59   32.522  234.139   3.2955  237.347   3.3222 -3.207825 4.679470 
1 1 1   19   19    6 o   63.749   3.5404   87.283   8.1616   77.977   15.530   90.835   9.5933   61.225   6.1499   66.274   3.5096 -5.048809 7.080848 
1 1 1   19   19    7 o  206.915   2.7165  886.406   21.166  885.046   38.868  886.980   25.235  206.654   4.5601  207.176   2.9533 -0.5217438 5.432932 
1 1 1   19   19    8 o  181.168   2.3770  681.598   17.564  658.461   26.666  699.327   23.342  178.400   3.6241  183.936   3.0769 -5.535660 4.754057 
1 1 1   19   19    9 o  174.520   2.3117  630.024   16.204  628.960   26.055  630.695   20.692  174.344   3.6233  174.695   2.8718 -0.3502197 4.623410 
1 1 1   19   19   10 o  140.393   2.3514  407.909   13.380  406.557   20.944  408.841   17.391  140.157   3.6231  140.629   2.9984 -0.4725189 4.702879 
1 1 1   19   19   11 o  104.142   2.4515  222.339   10.200  232.726   16.813  216.290   12.831  106.007   3.8454  102.276   3.0418 3.731140 4.902996 
1 1 1   19   19   12 o  159.104   2.3118  520.430   14.703  536.737   24.124  510.792   18.546  161.017   3.6325  157.192   2.8606 3.824280 4.623621 
1 1 1   19   19   13 o  122.843   2.4216  314.798   12.036  298.786   18.684  326.156   15.736  120.104   3.7718  125.581   3.0382 -5.477158 4.843276 
1 1 1   19   19   14 o   26.847   5.5293   15.497   6.2467   14.410   11.079   16.004   7.5637   26.578   8.7357   27.117   6.7807 -0.5387344 11.05852 
1 1 1   19   19   15 o   81.111   2.7733  139.331   8.8744  126.198   14.495  147.206   11.224   77.911   4.5109   84.312   3.2276 -6.401642 5.546682 
1 1 1   19   19   16 o  177.259   2.7290  645.364   18.808  672.424   32.890  632.216   22.926  179.809   4.4349  174.709   3.1816 5.100311 5.458092 
1 1 1   19   19   17 f   56.107   3.7132   67.496   7.6605   61.833   14.279   69.785   9.0775   54.238   6.3828   57.975   3.7963 -3.736546 7.426453 
1 1 1   19   19   18 o   89.455   3.3175  167.520   12.045  170.415   15.775  163.472   18.652   90.481   4.2271   88.428   5.1142 2.052704 6.634997 
1 1 1   19   19   19 o   23.928   5.6681   9.1504   7.1064   19.822   10.993   1.4895   9.3143   29.964   8.5015   17.892   7.4990 12.07256 11.33626 
1 1 1   19   19   20 o   92.178   2.9110  176.758   11.020  155.342   15.272  200.019   15.916   86.321   4.2895   98.035   3.9364 -11.71336 5.821946 
1 1 1   19   19   21 o   35.139   6.4118   27.781   9.3596   26.582   13.491   28.893   12.995   34.394   9.2912   35.885   8.8386 -1.490803 12.82367 
1 1 1   19   19   22 o   59.787   3.9212   76.099   9.5119   71.268   14.550   79.704   12.570   57.976   6.0849   61.598   4.9475 -3.622093 7.842469 
1 1 1   19   19   23 f   16.778   5.2869  -5.6593   7.6532 -12.3774   10.440   2.1438   11.252   13.964   6.6407   19.592   8.2284 -5.627299 10.57378 
1 1 1   19   19   24 o   37.985   5.2933   32.171   7.9695   31.410   11.787   32.812   10.817   37.425   7.8848   38.545   7.0643 -1.119919 10.58653 
1 1 1   19   19   25 o   37.939   5.2882   31.398   8.0859   40.965   11.952   23.325   10.980   43.761   6.6223   32.117   8.2464 11.64382 10.57630 
1 1 1   19   19   26 o   63.941   3.8746   90.623   9.6675   60.419   14.120  117.275   13.264   53.111   6.4459   74.770   4.3011 -21.65945 7.749143 
1 1 1   19   19   27 o   70.873   4.4536  108.285   12.091  106.527   21.350  109.115   14.671   69.913   7.4040   71.833   4.9517 -1.919830 8.907201 
1 1 1   19   19   28 o   60.077   4.7041   76.190   11.329   70.688   14.225   85.734   18.734   57.435   6.0051   62.719   7.2423 -5.283943 9.408113 
1 1 1   19   19   29 o   34.324   5.9332   26.724   8.3852   34.509   12.624   20.579   11.217   38.790   8.1500   29.859   8.6248 8.930826 11.86636 
1 1 1   19   19   30 o   27.004   5.9833   16.556   8.3870   2.8334   13.542   25.094   10.682   21.051   8.9437   32.956   7.9504 -11.90499 11.96657 
1 1 1   19   19   31 o   40.273   5.7162   37.024   9.1140   44.106   13.910   31.698   12.064   43.708   8.0117   36.839   8.1555 6.868797 11.43236 
1 1 1   19   19   32 o  108.196   3.0113  248.473   13.393  246.538   19.712  250.132   18.253  107.674   4.4387  108.718   4.0706 -1.043373 6.022572 
1 1 1   19   19   33 o   29.153   6.4402   20.629   8.5779   19.731   12.976   21.326   11.432   28.616   9.4565   29.691   8.7451 -1.074739 12.88031 
1 1 1   19   19   34 o   45.364   5.7101   49.846   10.100   63.156   13.895   34.932   14.708   53.348   6.3150   37.381   9.5154 15.96664 11.42024 
1 1 1   19   19   35 o   26.262   7.2670   14.822   10.717   16.172   12.345   10.691   21.596   26.203   9.2128   26.322   11.241 -0.1182518 14.53393 
1 1 1   19   19   36 o   35.336   7.5164   33.379   11.148   33.044   12.992   34.314   21.713   36.284   8.7770   34.388   12.205 1.896156 15.03284 
1 1 1   19   19   37 o   22.152   7.3762  -8.8956   17.270 -27.9763   30.835  -0.1740   20.847   21.780   10.614   22.525   10.246 -0.7453728 14.75234 
1 1 1   19   19   38 f   48.941   8.0189   62.453   14.347   54.622   16.635   85.200   28.350   45.985   9.0929   51.896   13.211 -5.910847 16.03781 
1 1 1   19   19   39 o   29.791   8.2076   22.889   12.712   18.529   14.470   37.630   26.609   26.505   9.8784   33.077   13.110 -6.571636 16.41529 
1 1 1   19   20    0 o  162.529   2.1321  545.913   20.197  545.913   20.197  545.913   20.197  162.529   3.0153  162.529   3.0153 0.000000 0.000000 
1 1 1   19   20    1 o  144.059   2.4531  428.928   14.538  387.984   20.240  472.560   20.894  136.949   3.5834  151.170   3.3512 -14.22102 4.906208 
1 1 1   19   20    2 o   20.883   4.9728   7.5591   5.6444   13.709   7.5856  -0.0706   8.4488   25.261   7.0255   16.506   7.0396 8.754738 9.945515 
1 1 1   19   20    3 o  118.531   2.3208  288.684   11.215  279.039   14.675  302.227   17.389  116.187   3.0623  120.876   3.4880 -4.689034 4.641502 
1 1 1   19   20    4 o   46.380   3.4408   44.562   6.5562   43.920   8.8602   45.340   9.7469   46.022   4.6678   46.737   5.0563 -0.7154274 6.881520 
1 1 1   19   20    5 o  135.245   2.2981  382.001   12.525  359.530   19.629  397.434   16.267  131.814   3.6105  138.677   2.8441 -6.863647 4.596119 
1 1 1   19   20    6 o  166.863   2.6416  566.625   16.362  598.729   31.205  554.452   19.216  169.936   4.4521  163.791   2.8445 6.145554 5.283211 
1 1 1   19   20    7 o  200.907   2.7038  836.295   20.352  834.564   37.689  837.007   24.180  200.589   4.5556  201.225   2.9134 -0.6366425 5.407550 
1 1 1   19   20    8 o   21.162   5.4401   7.8995   5.9074   5.2090   10.794   9.0500   7.0585   21.088   8.3525   21.236   6.9725 -0.1480904 10.88027 
1 1 1   19   20    9 o   43.299   3.9070   39.183   6.6245   38.447   11.245   39.574   8.1979   42.924   6.3519   43.674   4.5511 -0.7494278 7.814021 
1 1 1   19   20   10 o   42.498   4.4043   40.913   6.8256   30.919   11.516   46.326   8.4748   37.733   7.6610   47.262   4.3477 -9.528271 8.808654 
1 1 1   19   20   11 o   87.650   2.6391  160.663   9.1344  153.733   15.132  164.635   11.457   86.089   4.2617   89.210   3.1139 -3.121506 5.278123 
1 1 1   19   20   12 o  169.965   2.3354  601.365   15.978  582.700   25.332  613.697   20.590  167.686   3.6627  172.245   2.8984 -4.559021 4.670765 
1 1 1   19   20   13 o   76.392   2.7653  119.348   8.4137  127.710   14.039  114.660   10.510   78.395   4.3419   74.388   3.4257 4.006317 5.530618 
1 1 1   19   20   14 o  118.730   2.4090  291.970   11.482  293.042   18.509  291.299   14.639  118.839   3.7763  118.621   2.9923 0.2184372 4.818100 
1 1 1   19   20   15 o  170.071   2.3591  597.515   16.090  608.391   26.097  590.846   20.436  171.216   3.6956  168.927   2.9332 2.288818 4.718132 
1 1 1   19   20   16 o   23.349   5.8271   10.032   6.4997   11.021   12.191   9.6399   7.6826   24.842   9.1015   21.855   7.2790 2.986773 11.65425 
1 1 1   19   20   17 o  121.795   3.1264  309.264   15.704  310.790   22.353  307.776   22.068  122.086   4.4392  121.503   4.4036 0.5827866 6.252896 
1 1 1   19   20   18 o   24.662   6.4271   10.221   8.9016   15.610   12.340   4.3750   12.853   27.468   9.2258   21.857   8.9507 5.610609 12.85422 
1 1 1   19   20   19 o   69.873   3.2695  102.521   9.3451   96.830   13.902  107.213   12.623   68.029   4.9546   71.717   4.2674 -3.687752 6.539030 
1 1 1   19   20   20 o   38.195   5.6108   35.225   8.4078   20.749   13.743   43.885   10.629   30.752   9.6972   45.638   5.6469 -14.88636 11.22156 
1 1 1   19   20   21 o   68.715   3.3009  100.026   9.2556   89.810   13.641  108.742   12.599   65.328   5.0628   72.101   4.2368 -6.773079 6.601707 
1 1 1   19   20   22 o   22.410   5.9001   8.7277   7.3837   5.8372   10.791   11.272   10.125   21.021   8.3435   23.798   8.3446 -2.777742 11.80027 
1 1 1   19   20   23 o   49.502   5.7041   50.920   11.270   63.284   19.094   44.310   13.962   53.718   8.6180   45.285   7.4751 8.432693 11.40821 
1 1 1   19   20   24 o   39.117   5.7374   34.546   8.9240   36.267   12.127   32.513   13.179   40.393   7.5572   37.841   8.6347 2.551762 11.47472 
1 1 1   19   20   25 o   50.825   4.1702   56.178   8.5376   44.648   12.443   66.435   11.736   45.581   6.6187   56.069   5.0750 -10.48841 8.340417 
1 1 1   19   20   26 o   54.768   4.0221   64.461   9.0004   56.540   13.014   71.723   12.461   51.368   6.1426   58.168   5.1941 -6.799820 8.044250 
1 1 1   19   20   27 o   47.016   6.2222   53.956   10.372   41.686   19.307   58.934   12.298   41.492   11.075   52.540   5.6750 -11.04748 12.44434 
1 1 1   19   20   28 o   85.712   3.2799  156.975   11.431  128.609   16.280  184.555   16.053   77.784   5.0747   93.640   4.1566 -15.85583 6.559701 
1 1 1   19   20   29 o   56.931   4.2375   72.057   9.5811   52.835   13.963   89.163   13.172   49.123   6.8915   64.738   4.9330 -15.61531 8.475059 
1 1 1   19   20   30 o   27.958   5.9748   18.360   8.5817   3.2915   13.721   28.041   10.998   21.180   9.0006   34.736   7.8603 -13.55565 11.94968 
1 1 1   19   20   31 o   77.709   3.6444  129.352   11.649  134.914   17.242  124.682   15.801   79.163   5.2807   76.254   5.0239 2.908501 7.288728 
1 1 1   19   20   32 o   45.458   5.1747   47.495   9.3243   44.748   14.143   49.606   12.401   43.551   8.1736   47.364   6.3484 -3.812145 10.34938 
1 1 1   19   20   33 o   36.197   5.9999   32.098   8.8593   26.421   12.934   37.114   12.159   32.648   9.2073   39.746   7.6954 -7.097889 11.99971 
1 1 1   19   20   34 o   21.292   6.0263   6.1624   8.3607   13.233   12.063  -0.3732   11.598   24.521   9.0430   18.063   7.9680 6.458553 12.05260 
1 1 1   19   20   35 o   33.061   9.4048   21.443   12.033   18.567   12.492   58.420   44.795   27.339   9.2819   38.783   16.360 -11.44415 18.80961 
1 1 1   19   20   36 o   26.623   7.4322   15.231   11.100   12.604   13.110   21.883   20.860   24.043   9.2976   29.203   11.597 -5.160797 14.86431 
1 1 1   19   20   37 f   26.228   8.2760   10.947   17.026   15.573   30.990   8.9474   20.377   28.091   12.662   24.365   10.660 3.726149 16.55201 
1 1 1   19   20   38 o   25.508   7.5574   14.742   12.760   15.425   15.119   13.051   23.788   25.134   9.9073   25.883   11.415 -0.7499962 15.11481 
1 1 1   19   21    0 o  316.722   2.6865  2073.87   49.614  2073.87   49.614  2073.87   49.614  316.722   3.7992  316.722   3.7992 0.000000 0.000000 
1 1 1   19   21    1 o  213.413   2.6035  942.465   22.909  909.267   32.042  977.182   32.767  209.565   3.7071  217.262   3.6566 -7.697021 5.207096 
1 1 1   19   21    2 o  177.195   2.3303  648.565   16.835  643.186   22.149  655.923   25.907  176.367   3.0449  178.023   3.5284 -1.656006 4.660578 
1 1 1   19   21    3 o  127.567   2.2989  335.308   11.955  328.240   15.680  345.125   18.478  125.995   3.0174  129.140   3.4691 -3.144981 4.597745 
1 1 1   19   21    4 o   22.720   5.4174   8.5327   5.8470   15.457   10.240   5.1831   7.1221   27.090   8.3434   18.349   6.9122 8.740927 10.83470 
1 1 1   19   21    5 o  182.176   2.6649  689.675   18.286  681.396   33.471  693.197   21.832  181.237   4.4778  183.115   2.8907 -1.877914 5.329787 
1 1 1   19   21    6 f  114.205   2.7510  273.315   11.680  262.928   21.704  277.550   13.858  112.545   4.6758  115.865   2.9000 -3.320290 5.502049 
1 1 1   19   21    7 o  100.614   2.4583  209.623   9.8847  209.247   16.100  209.851   12.523  100.494   3.8842  100.733   3.0141 -0.2387924 4.916541 
1 1 1   19   21    8 o   72.287   2.8637  112.169   8.1374   93.924   13.054  123.763   10.407   67.240   4.7071   77.333   3.2627 -10.09216 5.727328 
1 1 1   19   21    9 o  114.115   2.4406  272.473   11.229  255.688   17.556  284.094   14.607  111.052   3.8328  117.177   3.0224 -6.124245 4.881164 
1 1 1   19   21   10 f  173.364   2.3227  618.265   16.110  639.518   26.391  605.643   20.338  175.637   3.6432  171.090   2.8822 4.547150 4.645399 
1 1 1   19   21   11 o   83.996   2.6268  146.217   8.7598  146.831   14.517  145.866   10.985   84.069   4.1869   83.924   3.1735 0.1452103 5.253677 
1 1 1   19   21   12 o  147.327   2.3311  452.245   13.801  438.475   21.985  461.198   17.728  145.383   3.6665  149.272   2.8795 -3.889191 4.662117 
1 1 1   19   21   13 o  102.151   2.6110  215.764   10.933  223.772   16.522  209.525   14.582  103.801   3.8592  100.502   3.5179 3.298889 5.221971 
1 1 1   19   21   14 o  119.749   2.6627  298.124   12.136  297.268   21.853  298.506   14.593  119.456   4.4354  120.043   2.9475 -0.5864410 5.325426 
1 1 1   19   21   15 o   37.268   4.8288   30.883   6.7465   27.156   11.654   32.761   8.2738   34.963   8.2203   39.572   5.0693 -4.609276 9.657650 
1 1 1   19   21   16 o   61.876   3.1642   80.330   7.6772   78.448   12.975   81.344   9.5230   61.199   5.1405   62.553   3.6912 -1.353458 6.328414 
1 1 1   19   21   17 o   73.529   3.8303  112.984   11.580  101.314   15.888  126.209   16.914   69.464   5.5456   77.593   5.2850 -8.129707 7.660645 
1 1 1   19   21   18 o   68.321   3.6031   99.501   9.8923   89.408   15.373  106.634   12.924   65.169   5.7192   71.472   4.3841 -6.303146 7.206221 
1 1 1   19   21   19 o   38.957   5.2266   36.615   7.8832   19.098   12.100   49.533   10.391   29.399   9.0721   48.514   5.1930 -19.11493 10.45323 
1 1 1   19   21   20 o   92.050   4.4985  187.697   13.227  168.555   29.735  192.419   14.768   88.044   8.1883   96.055   3.7277 -8.011124 8.996941 
1 1 1   19   21   21 o   67.550   3.3605   95.925   9.3583   94.005   13.350   97.779   13.122   66.862   4.8411   68.239   4.6623 -1.376579 6.721100 
1 1 1   19   21   22 o   18.969   5.4119   2.4230   7.0756  -6.5814   10.914   8.9505   9.2928   16.022   7.3357   21.916   7.9588 -5.893969 10.82384 
1 1 1   19   21   23 o  109.355   2.7335  249.862   12.325  247.502   17.609  252.128   17.256  108.828   3.9231  109.882   3.8075 -1.054482 5.466989 
1 1 1   19   21   24 o   50.663   4.5940   54.282   9.5105   45.607   12.636   65.617   14.444   46.017   6.6577   55.309   6.3319 -9.291874 9.187922 
1 1 1   19   21   25 o   36.958   5.3988   30.987   7.9206   28.923   11.793   32.682   10.691   35.592   8.2023   38.324   7.0221 -2.732433 10.79754 
1 1 1   19   21   26 o   61.709   3.7453   80.910   9.5234   83.104   13.836   78.936   13.128   62.477   5.3693   60.942   5.2231 1.535378 7.490639 
1 1 1   19   21   27 o   29.837   7.4103   19.556   11.635   12.263   17.373   25.487   15.668   26.815   10.604   32.859   10.354 -6.043425 14.82057 
1 1 1   19   21   28 o   61.222   4.6576   77.692   10.779   92.199   20.331   72.020   12.713   64.419   7.6521   58.024   5.3122 6.394653 9.315260 
1 1 1   19   21   29 o   80.459   3.7553  141.811   12.138  123.465   18.604  155.410   16.017   75.403   5.9820   85.514   4.5413 -10.11079 7.510552 
1 1 1   19   21   30 o   32.534   6.0375   24.515   8.2802   32.461   12.583   18.447   10.996   37.039   8.4269   28.028   8.6483 9.011044 12.07494 
1 1 1   19   21   31 f   56.336   4.1104   69.548   9.4916   68.057   14.120   70.776   12.820   55.587   6.1589   57.085   5.4450 -1.497864 8.220729 
1 1 1   19   21   32 o   49.059   5.2151   56.332   9.7386   50.917   15.932   59.563   12.305   45.978   8.7206   52.139   5.7221 -6.161583 10.43029 
1 1 1   19   21   33 o   45.306   5.2604   49.127   9.1769   34.373   13.364   62.292   12.624   37.397   8.8095   53.215   5.7516 -15.81774 10.52083 
1 1 1   19   21   34 o   17.955   5.5327  -0.7834   8.0879  -8.6902   11.711   6.4259   11.183   15.437   7.2466   20.473   8.3625 -5.036602 11.06548 
1 1 1   19   21   35 o   39.393   8.5003   47.669   13.472   49.212   13.975   27.397   50.665   45.910   7.3805   32.876   15.315 13.03386 17.00052 
1 1 1   19   21   36 o   27.933   7.6508   20.351   12.351   20.768   15.391   19.595   20.701   28.013   10.232   27.853   11.377 0.1607685 15.30153 
1 1 1   19   21   37 o   21.107   6.8045   0.2055   13.012   5.3324   15.833 -10.4625   22.839   21.528   9.4084   20.686   9.8329 0.8418674 13.60894 
1 1 1   19   22    0 o   47.773   3.2349   48.505   8.8243   48.505   8.8243   48.505   8.8243   47.773   4.5749   47.773   4.5749 0.000000 0.000000 
1 1 1   19   22    1 o   80.756   2.3508  134.991   7.8300  134.904   11.088  135.078   11.058   80.730   3.3302   80.783   3.3190 -0.5309296E-01 4.701684 
1 1 1   19   22    2 o  255.811   2.6123  1355.48   27.265  1353.38   36.007  1358.31   41.744  255.666   3.4147  255.957   3.9542 -0.2918854 5.224559 
1 1 1   19   22    3 o  118.903   2.4491  291.869   11.957  302.193   17.897  283.543   16.071  120.777   3.5927  117.028   3.3295 3.748680 4.898233 
1 1 1   19   22    4 o  141.792   2.4891  417.739   14.503  378.998   20.611  455.733   20.410  135.228   3.6954  148.355   3.3357 -13.12749 4.978199 
1 1 1   19   22    5 o   26.310   5.0055   16.644   6.5305  -3.4748   12.899   23.578   7.5727   18.997   8.3905   33.622   5.4608 -14.62468 10.01103 
1 1 1   19   22    6 o  179.265   2.3751  666.207   17.327  662.623   26.735  668.803   22.753  178.783   3.6256  179.748   3.0690 -0.9651337 4.750177 
1 1 1   19   22    7 o  100.035   2.4401  208.596   9.7462  202.478   15.792  212.360   12.386   98.778   3.8763  101.291   2.9649 -2.512978 4.880190 
1 1 1   19   22    8 o   41.608   4.5098   37.330   7.3820   33.990   11.365   39.768   9.7091   39.575   7.2289   43.641   5.3941 -4.066399 9.019589 
1 1 1   19   22    9 o   57.024   3.4707   67.721   8.1314   68.447   12.067   67.117   11.005   57.279   5.1078   56.769   4.7003 0.5091591 6.941337 
1 1 1   19   22   10 o  127.274   2.6419  340.700   12.709  324.961   22.903  347.703   15.276  124.949   4.4442  129.598   2.8580 -4.649971 5.283853 
1 1 1   19   22   11 o  110.054   2.4414  254.780   10.702  236.982   17.232  265.956   13.655  106.789   3.9123  113.320   2.9215 -6.531334 4.882755 
1 1 1   19   22   12 o  153.802   2.3209  489.819   14.312  494.194   23.174  487.121   18.198  154.253   3.6425  153.350   2.8772 0.9028320 4.641766 
1 1 1   19   22   13 o  139.849   2.3914  409.997   13.577  380.244   20.686  432.515   17.996  135.255   3.7081  144.443   3.0207 -9.188232 4.782734 
1 1 1   19   22   14 o  113.448   2.4512  271.683   11.059  249.717   17.808  285.470   14.109  109.536   3.9418  117.359   2.9147 -7.822968 4.902428 
1 1 1   19   22   15 o  204.472   2.6137  869.295   22.020  819.937   30.968  919.777   31.318  198.562   3.7814  210.382   3.6093 -11.82027 5.227406 
1 1 1   19   22   16 o   87.609   3.4493  178.323   10.417  126.928   19.800  197.994   12.249   77.519   6.1928   97.700   3.0398 -20.18098 6.898605 
1 1 1   19   22   17 o   55.927   4.1135   65.247   9.4134   59.359   12.396   73.268   14.468   53.021   5.6684   58.833   5.9625 -5.812382 8.226973 
1 1 1   19   22   18 o  111.442   2.8160  262.112   12.711  243.153   19.506  276.105   16.758  107.751   4.3892  115.132   3.5291 -7.381073 5.632068 
1 1 1   19   22   19 f   54.023   5.3751   70.303   9.6714   50.918   18.329   77.783   11.385   47.147   9.7479   60.899   4.5328 -13.75174 10.75024 
1 1 1   19   22   20 o   92.277   2.7908  177.612   10.592  182.099   15.654  173.823   14.385   93.312   4.0673   91.241   3.8225 2.070976 5.581669 
1 1 1   19   22   21 o   31.376   4.9634   22.689   7.5704   1.0376   11.302   40.312   10.196   19.132   8.1502   43.621   5.6672 -24.48956 9.926844 
1 1 1   19   22   22 o   98.503   2.7628  202.620   11.214  209.150   16.298  196.749   15.453   99.992   3.9518   97.013   3.8621 2.978783 5.525575 
1 1 1   19   22   23 o   42.837   4.7780   40.799   8.0426   35.937   12.227   44.507   10.678   39.969   7.6963   45.706   5.6642 -5.736820 9.555983 
1 1 1   19   22   24 o   81.751   3.5062  139.680   11.698  130.337   15.285  152.891   18.176   78.589   4.7157   84.913   5.1899 -6.324188 7.012311 
1 1 1   19   22   25 o   22.675   5.6563   6.8307   7.2771   19.409   11.330  -2.0023   9.4944   29.108   8.7380   16.242   7.1848 12.86520 11.31258 
1 1 1   19   22   26 o   54.900   3.9629   63.830   8.8947   76.890   13.281   53.206   11.978   60.023   5.3646   49.777   5.8343 10.24604 7.925780 
1 1 1   19   22   27 o   22.472   5.9461   4.9189   9.1456   19.077   11.925 -15.2998   14.251   28.692   9.0315   16.251   7.7367 12.44102 11.89220 
1 1 1   19   22   28 o   42.066   6.0879   53.892   10.210   12.315   19.496   69.606   11.986   27.131   11.057   57.000   5.0982 -29.86888 12.17587 
1 1 1   19   22   29 o   36.108   6.1296   31.201   8.7879   30.350   14.576   31.687   11.015   35.157   9.7244   37.058   7.4648 -1.900959 12.25915 
1 1 1   19   22   30 o   20.146   5.8362   5.3227   7.7378   2.4083   12.176   7.2973   10.022   19.635   8.4143   20.657   8.0899 -1.022095 11.67247 
1 1 1   19   22   31 o   44.358   5.0793   45.986   8.8041   38.577   13.273   51.807   11.765   40.166   8.2872   48.550   5.8753 -8.384056 10.15855 
1 1 1   19   22   32 o   23.031   6.2473   10.649   8.3482   6.9625   13.592   12.882   10.579   22.086   9.1411   23.976   8.5178 -1.890221 12.49451 
1 1 1   19   22   33 o   83.591   3.4380  152.252   11.817  141.102   16.861  163.016   16.567   80.374   5.0863   86.809   4.6271 -6.435318 6.876075 
1 1 1   19   22   34 o   18.084   5.9469  -6.4424   10.443  -1.3826   12.451 -18.4419   19.174   18.043   8.0884   18.125   8.7202 -0.8172226E-01 11.89388 
1 1 1   19   22   35 o   44.727   7.9805   71.911   14.493   76.958   15.279   26.604   45.778   57.982   6.3891   31.472   14.626 26.50917 15.96099 
1 1 1   19   22   36 o   19.457   6.3047  -4.0981   11.966   5.2700   14.827 -21.5929   20.262   21.122   9.1693   17.792   8.6557 3.330145 12.60945 
1 1 1   19   23    0 o   44.640   3.3094   42.620   8.4003   42.620   8.4003   42.620   8.4003   44.640   4.6803   44.640   4.6803 0.000000 0.000000 
1 1 1   19   23    1 o   61.641   2.6734   79.009   6.7778   72.497   9.6103   85.454   9.5604   59.091   3.9432   64.190   3.6111 -5.098396 5.346853 
1 1 1   19   23    2 o  122.921   2.4406  313.129   12.324  314.244   18.277  312.199   16.688  123.093   3.6000  122.748   3.2963 0.3451233 4.881142 
1 1 1   19   23    3 o  111.492   2.4879  258.163   11.389  253.128   16.831  262.416   15.470  110.456   3.6944  112.527   3.3331 -2.071335 4.975803 
1 1 1   19   23    4 o  226.956   2.9152  1076.58   26.153  1048.25   43.421  1092.70   32.762  224.344   4.6927  229.568   3.4602 -5.224457 5.830463 
1 1 1   19   23    5 o  135.833   3.5837  405.368   15.092  354.133   35.183  416.921   16.707  129.748   6.5746  141.919   2.8543 -12.17050 7.167490 
1 1 1   19   23    6 o  142.032   2.6226  423.270   14.090  407.292   25.417  430.358   16.929  139.885   4.4054  144.180   2.8468 -4.294464 5.245147 
1 1 1   19   23    7 o  133.408   2.3437  371.174   12.560  359.318   20.019  378.871   16.129  131.554   3.6896  135.262   2.8911 -3.707993 4.687416 
1 1 1   19   23    8 o  120.605   2.3884  305.143   11.648  282.702   17.974  321.391   15.294  116.659   3.7355  124.550   2.9771 -7.891327 4.776753 
1 1 1   19   23    9 o   74.413   2.7690  114.705   8.2538  117.030   13.431  113.293   10.463   74.945   4.3450   73.881   3.4336 1.063820 5.537905 
1 1 1   19   23   10 o   69.265   2.8600  100.346   7.7829   98.273   13.113  101.473   9.6705   68.609   4.6339   69.921   3.3533 -1.311745 5.719980 
1 1 1   19   23   11 o   40.876   4.7287   41.685   6.7104   23.050   11.548   51.186   8.2455   32.170   8.5549   49.582   4.0321 -17.41191 9.457496 
1 1 1   19   23   12 o   72.846   3.2466  109.751   8.7369  113.177   16.675  108.454   10.258   73.425   5.5062   72.266   3.4415 1.158714 6.493278 
1 1 1   19   23   13 o   33.922   5.2597   25.106   7.0790   27.420   11.008   23.474   9.2437   35.184   7.7915   32.659   7.0675 2.524849 10.51936 
1 1 1   19   23   14 o   24.069   5.4590   10.248   5.9341   18.614   10.626   6.4569   7.1535   29.020   8.3981   19.118   6.9767 9.902401 10.91801 
1 1 1   19   23   15 o   23.171   5.0893   5.0195   5.7480   24.102   11.049  -2.0613   6.7304   32.743   8.1996   13.599   6.0307 19.14465 10.17851 
1 1 1   19   23   16 o   76.605   2.8734  127.455   8.5593  106.328   14.023  140.001   10.806   71.152   4.7783   82.057   3.1929 -10.90495 5.746866 
1 1 1   19   23   17 o   64.967   3.7649   88.842   9.9522   87.644   13.015   90.528   15.444   64.558   4.8879   65.376   5.7276 -0.8179703 7.529710 
1 1 1   19   23   18 f   61.767   3.7454   83.656   9.0944   67.866   14.371   94.205   11.746   56.458   6.1714   67.075   4.2457 -10.61686 7.490792 
1 1 1   19   23   19 f   85.675   3.8271  155.450   11.935  154.456   23.053  155.814   13.949   84.990   6.5765   86.360   3.9163 -1.369774 7.654260 
1 1 1   19   23   20 o   54.152   3.9618   63.741   8.5803   53.600   13.160   71.240   11.317   50.095   6.3691   58.209   4.7137 -8.113438 7.923674 
1 1 1   19   23   21 o   93.328   3.2770  185.117   12.321  191.888   15.993  175.229   19.327   95.678   4.0526   90.979   5.1507 4.699348 6.553907 
1 1 1   19   23   22 o   76.384   3.1166  123.350   9.7380  117.202   14.512  128.385   13.134   74.534   4.7206   78.235   4.0705 -3.701126 6.233234 
1 1 1   19   23   23 o  117.099   2.6846  287.697   12.943  275.393   18.582  299.291   18.038  114.598   3.9315  119.600   3.6567 -5.002701 5.369214 
1 1 1   19   23   24 f   92.217   2.9299  179.392   11.114  168.338   15.940  189.850   15.505   89.363   4.3247   95.071   3.9541 -5.707489 5.859857 
1 1 1   19   23   25 o   86.257   4.4657  157.245   15.887  157.245   15.887   0.0000   0.0000   86.257   4.4657  ?   ?       ?      ? 
1 1 1   19   23   26 o   22.065   5.7388   7.4633   7.7511  -3.5481   11.520   16.573   10.478   17.239   7.7501   26.890   8.4659 -9.651325 11.47757 
1 1 1   19   23   27 o   35.777   5.6107   30.529   8.2839   21.018   12.346   38.319   11.173   29.761   9.1602   41.793   6.4816 -12.03203 11.22144 
1 1 1   19   23   28 o   33.363   6.6999   30.978   10.023   1.9422   25.800   36.140   10.878   26.235   11.710   40.492   6.5134 -14.25683 13.39974 
1 1 1   19   23   29 o   39.827   6.2742   43.198   10.512   56.558   13.203   20.063   17.374   50.518   6.3365   29.136   10.831 21.38196 12.54835 
1 1 1   19   23   30 o   27.438   6.0701   16.771   7.9497   26.363   12.117   9.5203   10.534   32.812   8.7805   22.064   8.3837 10.74764 12.14019 
1 1 1   19   23   31 o   28.277   6.3055   19.249   8.1652   22.382   12.480   16.905   10.797   29.999   9.2061   26.555   8.6188 3.443596 12.61095 
1 1 1   19   23   32 o   20.332   5.6903   4.3158   8.2707 -11.5690   13.169   14.662   10.628   15.810   7.5009   24.854   8.5589 -9.044297 11.38054 
1 1 1   19   23   33 o   17.622   5.5180  -0.3068   7.9564  -3.1340   12.139   1.8227   10.535   17.272   7.8415   17.972   7.7655 -0.7003727 11.03601 
1 1 1   19   23   34 o   35.806   7.3969   35.272   11.171   34.582   13.468   36.792   19.999   36.551   8.9951   35.061   11.745 1.489853 14.79380 
1 1 1   19   23   35 o   21.887   6.8486   5.0041   11.819   6.4166   14.453   2.1525   20.535   21.380   9.1649   22.394   10.179 -1.014328 13.69724 
1 1 1   19   24    0 o  187.990   2.5270  732.070   27.687  732.070   27.687  732.070   27.687  187.990   3.5738  187.990   3.5738 0.000000 0.000000 
1 1 1   19   24    1 o   82.319   3.2003  143.430   10.487  132.476   16.864  150.338   13.392   79.588   5.1374   85.050   3.8177 -5.462219 6.400580 
1 1 1   19   24    2 o   69.140   2.9154   98.459   8.2404  107.019   12.702   92.238   10.828   71.681   4.2964   66.599   3.9421 5.082039 5.830855 
1 1 1   19   24    3 o   50.353   4.1647   50.449   7.9879   60.767   14.950   46.326   9.4501   53.614   6.7606   47.091   4.8655 6.523075 8.329386 
1 1 1   19   24    4 f   51.261   4.2924   59.632   7.4279   47.558   15.050   63.520   8.5406   47.239   7.7246   55.282   3.7457 -8.043789 8.584881 
1 1 1   19   24    5 o  127.741   2.3392  340.626   11.937  330.334   19.310  346.993   15.187  126.067   3.7137  129.416   2.8453 -3.349335 4.678375 
1 1 1   19   24    6 o   77.376   2.7375  126.710   8.3466  116.816   13.737  132.499   10.509   74.832   4.4509   79.920   3.1881 -5.088142 5.474907 
1 1 1   19   24    7 o   91.036   2.8073  170.407   9.5168  177.426   17.978  167.674   11.217   92.146   4.7303   89.927   3.0244 2.219299 5.614513 
1 1 1   19   24    8 o   37.603   5.2984   36.695   7.8338   12.929   12.976   50.324   9.8267   26.150   9.4184   49.056   4.8568 -22.90595 10.59688 
1 1 1   19   24    9 o  137.189   2.3492  392.127   13.090  381.856   20.216  399.542   17.177  135.554   3.6160  138.823   3.0000 -3.269592 4.698434 
1 1 1   19   24   10 o   64.866   3.1032   92.830   7.7293   71.553   12.631  105.567   9.7726   58.422   5.2421   71.310   3.3227 -12.88895 6.206429 
1 1 1   19   24   11 f   38.221   4.4637   32.512   6.3083   28.339   10.943   34.589   7.7202   35.766   7.6499   40.676   4.6018 -4.910042 8.927334 
1 1 1   19   24   12 o  103.552   2.4499  225.471   10.103  213.461   16.354  232.884   12.849  101.172   3.9191  105.933   2.9408 -4.760620 4.899812 
1 1 1   19   24   13 o   64.052   2.9560   83.482   7.4881   93.815   12.822   78.134   9.2245   66.876   4.6487   61.229   3.6527 5.646404 5.912071 
1 1 1   19   24   14 f  123.181   2.4424  315.676   12.187  317.380   19.145  314.516   15.801  123.349   3.7633  123.012   3.1144 0.3369522 4.884823 
1 1 1   19   24   15 o   67.784   3.0603   98.885   7.9878   88.354   13.639  104.383   9.8547   64.757   5.1065   70.811   3.3742 -6.053947 6.120652 
1 1 1   19   24   16 o  120.373   2.5811  302.795   12.733  296.646   19.002  307.806   17.153  119.179   3.8658  121.566   3.4211 -2.387344 5.162230 
1 1 1   19   24   17 o   67.496   3.2441   95.068   9.0037  103.709   13.366   87.889   12.183   70.281   4.6109   64.710   4.5646 5.570808 6.488120 
1 1 1   19   24   18 o   32.899   5.7911   25.742   8.1304   15.286   13.563   31.607   10.158   27.331   9.6517   38.467   6.4024 -11.13672 11.58216 
1 1 1   19   24   19 o   60.868   3.7558   76.755   9.1544   85.824   15.178   71.569   11.477   63.473   5.7976   58.263   4.7761 5.210667 7.511546 
1 1 1   19   24   20 o   38.960   5.3866   33.085   8.1175   38.705   13.473   29.881   10.171   41.302   8.1982   36.618   6.9894 4.683586 10.77322 
1 1 1   19   24   21 o   30.774   4.7013   22.188   7.3572  -3.0079   11.162   41.545   9.7832   17.332   7.7219   44.215   5.3647 -26.88281 9.402499 
1 1 1   19   24   22 o   33.791   5.5070   25.464   7.4535   30.754   11.622   21.768   9.7143   36.703   7.9106   30.879   7.6636 5.824356 11.01403 
1 1 1   19   24   23 o   19.056   5.2531   2.2334   7.0333 -11.6521   10.970   11.926   9.1650   14.495   6.8678   23.616   7.9507 -9.121652 10.50622 
1 1 1   19   24   24 o   52.091   4.1072   58.375   8.8185   60.897   12.735   56.051   12.223   53.171   5.8072   51.011   5.8096 2.160477 8.214339 
1 1 1   19   24   25 o   38.165   5.9962   34.384   9.1739   36.077   12.455   32.376   13.563   39.492   7.9223   36.838   9.0030 2.654758 11.99241 
1 1 1   19   24   26 o   40.764   8.0662   28.083   10.979   20.388   11.860   74.158   29.020   29.331   8.9701   52.198   13.409 -22.86717 16.13243 
1 1 1   19   24   27 o   38.863   5.3467   37.113   8.2937   18.866   12.116   53.202   11.377   28.213   9.1276   49.513   5.5712 -21.30033 10.69348 
1 1 1   19   24   28 o   28.078   7.8301   6.7087   9.5252   42.431   27.160   1.6990   10.171   38.195   13.640   17.962   7.6938 20.23242 15.66024 
1 1 1   19   24   29 o   23.020   6.1384   10.682   8.0889   6.6608   12.369   13.686   10.692   21.457   8.7832   24.582   8.5776 -3.124842 12.27681 
1 1 1   19   24   30 o   71.807   3.5905  113.692   10.451   97.224   15.418  127.690   14.214   66.512   5.6203   77.102   4.4698 -10.59081 7.181009 
1 1 1   19   24   31 o   27.995   5.9022   17.320   7.9248   31.210   12.295   7.4495   10.365   35.431   8.5187   20.560   8.1718 14.87179 11.80447 
1 1 1   19   24   32 o   12.187   4.2488 -19.8366   7.4420 -15.7255   11.251 -23.0344   9.9229   13.394   6.5010   10.980   5.4721 2.414324 8.497508 
1 1 1   19   24   33 o   23.404   6.9938   9.5377   11.465   10.492   14.620   8.0136   18.479   23.233   9.5338   23.574   10.235 -0.3410797 13.98768 
1 1 1   19   24   34 o   22.824   6.8682   9.1339   10.786   10.236   12.798   6.4322   20.038   22.345   9.0120   23.304   10.367 -0.9595127 13.73631 
1 1 1   19   25    0 o  126.100   2.5554  329.986   18.761  329.986   18.761  329.986   18.761  126.100   3.6139  126.100   3.6139 0.000000 0.000000 
1 1 1   19   25    1 o   66.305   2.8553   93.754   7.4711   83.205   12.110  100.235   9.4928   63.117   4.6521   69.493   3.3120 -6.375797 5.710629 
1 1 1   19   25    2 o  227.291   3.2365  1078.63   30.331  1075.04   43.387  1082.07   42.420  226.885   4.6364  227.697   4.5169 -0.8125153 6.472956 
1 1 1   19   25    3 o  104.173   3.8978  231.179   15.315  219.204   27.606  236.503   18.408  101.807   6.5745  106.539   4.1891 -4.732109 7.795674 
1 1 1   19   25    4 o  142.152   2.8521  426.023   16.320  394.296   25.510  448.003   21.233  137.449   4.4999  146.855   3.5055 -9.406448 5.704166 
1 1 1   19   25    5 o  109.103   2.3944  247.143   10.584  247.352   16.599  247.000   13.740  109.071   3.6898  109.134   3.0526 -0.6282043E-01 4.788852 
1 1 1   19   25    6 o  131.661   2.5082  360.445   13.613  354.776   19.487  365.848   19.024  130.629   3.6169  132.693   3.4760 -2.063995 5.016433 
1 1 1   19   25    7 f   15.603   4.6897  -0.0713   5.4514  -9.0693   9.8559   3.8950   6.5435   14.354   6.7093   16.852   6.5543 -2.497956 9.379400 
1 1 1   19   25    8 o   35.623   4.5428   27.368   6.0597   27.520   10.753   27.297   7.3352   35.177   7.6313   36.069   4.9308 -0.8919601 9.085671 
1 1 1   19   25    9 o  117.222   2.3402  284.005   10.968  292.846   17.978  278.763   13.843  118.552   3.6768  115.893   2.8961 2.659462 4.680404 
1 1 1   19   25   10 o   28.119   5.0981   18.485   5.7844   13.603   10.380   20.685   6.9664   25.420   8.4606   30.818   5.6903 -5.398088 10.19614 
1 1 1   19   25   11 o  142.460   2.3211  421.571   13.304  425.041   21.333  419.362   17.019  142.805   3.6220  142.116   2.9036 0.6888123 4.642176 
1 1 1   19   25   12 o   74.739   2.8045  119.599   8.2498  106.068   13.443  127.773   10.449   71.102   4.5840   78.376   3.2323 -7.274200 5.609046 
1 1 1   19   25   13 o   70.669   2.9785  107.715   8.2861   92.454   13.345  117.290   10.571   66.291   4.8809   75.046   3.4151 -8.754807 5.957031 
1 1 1   19   25   14 o  130.178   2.4044  357.894   12.521  330.925   19.897  375.578   16.111  125.888   3.8321  134.468   2.9050 -8.580170 4.808770 
1 1 1   19   25   15 o   68.957   2.8862   95.757   7.7404  110.529   13.811   88.992   9.3462   72.556   4.6151   65.358   3.4671 7.197678 5.772378 
1 1 1   19   25   16 o   37.437   5.8821   31.195   8.8293   25.934   11.755   38.005   13.374   33.772   8.4576   41.103   8.1770 -7.331036 11.76417 
1 1 1   19   25   17 o  108.829   2.6137  248.018   11.708  237.356   16.859  257.948   16.270  106.509   3.8379  111.149   3.5491 -4.639877 5.227371 
1 1 1   19   25   18 o   19.858   5.7136   4.2709   7.4214  -2.6010   12.804   7.7471   9.1071   18.775   8.3224   20.942   7.8305 -2.166912 11.42714 
1 1 1   19   25   19 o   91.324   2.8682  175.534   10.730  169.563   15.974  180.443   14.483   89.803   4.3128   92.845   3.7822 -3.042122 5.736334 
1 1 1   19   25   20 o  119.874   2.9787  302.319   14.454  302.418   22.711  302.251   18.739  119.661   4.6018  120.088   3.7835 -0.4266586 5.957419 
1 1 1   19   25   21 o   81.582   3.1894  142.706   10.529  126.749   15.938  155.065   14.026   77.251   5.0022   85.913   3.9583 -8.662148 6.378892 
1 1 1   19   25   22 o   24.826   5.9393   13.124   7.1493   15.095   11.130   11.740   9.3284   26.157   8.7617   23.496   8.0207 2.660961 11.87855 
1 1 1   19   25   23 o   26.156   5.8425   15.736   7.2889   10.278   11.252   19.683   9.5676   23.175   8.6964   29.138   7.8047 -5.962479 11.68506 
1 1 1   19   25   24 o   29.445   5.9145   20.599   7.9309   12.308   11.701   27.643   10.786   24.399   8.9201   34.491   7.7691 -10.09138 11.82906 
1 1 1   19   25   25 f   15.629   5.0252  -5.6979   7.0796   0.0514   10.854  -9.9544   9.3396   17.944   7.8172   13.314   6.3168 4.629141 10.05044 
1 1 1   19   25   26 o   34.902   6.9935   35.082   11.553   41.866   12.662   1.3718   28.226   43.151   7.1143   26.652   12.042 16.49922 13.98699 
1 1 1   19   25   27 o   34.592   5.9681   30.720   8.8304   18.716   14.505   37.788   11.130   28.038   9.9728   41.147   6.5586 -13.10896 11.93614 
1 1 1   19   25   28 o   66.366   4.5621   99.712   11.264   94.003   20.525  102.172   13.474   63.838   7.7953   68.893   4.7418 -5.055435 9.124236 
1 1 1   19   25   29 o   96.967   3.7194  213.122   13.827  180.745   23.232  230.882   17.206   89.906   6.2652  104.029   4.0103 -14.12282 7.438712 
1 1 1   19   25   30 o   34.620   6.0339   29.573   8.4757   32.396   13.120   27.551   11.103   35.785   8.9208   33.455   8.1273 2.330357 12.06788 
1 1 1   19   25   31 o   22.850   6.2191   11.077   8.2058   10.790   12.702   11.282   10.750   23.012   9.0779   22.688   8.5028 0.3232059 12.43811 
1 1 1   19   25   32 o   30.992   6.4800   25.201   8.8243   26.989   13.211   23.760   11.857   31.804   9.4105   30.180   8.9109 1.623524 12.96006 
1 1 1   19   25   33 o   52.985   6.1490   70.980   12.826   70.209   16.612   72.116   20.181   54.053   7.4514   51.917   9.7837 2.136032 12.29808 
1 1 1   19   26    0 o   14.914   6.2158   5.5471   9.2267   5.5471   9.2267   5.5471   9.2267   14.914   8.7904   14.914   8.7904 0.000000 0.000000 
1 1 1   19   26    1 o   68.497   2.9929   98.134   8.4475   93.332   11.941  102.943   11.952   66.796   4.3345   70.197   4.1281 -3.401230 5.985743 
1 1 1   19   26    2 o   38.776   5.0080   30.633   7.2341   38.470   13.530   27.497   8.5604   41.495   8.1967   36.058   5.7561 5.437027 10.01590 
1 1 1   19   26    3 o   99.446   3.0227  205.493   12.014  212.400   19.714  201.413   15.153  100.601   4.7513   98.291   3.7378 2.310661 6.045306 
1 1 1   19   26    4 o   24.305   4.5495   13.832   5.7316  -2.9649   10.269   21.432   6.9076   16.720   7.4304   31.889   5.2520 -15.16902 9.099097 
1 1 1   19   26    5 o   67.363   2.8507   94.471   7.6069   96.001   12.701   93.614   9.4991   67.667   4.5508   67.058   3.4345 0.6093369 5.701422 
1 1 1   19   26    6 o   78.778   2.6152  127.661   8.1936  135.895   13.701  123.077   10.223   80.625   4.1202   76.931   3.2220 3.693352 5.230411 
1 1 1   19   26    7 o  118.389   2.4115  297.841   11.499  255.833   17.463  330.002   15.280  110.722   3.8240  126.056   2.9389 -15.33455 4.822913 
1 1 1   19   26    8 f   60.432   3.0353   75.386   7.2257   80.078   12.340   72.938   8.9135   61.718   4.8478   59.146   3.6539 2.572033 6.070591 
1 1 1   19   26    9 o   42.021   4.0152   38.045   6.3970   35.670   11.375   39.144   7.7364   40.814   6.7571   43.227   4.3393 -2.412926 8.030419 
1 1 1   19   26   10 o   37.173   4.5145   29.305   6.2351   31.693   11.345   28.271   7.4634   37.700   7.5591   36.647   4.9378 1.052933 9.028991 
1 1 1   19   26   11 o   92.079   2.6628  182.426   9.6993  154.470   15.378  200.895   12.499   85.857   4.3426   98.301   3.0829 -12.44353 5.325638 
1 1 1   19   26   12 o   58.729   3.2116   72.423   7.3630   72.220   12.620   72.528   9.0659   58.501   5.2304   58.957   3.7283 -0.4552612 6.423151 
1 1 1   19   26   13 o   77.189   3.0322  124.406   9.6251  130.272   14.280  119.523   13.029   78.821   4.3926   75.558   4.1810 3.263069 6.064337 
1 1 1   19   26   14 o  140.211   2.5902  410.622   14.960  409.365   21.690  411.763   20.660  139.960   3.7574  140.462   3.5662 -0.5013275 5.180355 
1 1 1   19   26   15 o  105.432   2.5027  231.223   10.500  235.763   17.362  228.605   13.184  106.073   3.9686  104.790   3.0503 1.282646 5.005432 
1 1 1   19   26   16 f   48.815   4.6559   51.597   9.2974   53.827   12.566   48.901   13.820   50.141   6.0765   47.488   7.0558 2.652916 9.311752 
1 1 1   19   26   17 o   97.321   3.0377  198.923   11.788  200.038   19.320  198.261   14.879   97.298   4.8143   97.343   3.7059 -0.4483795E-01 6.075467 
1 1 1   19   26   18 o   34.754   5.5204   28.129   7.6735   23.744   11.833   31.311   10.081   32.006   8.7246   37.503   6.7661 -5.496925 11.04079 
1 1 1   19   26   19 o  137.355   2.7086  396.111   15.321  369.158   21.575  423.528   21.760  132.567   3.9460  142.143   3.7116 -9.576813 5.417240 
1 1 1   19   26   20 o   43.110   4.8183   42.356   8.0028   34.837   12.439   47.665   10.453   38.983   8.0047   47.236   5.3656 -8.252342 9.636654 
1 1 1   19   26   21 o  133.891   2.9585  382.582   16.115  349.114   24.190  409.286   21.608  128.262   4.5728  139.519   3.7550 -11.25699 5.916937 
1 1 1   19   26   22 o   69.333   3.5734  104.969   9.9178   92.390   15.422  113.842   12.951   65.361   5.7207   73.305   4.2837 -7.943909 7.146744 
1 1 1   19   26   23 o   68.112   3.5163   99.567   9.8545   93.172   14.059  105.743   13.817   65.852   5.1765   70.372   4.7603 -4.520821 7.032502 
1 1 1   19   26   24 o   36.938   5.4678   32.695   8.1727   22.828   12.140   40.873   11.052   30.741   8.9997   43.136   6.2123 -12.39488 10.93561 
1 1 1   19   26   25 o   46.482   5.3900   49.949   9.8574   50.160   12.760   49.638   15.524   47.453   6.5195   45.511   8.5850 1.941704 10.77992 
1 1 1   19   26   26 o   29.258   6.3604   19.675   9.1221   8.9977   12.530   31.717   13.306   22.619   8.9865   35.896   9.0034 -13.27685 12.72079 
1 1 1   19   26   27 o   82.978   3.8882  150.537   13.272  136.723   18.491  165.217   19.062   78.891   5.6827   87.064   5.3084 -8.172203 7.776358 
1 1 1   19   26   28 o   25.281   6.3460   15.016   8.2532   15.156   12.604   14.912   10.920   25.469   9.2660   25.093   8.6734 0.3766594 12.69202 
1 1 1   19   26   29 o   70.993   4.4768  118.615   11.802  100.505   20.800  127.214   14.332   65.307   7.7220   76.680   4.5317 -11.37293 8.953551 
1 1 1   19   26   30 o   20.655   5.7352   2.7911   7.8798   18.251   12.448  -7.5465   10.179   26.886   9.2623   14.423   6.7660 12.46337 11.47037 
1 1 1   19   26   31 o   19.184   5.8187   3.7604   8.2485   1.2819   12.761   5.5392   10.811   18.859   8.3366   19.508   8.1196 -0.6483727 11.63730 
1 1 1   19   26   32 o   23.615   6.3162   12.453   8.3163   18.145   13.305   8.8031   10.654   26.315   9.5284   20.916   8.2939 5.398912 12.63244 
1 1 1   19   27    0 o   39.141   4.7718   34.778   9.9226   34.778   9.9226   34.778   9.9226   39.141   6.7484   39.141   6.7484 0.000000 0.000000 
1 1 1   19   27    1 o   67.806   2.9650   96.069   8.2817  103.007   11.948   89.654   11.489   70.173   4.1283   65.438   4.2569 4.735191 5.929922 
1 1 1   19   27    2 o   29.632   6.3484   19.745   8.4273   17.676   12.935   21.271   11.109   28.568   9.4415   30.696   8.4892 -2.127190 12.69682 
1 1 1   19   27    3 o   35.726   5.2741   26.387   6.8174   33.420   13.370   23.916   7.9252   38.375   8.6537   33.076   6.0316 5.298450 10.54827 
1 1 1   19   27    4 o   94.663   2.4279  184.173   9.1803  196.464   15.196  177.110   11.520   97.011   3.7980   92.314   3.0257 4.697403 4.855826 
1 1 1   19   27    5 o   78.930   2.6386  130.454   8.2514  128.352   13.661  131.661   10.353   78.295   4.2304   79.565   3.1550 -1.269218 5.277300 
1 1 1   19   27    6 o   58.307   3.1696   73.496   7.1572   64.455   12.012   78.472   8.9118   55.253   5.2712   61.361   3.5213 -6.108425 6.339198 
1 1 1   19   27    7 f   41.288   3.9243   36.626   6.1575   34.603   10.929   37.566   7.4531   40.224   6.5876   42.353   4.2667 -2.128616 7.848635 
1 1 1   19   27    8 o   76.921   3.4326  133.761   9.2991  105.743   17.693  144.454   10.930   70.506   6.0843   83.337   3.1801 -12.83053 6.865242 
1 1 1   19   27    9 o  133.263   2.8713  381.710   14.894  337.914   24.829  406.328   18.615  126.783   4.7482  139.743   3.2298 -12.96001 5.742578 
1 1 1   19   27   10 o   58.530   3.4065   77.181   7.4878   58.006   12.620   87.599   9.3020   52.236   5.8578   64.823   3.4792 -12.58702 6.813077 
1 1 1   19   27   11 o  146.490   2.4058  452.776   14.297  412.965   21.700  483.311   19.005  140.562   3.7431  152.418   3.0232 -11.85585 4.811532 
1 1 1   19   27   12 f  136.094   2.4398  386.904   13.446  384.987   21.084  388.218   17.456  135.652   3.7685  136.536   3.0997 -0.8842773 4.879539 
1 1 1   19   27   13 o   35.666   4.9702   34.981   6.4385   13.640   11.987   43.636   7.6331   25.720   9.0746   45.612   4.0574 -19.89207 9.940342 
1 1 1   19   27   14 o  101.741   2.5411  217.252   10.215  213.103   16.999  219.597   12.780  100.777   4.0898  102.704   3.0171 -1.927109 5.082269 
1 1 1   19   27   15 f   81.284   2.7788  139.406   8.8058  135.926   15.045  141.219   10.860   80.279   4.5439   82.289   3.1999 -2.010345 5.557534 
1 1 1   19   27   16 o   44.818   4.7888   43.668   8.8074   43.897   11.906   43.392   13.089   45.068   6.4053   44.568   7.1205 0.4999886 9.577540 
1 1 1   19   27   17 o   60.075   3.8990   75.512   9.1600   82.345   15.953   72.150   11.188   61.752   6.2636   58.398   4.6451 3.354637 7.798064 
1 1 1   19   27   18 o   53.129   3.9303   62.151   8.3402   50.911   12.674   70.735   11.076   48.474   6.3395   57.785   4.6474 -9.311291 7.860507 
1 1 1   19   27   19 o   33.438   5.4398   26.498   7.5455   18.603   11.598   32.292   9.9357   28.340   8.9044   38.536   6.2512 -10.19674 10.87956 
1 1 1   19   27   20 o   75.889   3.1944  122.744   9.8549  119.961   15.170  124.776   12.963   74.942   4.9078   76.837   4.0904 -1.895378 6.388873 
1 1 1   19   27   21 o   40.851   5.0055   37.642   8.0198   37.137   12.758   37.972   10.312   39.936   8.0239   41.765   5.9863 -1.829239 10.01097 
1 1 1   19   27   22 o   35.252   5.8380   28.704   8.2227   34.092   13.052   25.157   10.588   37.822   8.5655   32.682   7.9347 5.139957 11.67598 
1 1 1   19   27   23 o   62.186   3.9881   84.491   10.177   83.700   15.109   85.149   13.770   61.735   5.9338   62.637   5.3300 -0.9019508 7.976170 
1 1 1   19   27   24 o   56.764   4.7439   72.570   10.727   74.031   13.654   70.217   17.337   58.143   5.6939   55.386   7.5894 2.757290 9.487863 
1 1 1   19   27   25 o   74.201   3.8073  117.893   11.436  109.679   14.630  130.796   18.336   71.223   4.9804   77.179   5.7601 -5.955299 7.614684 
1 1 1   19   27   26 o   26.452   6.8545   15.833   10.005   21.773   14.322   10.170   13.983   29.391   9.9388   23.513   9.4422 5.877943 13.70893 
1 1 1   19   27   27 o   23.872   6.7277   10.203   11.435   19.700   12.342 -47.4075   30.398   27.992   9.2212   19.751   9.7987 8.241497 13.45534 
1 1 1   19   27   28 o   40.084   5.5106   38.346   8.8950   47.267   12.996   30.485   12.200   45.285   6.9581   34.883   8.5470 10.40195 11.02118 
1 1 1   19   27   29 f   32.856   7.1105   24.963   9.6886   43.134   18.797   18.389   11.306   38.807   11.152   26.906   8.8241 11.90021 14.22092 
1 1 1   19   27   30 o   52.917   4.5130   65.888   9.5488   55.888   14.525   73.499   12.672   48.476   7.2648   57.358   5.3565 -8.882019 9.026087 
1 1 1   19   27   31 o   47.283   4.8474   52.756   9.3863   51.391   13.956   53.885   12.684   46.325   7.3042   48.241   6.3747 -1.915428 9.694741 
1 1 1   19   28    0 o  107.130   2.6220  238.929   16.340  238.929   16.340  238.929   16.340  107.130   3.7081  107.130   3.7081 0.000000 0.000000 
1 1 1   19   28    1 o   61.652   3.1989   79.869   8.1206   77.808   11.733   81.764   11.251   60.851   4.6748   62.453   4.3679 -1.601585 6.397811 
1 1 1   19   28    2 o   42.270   5.2566   38.648   8.9322   43.630   13.612   34.881   11.837   44.952   7.3420   39.587   7.5248 5.364338 10.51317 
1 1 1   19   28    3 o   44.901   5.1526   44.258   9.1783   42.908   14.079   45.256   12.104   43.776   8.0958   46.027   6.3761 -2.250874 10.30520 
1 1 1   19   28    4 f  100.238   2.5040  209.564   10.349  208.863   14.822  210.231   14.455  100.059   3.5917  100.418   3.4901 -0.3591385 5.008095 
1 1 1   19   28    5 o   47.927   3.4123   47.882   6.4512   50.155   10.944   46.672   7.9864   48.649   5.4542   47.206   4.1019 1.443100 6.824524 
1 1 1   19   28    6 o   88.078   2.5561  165.145   8.9125  149.876   14.440  174.540   11.327   84.554   4.1408   91.602   2.9982 -7.047867 5.112257 
1 1 1   19   28    7 o   64.992   2.8909   85.390   7.4662  100.366   12.730   77.537   9.2181   69.076   4.4682   60.908   3.6694 8.167240 5.781815 
1 1 1   19   28    8 o   69.117   2.9555  103.906   7.9646   87.735   13.019  113.578   10.069   64.435   4.8987   73.799   3.3079 -9.363564 5.910982 
1 1 1   19   28    9 o   55.530   3.2752   63.778   7.0186   68.510   12.521   61.611   8.4752   56.804   5.3445   54.257   3.7873 2.546661 6.550321 
1 1 1   19   28   10 o   47.287   3.6990   48.443   6.5608   44.820   11.836   50.050   7.8825   45.695   6.2803   48.879   3.9100 -3.183952 7.398002 
1 1 1   19   28   11 o   61.401   3.0355   76.765   7.2719   86.976   12.841   71.945   8.8231   64.148   4.8534   58.654   3.6472 5.494446 6.071028 
1 1 1   19   28   12 o   46.824   4.2131   51.657   6.9063   37.563   12.171   58.350   8.3875   40.888   7.4930   52.759   3.8545 -11.87127 8.426276 
1 1 1   19   28   13 o  120.531   2.5275  307.815   12.388  274.438   18.473  335.091   16.700  114.342   3.9171  126.720   3.1952 -12.37818 5.054997 
1 1 1   19   28   14 o   28.498   5.3364   17.754   5.7920   19.798   11.481   17.057   6.7084   29.330   8.7939   27.666   6.0477 1.663500 10.67276 
1 1 1   19   28   15 o   18.688   5.5166   0.3442   7.6344  -8.4166   11.033   8.3924   10.575   15.412   7.1685   21.965   8.3870 -6.552795 11.03312 
1 1 1   19   28   16 o   19.747   5.7666   4.4127   7.0481   1.6992   13.698   5.3897   8.2196   20.701   8.8994   18.794   7.3358 1.906982 11.53315 
1 1 1   19   28   17 o   49.497   4.9175   56.871   8.7206   48.543   15.579   60.671   10.524   45.619   8.5950   53.375   4.7805 -7.755981 9.835023 
1 1 1   19   28   18 o   58.645   4.1826   76.090   9.4979   69.920   16.094   79.387   11.765   56.236   6.9390   61.055   4.6720 -4.819393 8.365294 
1 1 1   19   28   19 o   76.575   3.2155  124.560   10.144  132.243   14.722  117.614   13.998   78.829   4.5280   74.321   4.5666 4.507462 6.430913 
1 1 1   19   28   20 o   42.416   4.7274   40.109   7.8514   40.966   12.646   39.572   10.016   42.153   7.5511   42.678   5.6899 -0.5250511 9.454855 
1 1 1   19   28   21 o   56.262   3.9023   69.810   8.7292   65.059   14.048   72.797   11.141   54.245   6.2792   58.280   4.6349 -4.034851 7.804502 
1 1 1   19   28   22 o   31.315   5.8333   24.476   7.7899   17.888   12.255   28.943   10.091   27.369   9.1938   35.262   7.1823 -7.893457 11.66668 
1 1 1   19   28   23 o   24.825   6.2655   13.433   7.8645   15.979   13.060   11.984   9.8508   26.343   9.4529   23.307   8.2261 3.036310 12.53101 
1 1 1   19   28   24 f   31.462   6.2836   24.945   8.4379   21.975   14.052   26.620   10.552   29.598   9.8437   33.327   7.8126 -3.729618 12.56724 
1 1 1   19   28   25 o   43.201   5.2888   44.900   8.8608   38.323   13.810   49.502   11.552   39.266   8.7507   47.136   5.9423 -7.869923 10.57763 
1 1 1   19   28   26 o   49.380   5.4129   61.093   9.7635   46.222   16.124   69.703   12.269   42.473   9.4483   56.287   5.2847 -13.81392 10.82585 
1 1 1   19   28   27 o   21.188   6.0064   8.1868   7.9591   6.9676   12.255   9.0763   10.467   21.042   8.6922   21.334   8.2917 -0.2913151 12.01275 
1 1 1   19   28   28 o   67.742   4.0300  103.552   11.114  105.846   14.734  100.524   16.929   69.115   5.1686   66.370   6.1844 2.745323 8.059911 
1 1 1   19   28   29 o   18.790   6.0606  -3.3895   8.9661   8.1216   17.745  -7.3355   10.390   23.077   10.025   14.503   6.8139 8.574027 12.12118 
1 1 1   19   29    0 o  116.585   2.5660  283.015   17.411  283.015   17.411  283.015   17.411  116.585   3.6289  116.585   3.6289 0.000000 0.000000 
1 1 1   19   29    1 o   22.577   5.8619   6.2122   7.2516   17.963   12.470   0.2080   8.9136   28.429   9.2644   16.726   7.1845 11.70262 11.72372 
1 1 1   19   29    2 o   26.690   6.3657   15.054   8.2508   17.944   12.656   12.919   10.881   28.449   9.3364   24.932   8.6557 3.516420 12.73143 
1 1 1   19   29    3 o  100.251   2.8145  208.506   11.467  198.719   14.847  222.971   18.051   97.478   3.6930  103.024   4.2481 -5.545616 5.628922 
1 1 1   19   29    4 o   44.501   3.9637   41.853   7.1904   51.460   10.639   33.775   9.7560   49.257   5.2368   39.745   5.9515 9.511925 7.927406 
1 1 1   19   29    5 o  155.231   2.5593  503.660   16.383  507.764   23.440  499.740   22.906  155.833   3.6470  154.629   3.5917 1.204239 5.118645 
1 1 1   19   29    6 f  126.355   2.4768  336.040   12.808  301.325   18.602  367.327   17.660  119.980   3.7592  132.729   3.2259 -12.74960 4.953623 
1 1 1   19   29    7 o  149.673   2.3605  466.755   14.311  472.089   22.515  463.140   18.537  150.223   3.6339  149.124   3.0138 1.099686 4.721065 
1 1 1   19   29    8 o   45.571   3.6364   44.255   6.3473   43.687   11.236   44.521   7.6920   45.104   6.0402   46.038   4.0510 -0.9340858 7.272826 
1 1 1   19   29    9 o   44.568   3.5466   38.932   6.1491   52.325   11.192   33.141   7.3594   49.513   5.4803   39.623   4.5033 9.889919 7.093241 
1 1 1   19   29   10 o   34.546   4.8065   30.184   6.0022   17.960   10.955   35.428   7.1751   28.081   8.6265   41.011   4.2419 -12.92978 9.612998 
1 1 1   19   29   11 o   49.853   3.7920   56.651   7.0145   43.568   12.135   63.217   8.5962   44.814   6.5652   54.892   3.7969 -10.07752 7.584076 
1 1 1   19   29   12 o   98.342   2.5707  206.448   10.071  186.804   16.053  219.195   12.932   94.181   4.1326  102.503   3.0588 -8.321884 5.141471 
1 1 1   19   29   13 o   73.825   2.9701  120.497   8.4665   96.760   13.856  134.640   10.695   67.400   4.9844   80.249   3.2313 -12.84898 5.940183 
1 1 1   19   29   14 o   45.134   4.4045   48.451   6.6860   37.306   12.709   52.716   7.8620   40.219   7.9431   50.048   3.8087 -9.829189 8.809012 
1 1 1   19   29   15 f   32.899   6.1185   25.528   8.4600   29.889   12.272   21.579   11.678   35.596   8.4798   30.202   8.8227 5.394531 12.23707 
1 1 1   19   29   16 o   86.080   3.3301  161.277   11.135  147.341   18.769  168.846   13.831   82.631   5.5071   89.529   3.7458 -6.898170 6.660259 
1 1 1   19   29   17 o   29.429   5.8649   19.855   7.1934   22.881   12.069   18.187   8.9587   30.903   8.9520   27.955   7.5794 2.948269 11.72972 
1 1 1   19   29   18 o   39.480   5.0355   36.110   7.7332   32.042   12.257   38.800   9.9672   36.741   8.2862   42.219   5.7240 -5.477318 10.07100 
1 1 1   19   29   19 o   43.376   4.7145   43.090   7.8604   39.692   12.733   45.183   9.9917   41.125   7.7919   45.627   5.3094 -4.502964 9.428914 
1 1 1   19   29   20 o   49.456   4.1276   54.755   8.1020   49.124   12.915   58.408   10.404   46.848   6.6840   52.064   4.8449 -5.216419 8.255253 
1 1 1   19   29   21 o   85.596   3.1181  158.236   10.772  148.649   16.746  165.004   14.070   83.006   4.8914   88.185   3.8684 -5.179329 6.236202 
1 1 1   19   29   22 o   51.041   4.7153   62.469   8.9208   44.836   13.994   74.540   11.578   43.320   8.1309   58.763   4.7773 -15.44279 9.430500 
1 1 1   19   29   23 o   15.223   4.8905  -6.6808   7.3552 -21.9688   12.017   2.4763   9.3007   12.926   6.3657   17.520   7.4259 -4.593628 9.780943 
1 1 1   19   29   24 o   42.021   6.0940   43.776   10.208   40.986   14.337   46.644   14.538   40.440   8.8420   43.602   8.3884 -3.162628 12.18795 
1 1 1   19   29   25 o   21.052   6.2748   4.1850   8.4653   13.128   16.024   0.7226   9.9702   24.992   10.082   17.112   7.4726 7.879820 12.54967 
1 1 1   19   29   26 o   45.530   5.3595   53.776   9.0378   31.285   13.727   70.984   12.007   34.371   9.4087   56.689   5.1356 -22.31794 10.71906 
1 1 1   19   29   27 o   21.868   5.3147   5.9992   7.9687 -16.8371   12.199   22.997   10.524   13.762   6.6999   29.974   8.2520 -16.21223 10.62939 
1 1 1   19   29   28 o   23.007   6.4566   11.701   9.1653   13.149   12.551   10.047   13.416   23.624   9.1080   22.390   9.1540 1.233921 12.91328 
1 1 1   19   30    0 o   76.261   2.9522  122.225   13.042  122.225   13.042  122.225   13.042   76.261   4.1750   76.261   4.1750 0.000000 0.000000 
1 1 1   19   30    2 o   46.570   5.1478   49.453   9.3158   39.021   13.898   57.963   12.553   41.170   8.4676   51.971   5.8564 -10.80112 10.29550 
1 1 1   19   30    3 o   30.183   5.7563   21.091   7.3467   22.836   9.9269   18.978   10.924   31.595   7.6902   28.771   8.5674 2.823912 11.51259 
1 1 1   19   30    4 o   76.294   2.8187  122.195   8.8632  125.388   12.834  119.283   12.255   77.230   4.0292   75.357   3.9429 1.872955 5.637428 
1 1 1   19   30    5 o   58.198   3.3542   72.626   7.9310   60.005   11.408   84.433   11.034   53.084   5.2104   63.312   4.2255 -10.22762 6.708416 
1 1 1   19   30    6 o   63.331   3.1039   84.977   8.0715   79.648   11.725   89.778   11.128   61.354   4.6333   65.308   4.1314 -3.954571 6.207710 
1 1 1   19   30    7 o   19.129   4.9669   6.7768   5.2767   0.4340   9.6145   9.5108   6.3124   17.327   7.4526   20.930   6.5680 -3.603104 9.933814 
1 1 1   19   30    8 o   51.960   3.3171   56.137   6.6450   60.358   11.872   54.212   8.0187   53.119   5.4191   50.802   3.8270 2.317028 6.634196 
1 1 1   19   30    9 o   41.101   4.3884   39.709   6.2699   31.251   11.513   43.276   7.4759   36.872   7.8130   45.329   3.9987 -8.456440 8.776848 
1 1 1   19   30   10 o   34.932   4.7346   27.750   5.9752   25.824   11.235   28.509   7.0559   33.237   8.2372   36.627   4.6707 -3.390633 9.469224 
1 1 1   19   30   11 o   44.146   3.9307   42.269   6.5960   41.215   11.773   42.751   7.9632   43.360   6.5831   44.932   4.2970 -1.571983 7.861419 
1 1 1   19   30   12 o   59.149   3.2924   76.606   7.3221   68.958   13.042   80.126   8.8482   56.519   5.5947   61.779   3.4726 -5.259750 6.584810 
1 1 1   19   30   13 f   31.352   5.0706   20.367   5.7957   28.211   11.521   17.710   6.7060   34.633   8.1937   28.070   5.9757 6.563364 10.14128 
1 1 1   19   30   14 o   85.058   2.7810  156.346   9.1269  142.274   15.588  163.687   11.258   81.688   4.6267   88.428   3.0869 -6.739479 5.561975 
1 1 1   19   30   15 o   25.410   6.1203   14.156   8.6976  -0.0682   14.435   22.263   10.898   20.251   8.9134   30.568   8.3896 -10.31666 12.24062 
1 1 1   19   30   16 o   49.284   4.1417   53.956   8.1114   49.779   13.019   56.605   10.370   47.272   6.6775   51.295   4.9016 -4.022984 8.283406 
1 1 1   19   30   17 o   15.847   5.0365  -2.3166   6.7078  -6.2198   11.454  -0.2792   8.2754   16.098   7.4232   15.595   6.8090 0.5025806 10.07307 
1 1 1   19   30   18 o   15.871   4.8740  -3.6514   6.8588 -21.1932   11.578   5.8338   8.5135   12.798   6.2923   18.945   7.4451 -6.146225 9.747942 
1 1 1   19   30   19 o   28.012   5.4783   19.889   7.2660   7.3258   11.860   27.439   9.1935   21.489   8.6723   34.534   6.6962 -13.04539 10.95660 
1 1 1   19   30   20 o   36.750   5.3727   34.690   7.9258   19.086   12.384   45.516   10.315   27.920   9.2388   45.579   5.4872 -17.65857 10.74543 
1 1 1   19   30   21 o   24.035   6.0360   13.383   7.5880   9.8178   12.225   15.617   9.6780   22.585   8.9069   25.485   8.1487 -2.899473 12.07203 
1 1 1   19   30   22 o   63.343   3.6825   87.563   9.4308   90.775   14.971   85.450   12.143   63.939   5.6770   62.747   4.6922 1.191563 7.365063 
1 1 1   19   30   23 f   49.758   4.7665   60.019   8.8488   43.757   13.747   71.523   11.562   42.285   8.1783   57.232   4.8983 -14.94638 9.533004 
1 1 1   19   30   24 o   19.949   5.8260   0.8280   8.7283 -11.9773   11.954   15.450   12.774   14.673   7.0132   25.224   9.3049 -10.55072 11.65191 
1 1 1   19   30   25 o   27.761   6.6871   19.972   9.7179   11.250   13.945   28.209   13.550   23.213   9.3913   32.309   9.5222 -9.095366 13.37416 
1 1 1   19   30   26 o   46.279   5.7409   53.313   10.628   45.586   14.884   61.353   15.181   41.871   8.8935   50.686   7.2620 -8.815765 11.48172 
1 1 1   19   31    0 o  135.123   2.3874  380.185   18.789  380.185   18.789  380.185   18.789  135.123   3.3762  135.123   3.3762 0.000000 0.000000 
1 1 1   19   31    1 o   94.891   3.1329  184.799   11.535  208.385   20.567  173.976   13.932   98.796   5.0474   90.986   3.7127 7.810661 6.265784 
1 1 1   19   31    2 o  106.185   3.0930  239.076   13.517  231.928   19.581  245.583   18.682  104.560   4.5404  107.810   4.2014 -3.250198 6.186036 
1 1 1   19   31    3 o   85.418   2.9806  154.899   10.307  157.998   13.443  150.479   16.056   86.672   3.7607   84.165   4.6253 2.507568 5.961205 
1 1 1   19   31    4 o   73.050   2.8775  113.114   8.6263  101.744   12.313  124.074   12.089   69.328   4.3061   76.771   3.8179 -7.442963 5.754916 
1 1 1   19   31    5 o   20.290   5.2087   6.8433   6.2554  -1.4852   9.4695   13.291   8.3322   16.299   7.1944   24.281   7.5341 -7.981417 10.41740 
1 1 1   19   31    6 o   31.268   5.2626   22.502   6.6505   23.163   10.059   21.988   8.8646   31.558   7.7779   30.978   7.0912 0.5805664 10.52524 
1 1 1   19   31    7 o   39.193   4.8042   35.864   7.2740   24.826   10.784   45.080   9.8531   32.552   8.0717   45.834   5.2122 -13.28155 9.608299 
1 1 1   19   31    8 o   31.107   5.4242   22.303   6.8429   23.906   10.618   21.163   8.9490   31.920   8.0630   30.294   7.2577 1.626677 10.84832 
1 1 1   19   31    9 o   27.256   5.1879   18.141   5.7496   12.719   11.101   20.129   6.7214   24.420   8.7203   30.091   5.6224 -5.671158 10.37575 
1 1 1   19   31   10 o   72.401   2.9415  111.345   8.2702  110.130   14.278  111.959   10.145   71.771   4.8234   73.031   3.3682 -1.259399 5.883013 
1 1 1   19   31   11 o  115.549   2.6114  286.832   12.157  249.424   18.510  315.204   16.121  108.477   4.1373  122.622   3.1876 -14.14503 5.222794 
1 1 1   19   31   12 o   25.611   5.3870   14.751   5.6038   15.589   11.131   14.467   6.4855   26.041   8.7623   25.181   6.2690 0.8598251 10.77393 
1 1 1   19   31   13 o   65.666   3.0913   91.694   7.6370   92.855   14.034   91.205   9.1029   65.503   5.1945   65.829   3.3527 -0.3259048 6.182527 
1 1 1   19   31   14 o   59.853   3.9553   78.231   9.7028   89.810   13.980   67.471   13.477   64.313   5.2704   55.393   5.8991 8.920101 7.910525 
1 1 1   19   31   15 o   46.316   5.5645   56.064   8.7446   36.900   16.164   63.994   10.397   38.024   10.126   54.607   4.6165 -16.58294 11.12893 
1 1 1   19   31   16 o   29.719   5.8770   20.658   7.2322   24.061   12.235   18.831   8.9662   31.247   9.0027   28.191   7.5571 3.056097 11.75407 
1 1 1   19   31   17 o   72.801   3.1885  115.369   9.4030  102.514   14.162  125.503   12.575   68.801   4.9908   76.802   3.9697 -8.001450 6.377036 
1 1 1   19   31   18 f   33.094   5.5806   25.797   7.3448   29.571   11.956   23.510   9.3084   34.713   8.4339   31.474   7.3104 3.239065 11.16127 
1 1 1   19   31   19 f   22.420   5.8879   10.370   7.0293   13.308   11.709   8.7143   8.7894   24.216   8.9125   20.625   7.6965 3.591110 11.77574 
1 1 1   19   31   20 o   14.546   4.7870 -10.5217   6.6387   2.2726   11.386 -17.1122   8.1716   18.712   8.0791   10.379   5.1370 8.333051 9.573945 
1 1 1   19   31   21 o   28.853   6.7341   20.890   9.2749   16.866   12.204   26.391   14.271   26.157   9.1619   31.549   9.8717 -5.391937 13.46813 
1 1 1   19   31   22 o   30.976   6.9348   25.105   10.122   33.541   15.105   18.229   13.636   35.188   9.9592   26.764   9.6531 8.423952 13.86964 
1 1 1   19   31   23 o   36.916   7.8055   44.946   13.903   50.977   15.634   22.147   30.396   44.629   8.8064   29.203   12.890 15.42556 15.61100 
1 1 1   19   31   24 o   34.234   6.9943   34.303   11.494   18.715   17.860   45.323   15.017   26.817   10.705   41.650   9.0040 -14.83295 13.98853 
1 1 1   19   32    0 f   50.737   3.8488   56.063   11.059   56.063   11.059   56.063   11.059   50.737   5.4431   50.737   5.4431 0.000000 0.000000 
1 1 1   19   32    1 o   16.998   5.3561  -1.8370   7.0783  -0.8282   12.630  -2.2989   8.5465   18.896   8.3262   15.100   6.7399 3.795540 10.71223 
1 1 1   19   32    2 o   40.975   4.7694   37.092   7.8486   32.535   10.501   42.860   11.814   37.807   6.9920   44.143   6.4885 -6.336632 9.538820 
1 1 1   19   32    3 o   61.243   3.5950   79.778   8.9924   75.434   11.797   85.802   13.893   59.396   4.8156   63.090   5.3391 -3.694252 7.189945 
1 1 1   19   32    4 o   49.864   3.7778   54.789   7.5749   43.688   11.109   64.435   10.356   44.744   6.0197   54.985   4.5663 -10.24094 7.555681 
1 1 1   19   32    5 o   64.391   3.0761   87.976   8.1308   89.842   12.152   86.463   10.940   64.924   4.5383   63.859   4.1537 1.064167 6.152187 
1 1 1   19   32    6 o   24.212   5.6226   13.087   6.3854   14.065   10.180   12.453   8.1989   24.945   8.3795   23.480   7.4994 1.464396 11.24527 
1 1 1   19   32    7 o   27.380   5.6863   16.996   6.7636   21.704   10.766   13.927   8.6936   30.144   8.3645   24.617   7.7052 5.527178 11.37253 
1 1 1   19   32    8 o   35.771   5.0518   29.992   7.1030   25.913   11.295   32.660   9.1354   32.866   8.3237   38.676   5.7269 -5.809540 10.10359 
1 1 1   19   32    9 o   77.431   2.9654  128.372   9.4004  120.683   13.891  134.868   12.768   75.104   4.4845   79.758   3.8814 -4.653557 5.930898 
1 1 1   19   32   10 o   56.950   3.5214   75.302   7.5130   54.174   12.424   87.484   9.4334   49.538   6.0806   64.362   3.5536 -14.82417 7.042845 
1 1 1   19   32   11 o   43.757   4.3244   43.709   6.5275   40.461   12.642   44.890   7.6221   41.563   7.6568   45.951   4.0217 -4.388290 8.648733 
1 1 1   19   32   12 o   28.750   5.3637   19.335   5.7537   19.093   12.183   19.405   6.5276   28.103   9.1569   29.397   5.5881 -1.293186 10.72737 
1 1 1   19   32   13 o   22.827   5.2532   12.467   5.5743   4.8561   12.021   14.552   6.2916   20.459   8.5427   25.195   6.1161 -4.735992 10.50640 
1 1 1   19   32   14 o   32.808   6.3754   27.613   8.8135   22.475   15.303   30.163   10.781   29.903   10.272   35.714   7.5549 -5.810757 12.75089 
1 1 1   19   32   15 o   63.566   3.5544   90.597   8.9491   74.272   13.875  102.225   11.710   57.962   5.8041   69.171   4.1047 -11.20932 7.108830 
1 1 1   19   32   16 f   28.992   5.6999   21.537   7.3379   13.931   11.905   26.197   9.3184   24.637   8.9989   33.347   6.9984 -8.709963 11.39987 
1 1 1   19   32   17 o   18.523   5.7801   0.3402   8.6527   2.2510   11.575  -2.0802   13.027   18.830   8.1379   18.216   8.2106 0.6136475 11.56020 
1 1 1   19   32   18 o   38.350   5.9169   37.162   9.7527   56.225   13.849   18.406   13.737   49.537   6.7783   27.163   9.7003 22.37396 11.83385 
1 1 1   19   32   19 o   77.355   3.8683  132.735   12.339  131.866   17.236  133.648   17.671   77.149   5.4167   77.561   5.5240 -0.4123764 7.736609 
1 1 1   19   32   20 o   32.377   6.7610   28.539   10.085   35.843   13.703   19.910   14.895   37.172   9.0279   27.582   10.067 9.590441 13.52203 
1 1 1   19   32   21 o   24.474   6.6541   14.299   9.4600   13.799   13.393   14.798   13.364   24.231   9.3900   24.716   9.4307 -0.4852924 13.30824 
1 1 1   19   32   22 o   40.419   6.2839   42.723   10.481   32.657   14.853   52.708   14.793   34.247   9.9340   46.591   7.6984 -12.34404 12.56779 
1 1 1   19   33    0 o   42.896   6.2397   44.620   13.791   44.620   13.791   44.620   13.791   42.896   8.8243   42.896   8.8243 0.000000 0.000000 
1 1 1   19   33    1 o   50.644   4.2779   57.839   8.3902   52.308   14.107   60.866   10.437   48.097   7.1111   53.191   4.7574 -5.094177 8.555705 
1 1 1   19   33    2 o   28.659   5.5635   19.674   6.7994   17.806   9.9624   21.303   9.3031   27.312   8.1926   30.007   7.5293 -2.695169 11.12692 
1 1 1   19   33    3 o   44.446   4.3907   43.650   8.0265   42.527   10.901   44.980   11.862   43.915   6.0186   44.976   6.3945 -1.061516 8.781458 
1 1 1   19   33    4 o   14.648   4.6457  -7.0443   6.1693   3.9654   9.4170 -15.3223   8.1656   18.492   7.6273   10.804   5.3060 7.687967 9.291327 
1 1 1   19   33    5 o   19.609   5.4330   6.3685   6.4779   3.1877   10.036   8.6402   8.4814   18.530   7.7763   20.687   7.5895 -2.156878 10.86606 
1 1 1   19   33    6 o   26.601   5.0627   17.162   6.6757   3.0318   10.391   27.093   8.7114   18.696   7.8826   34.507   6.3551 -15.81060 10.12536 
1 1 1   19   33    7 o   24.770   5.7176   14.058   6.6782   15.977   10.125   12.580   8.8850   26.022   8.3361   23.518   7.8277 2.503601 11.43519 
1 1 1   19   33    8 o   38.704   4.5614   32.830   7.0405   40.242   11.090   27.826   9.1122   42.559   6.3180   34.850   6.5808 7.709526 9.122753 
1 1 1   19   33    9 o   42.366   4.9928   43.511   7.9508   31.629   12.562   51.451   10.269   36.025   8.5780   48.707   5.1119 -12.68203 9.985669 
1 1 1   19   33   10 o   49.626   4.0377   53.402   7.9482   57.023   13.334   51.406   9.8990   50.516   6.3999   48.736   4.9247 1.779587 8.075322 
1 1 1   19   33   11 o   31.175   5.7124   22.525   7.0234   27.135   12.504   20.400   8.4890   32.949   8.9634   29.401   7.0842 3.548050 11.42489 
1 1 1   19   33   12 o   31.702   5.7114   23.946   7.1709   26.430   12.494   22.726   8.7567   32.369   9.0214   31.035   7.0070 1.334185 11.42289 
1 1 1   19   33   13 o   22.806   6.2569   9.0539   8.8413   1.5085   12.204   17.388   12.826   18.958   8.2733   26.654   9.3887 -7.695641 12.51384 
1 1 1   19   33   14 o   44.801   8.5107   55.832   15.677   49.008   19.788   67.336   25.693   42.025   11.210   47.576   12.809 -5.551590 17.02148 
1 1 1   19   33   15 o   35.572   6.6785   32.831   9.9699   31.221   14.034   34.472   14.166   34.604   9.5301   36.540   9.3587 -1.936012 13.35693 
1 1 1   19   33   16 o   32.845   6.2355   27.312   9.7929   44.364   13.916   10.581   13.784   42.461   8.2431   23.229   9.3583 19.23208 12.47102 
1 1 1   19   33   17 o   60.302   4.7266   83.829   11.639   83.211   15.435   84.644   17.720   60.507   6.1848   60.098   7.1491 0.4098091 9.453131 
1 1 1   19   33   18 o   58.345   4.7168   78.794   11.200   63.914   15.429   95.365   16.282   52.002   7.1939   64.688   6.1027 -12.68538 9.433667 
1 1 1   19   33   19 o   62.313   5.9476   95.509   13.946   98.914   25.209   94.008   16.741   60.801   10.052   63.825   6.3595 -3.023560 11.89517 
1 1 1   19   33   20 o   36.444   7.7427   30.104   12.852   71.825   23.922   13.176   15.238   48.720   11.987   24.169   9.8034 24.55114 15.48532 
1 1 1   19   34    0 o   14.977   6.7513   3.0779   13.043   3.0779   13.043   3.0779   13.043   14.977   9.5478   14.977   9.5478 0.000000 0.000000 
1 1 1   19   34    1 o   20.542   5.8545   6.6557   7.6611   0.1201   13.585   9.7032   9.2769   19.494   8.6104   21.590   7.9350 -2.095938 11.70905 
1 1 1   19   34    2 o   24.073   5.6707   13.440   6.6058   12.462   9.6868   14.290   9.0315   23.481   8.1661   24.665   7.8702 -1.184233 11.34134 
1 1 1   19   34    3 o   18.184   5.3693   2.3879   6.8929  -2.1731   9.4852   7.4920   10.034   15.775   7.0666   20.592   8.0858 -4.816537 10.73859 
1 1 1   19   34    4 o   64.671   3.1756   90.302   8.4305   83.116   12.150   96.973   11.707   62.023   4.7498   67.320   4.2164 -5.296982 6.351239 
1 1 1   19   34    5 o   61.372   3.3623   82.061   8.4226   70.071   12.032   93.581   11.794   56.699   5.1452   66.045   4.3296 -9.346287 6.724521 
1 1 1   19   34    6 o   49.778   3.8168   54.827   7.7478   50.120   11.494   58.745   10.489   47.534   5.8630   52.022   4.8883 -4.488380 7.633506 
1 1 1   19   34    7 o   73.714   3.1724  117.518   9.5861  113.303   14.196  121.051   12.997   72.293   4.7610   75.136   4.1940 -2.842545 6.344843 
1 1 1   19   34    8 o   22.930   5.7863   12.002   6.9573   8.1963   11.703   14.082   8.6522   21.537   8.6419   24.322   7.6971 -2.785318 11.57269 
1 1 1   19   34    9 o   19.287   5.3357   4.9859   7.0390  -8.2332   11.814   12.262   8.7647   15.602   7.3095   22.973   7.7749 -7.371035 10.67137 
1 1 1   19   34   10 o   23.092   6.4449   4.3909   7.3128   25.708   17.698   0.0018   8.0304   30.850   11.011   15.334   6.7010 15.51559 12.88982 
1 1 1   19   34   11 f   45.867   6.3474   57.073   9.2020   44.002   20.549   60.351   10.291   39.047   11.778   52.688   4.7359 -13.64137 12.69484 
1 1 1   19   34   12 o   34.382   6.3635   30.261   8.0533   27.984   18.681   30.781   8.9253   31.664   11.312   37.099   5.8330 -5.435629 12.72693 
1 1 1   19   34   13 o   27.290   7.1338   15.960   10.669   30.500   17.659   7.6014   13.389   32.836   11.036   21.745   9.0422 11.09053 14.26754 
1 1 1   19   34   14 o   21.145   7.0097 -16.9272   14.118 -32.2374   17.037   16.627   25.221   14.720   7.3084   27.570   11.964 -12.85021 14.01948 
1 1 1   19   34   15 o   41.305   7.1488   48.435   12.186   39.700   20.877   52.950   15.009   35.795   12.000   46.815   7.7731 -11.01986 14.29759 
1 1 1   19   34   16 o   18.738   6.1752  -6.7223   10.755   2.6854   18.880 -11.2410   13.085   21.950   9.8897   15.526   7.3978 6.423180 12.35045 
1 1 1   19   34   17 o   29.954   7.6960   25.378   11.891   28.748   20.331   23.626   14.660   30.760   11.657   29.148   10.051 1.611952 15.39197 
1 1 1   19   35    0 o   22.563   8.2074   18.093   13.787   18.093   13.787   18.093   13.787   22.563   11.607   22.563   11.607 0.000000 0.000000 
1 1 1   19   35    1 f   30.973   6.0632   25.212   8.0890   18.541   13.964   28.581   9.9236   27.271   9.7758   34.675   7.1753 -7.404295 12.12643 
1 1 1   19   35    2 o   49.437   3.7543   53.793   7.6536   55.078   10.944   52.562   10.708   50.018   5.3048   48.857   5.3139 1.160866 7.508558 
1 1 1   19   35    3 o   25.129   5.7983   15.034   7.4117   21.485   10.068   7.3994   10.951   29.507   8.0493   20.752   8.3481 8.755348 11.59660 
1 1 1   19   35    4 o   62.726   3.6246   86.163   9.1320   86.864   14.659   85.718   11.674   62.502   5.6864   62.950   4.4963 -0.4480133 7.249289 
1 1 1   19   35    5 o   31.605   5.2664   17.842   7.5865   46.848   13.579   4.6802   9.1472   44.803   7.3484   18.408   7.5460 26.39564 10.53288 
1 1 1   19   35    6 o   36.211   5.6249   35.782   8.1359   20.178   14.094   43.581   9.9638   28.051   9.8447   44.372   5.4445 -16.32055 11.24987 
1 1 1   19   35    7 o   35.657   5.7828   32.106   8.0592   28.189   14.295   33.932   9.7577   32.530   9.8262   38.784   6.1000 -6.253830 11.56562 
1 1 1   19   35    8 o   32.631   5.8598   28.619   8.0323   18.831   14.755   32.742   9.5755   27.211   10.006   38.052   6.1013 -10.84106 11.71969 
1 1 1   19   35    9 o   47.220   6.2897   60.811   9.9127   46.572   19.996   65.450   11.414   39.951   11.509   54.488   5.0789 -14.53687 12.57937 
1 1 1   19   35   10 o   23.820   6.2383   13.783   8.0584   2.8968   17.806   16.587   9.0367   21.789   9.7269   25.852   7.8135 -4.062567 12.47651 
1 1 1   19   35   11 o   28.476   7.3805   22.020   11.136   21.304   18.932   22.399   13.769   28.128   11.087   28.824   9.7450 -0.6956253 14.76106 
1 1 1   19   35   12 o   18.353   5.9052  -3.8879   10.327 -18.9106   17.098   4.7391   12.957   16.565   8.0339   20.141   8.6570 -3.576078 11.81046 
1 1 1   19   35   13 o   28.389   9.7641   21.954   13.830   0.0000   0.0000   21.954   13.830  ?   ?    28.389   9.7641      ?      ? 
1 1 1   19   35   14 o   21.508   7.1248  -3.7703   15.153  -2.9100   18.560  -5.4907   26.245   20.369   9.4125   22.648   10.698 -2.278727 14.24961 
1 1 1   19   36    0 o   15.476   7.6658 -15.9301   26.017 -15.9301   26.017 -15.9301   26.017   15.476   10.841   15.476   10.841 0.000000 0.000000 
1 1 1   19   36    1 o   46.659   7.3303   73.226   13.450   34.562   28.652   84.154   15.232   32.505   13.344   60.814   6.0730 -28.30882 14.66062 
1 1 1   19   36    2 o   23.862   6.3788   13.036   8.6642   16.943   12.641   9.5751   11.899   25.853   9.2976   21.870   8.7356 3.983282 12.75759 
1 1 1   19   36    3 o   28.153   6.5939   21.019   8.9225   19.541   13.756   22.092   11.723   27.257   9.7098   29.049   8.9239 -1.792221 13.18779 
1 1 1   19   36    4 o   51.852   4.9226   64.091   10.255   56.238   15.587   70.087   13.619   48.148   7.8489   55.557   5.9433 -7.408234 9.845217 
1 1 1   19   36    5 o   41.521   6.7281   47.885   11.518   35.854   18.277   55.809   14.833   34.753   11.207   48.289   7.4477 -13.53684 13.45625 
1 1 1   19   36    6 o   42.450   6.7334   48.471   11.279   46.087   18.213   49.953   14.364   40.118   10.778   44.782   8.0742 -4.663231 13.46675 
1 1 1   19   36    7 o   19.801   6.1849   0.5924   9.9745   9.3804   15.263  -5.9586   13.178   22.749   9.5704   16.852   7.8370 5.896681 12.36982 
1 1 1   19   36    8 o   22.306   9.5850   7.6890   15.876   7.6890   15.876   0.0000   0.0000   22.306   9.5850  ?   ?       ?      ? 
1 1 1   19   36    9 o   20.665   6.4264   2.8351   10.314   9.8473   16.738  -1.4570   13.095   23.291   9.9202   18.040   8.1721 5.250893 12.85272 
1 1 1   19   36   10 o   21.945   6.4116   5.6802   10.824 -13.7513   17.197   18.427   13.928   17.457   8.3620   26.433   9.7216 -8.975824 12.82313 
1 1 1   20    0    0 o  669.498   9.4424  9299.66  368.404  9299.66  368.404  9299.66  368.404  669.498   13.354  669.498   13.354 0.000000 0.000000 
1 1 1   20    0    1 o  212.585   3.1566  934.223   39.102  934.223   39.102  934.223   39.102  212.585   4.4641  212.585   4.4641 0.000000 0.000000 
1 1 1   20    0    2 o  460.576   3.9917  4384.23  107.198  4384.23  107.198  4384.23  107.198  460.576   5.6451  460.576   5.6451 0.000000 0.000000 
1 1 1   20    0    3 o  389.574   3.0597  3134.17   69.507  3134.17   69.507  3134.17   69.507  389.574   4.3270  389.574   4.3270 0.000000 0.000000 
1 1 1   20    0    4 o  134.560   2.1217  374.134   16.634  374.134   16.634  374.134   16.634  134.560   3.0006  134.560   3.0006 0.000000 0.000000 
1 1 1   20    0    5 o  136.479   2.1186  384.861   16.847  384.861   16.847  384.861   16.847  136.479   2.9961  136.479   2.9961 0.000000 0.000000 
1 1 1   20    0    6 o   47.175   3.3507   47.323   9.0066   47.323   9.0066   47.323   9.0066   47.175   4.7386   47.175   4.7386 0.000000 0.000000 
1 1 1   20    0    7 o  388.916   3.0566  3123.56   69.320  3123.56   69.320  3123.56   69.320  388.916   4.3227  388.916   4.3227 0.000000 0.000000 
1 1 1   20    0    8 o   54.710   3.6985   63.492   11.555   63.492   11.555   63.492   11.555   54.710   5.2305   54.710   5.2305 0.000000 0.000000 
1 1 1   20    0    9 o  459.559   3.4525  4362.68   92.522  4362.68   92.522  4362.68   92.522  459.559   4.8826  459.559   4.8826 0.000000 0.000000 
1 1 1   20    0   10 o   58.020   2.9491   70.565   9.8618   70.565   9.8618   70.565   9.8618   58.020   4.1706   58.020   4.1706 0.000000 0.000000 
1 1 1   20    0   11 o  109.879   2.1779  249.720   13.934  249.720   13.934  249.720   13.934  109.879   3.0800  109.879   3.0800 0.000000 0.000000 
1 1 1   20    0   12 o   26.211   7.0795   19.321   10.205   19.321   10.205   19.321   10.205   26.211   10.012   26.211   10.012 0.000000 0.000000 
1 1 1   20    0   13 o   53.442   4.8648   61.935   14.474   61.935   14.474   61.935   14.474   53.442   6.8798   53.442   6.8798 0.000000 0.000000 
1 1 1   20    0   14 o  152.241   2.4638  479.136   21.853  479.136   21.853  479.136   21.853  152.241   3.4843  152.241   3.4843 0.000000 0.000000 
1 1 1   20    0   15 o   15.605   6.0571   7.0161   7.9352   7.0161   7.9352   7.0161   7.9352   15.605   8.5661   15.605   8.5661 0.000000 0.000000 
1 1 1   20    0   16 o   53.588   3.1199   60.500   9.5996   60.500   9.5996   60.500   9.5996   53.588   4.4121   53.588   4.4121 0.000000 0.000000 
1 1 1   20    0   17 o   31.852   6.4714   25.589   10.426   25.589   10.426   25.589   10.426   31.852   9.1519   31.852   9.1519 0.000000 0.000000 
1 1 1   20    0   18 o   83.567   2.8438  145.202   13.789  145.202   13.789  145.202   13.789   83.567   4.0218   83.567   4.0218 0.000000 0.000000 
1 1 1   20    0   19 o   44.394   4.7432   43.465   11.453   43.465   11.453   43.465   11.453   44.394   6.7078   44.394   6.7078 0.000000 0.000000 
1 1 1   20    0   20 o  247.631   2.8593  1267.45   41.274  1267.45   41.274  1267.45   41.274  247.631   4.0436  247.631   4.0436 0.000000 0.000000 
1 1 1   20    0   21 o  218.881   2.5038  989.917   31.947  989.917   31.947  989.917   31.947  218.881   3.5409  218.881   3.5409 0.000000 0.000000 
1 1 1   20    0   22 o  197.986   4.0918  813.226   47.162  813.226   47.162  813.226   47.162  197.986   5.7867  197.986   5.7867 0.000000 0.000000 
1 1 1   20    0   23 o   31.844   7.6488   27.289   12.731   27.289   12.731   27.289   12.731   31.844   10.817   31.844   10.817 0.000000 0.000000 
1 1 1   20    0   24 o   21.369   7.5571   14.054   11.502   14.054   11.502   14.054   11.502   21.369   10.687   21.369   10.687 0.000000 0.000000 
1 1 1   20    0   25 o   50.218   4.6207   54.887   12.901   54.887   12.901   54.887   12.901   50.218   6.5346   50.218   6.5346 0.000000 0.000000 
1 1 1   20    0   26 o  299.324   3.1459  1855.07   54.897  1855.07   54.897  1855.07   54.897  299.324   4.4489  299.324   4.4489 0.000000 0.000000 
1 1 1   20    0   28 o  123.738   3.6065  319.338   25.929  319.338   25.929  319.338   25.929  123.738   5.1003  123.738   5.1003 0.000000 0.000000 
1 1 1   20    0   29 o  112.214   3.8742  263.739   25.220  263.739   25.220  263.739   25.220  112.214   5.4790  112.214   5.4790 0.000000 0.000000 
1 1 1   20    0   30 o   8.6643   4.3735 -14.5670   9.9157 -14.5670   9.9157 -14.5670   9.9157   8.6643   6.1851   8.6643   6.1851 0.000000 0.000000 
1 1 1   20    0   31 o   14.242   6.3203   2.5932   10.933   2.5932   10.933   2.5932   10.933   14.242   8.9383   14.242   8.9383 0.000000 0.000000 
1 1 1   20    0   32 o   52.945   12.153   78.973   33.195   78.973   33.195   78.973   33.195   52.945   17.187   52.945   17.187 0.000000 0.000000 
1 1 1   20    0   33 o   22.397   9.5468   12.635   22.708   12.635   22.708   12.635   22.708   22.397   13.501   22.397   13.501 0.000000 0.000000 
1 1 1   20    0   34 o   96.325   4.7317  197.928   26.290  197.928   26.290  197.928   26.290   96.325   6.6916   96.325   6.6916 0.000000 0.000000 
1 1 1   20    0   35 o   51.727   4.8196   59.187   13.840   59.187   13.840   59.187   13.840   51.727   6.8160   51.727   6.8160 0.000000 0.000000 
1 1 1   20    0   36 o   22.108   7.9588   15.921   12.888   15.921   12.888   15.921   12.888   22.108   11.255   22.108   11.255 0.000000 0.000000 
1 1 1   20    0   37 f   8.3362   4.2687 -21.2863   11.082 -21.2863   11.082 -21.2863   11.082   8.3362   6.0368   8.3362   6.0368 0.000000 0.000000 
1 1 1   20    0   38 o   13.861   6.2964   1.3707   11.613   1.3707   11.613   1.3707   11.613   13.861   8.9045   13.861   8.9045 0.000000 0.000000 
1 1 1   20    0   39 o   69.884   3.9386  105.058   15.820  105.058   15.820  105.058   15.820   69.884   5.5700   69.884   5.5700 0.000000 0.000000 
1 1 1   20    0   40 o   11.229   5.7693 -40.4270   21.166 -40.4270   21.166 -40.4270   21.166   11.229   8.1590   11.229   8.1590 0.000000 0.000000 
1 1 1   20    0   41 o   20.199   9.1211   8.2660   23.934   8.2660   23.934   8.2660   23.934   20.199   12.899   20.199   12.899 0.000000 0.000000 
1 1 1   20    0   42 o   12.790   6.5394 -40.5280   25.520 -40.5280   25.520 -40.5280   25.520   12.790   9.2481   12.790   9.2481 0.000000 0.000000 
1 1 1   20    0   43 o   15.837   7.7738 -12.7338   25.130 -12.7338   25.130 -12.7338   25.130   15.837   10.994   15.837   10.994 0.000000 0.000000 
1 1 1   20    1    0 o  186.353   3.0369  718.023   32.971  718.023   32.971  718.023   32.971  186.353   4.2949  186.353   4.2949 0.000000 0.000000 
1 1 1   20    1    1 o   99.263   2.6171  203.408   10.711  210.279   15.315  196.829   14.987  100.904   3.6799   97.622   3.7222 3.282166 5.234164 
1 1 1   20    1    2 o  144.639   2.4468  431.903   14.595  440.841   20.801  423.236   20.483  146.113   3.4517  143.165   3.4689 2.948196 4.893588 
1 1 1   20    1    3 o  125.519   2.2998  326.682   11.810  313.199   17.660  337.590   15.884  123.156   3.4767  127.882   3.0115 -4.726799 4.599608 
1 1 1   20    1    4 o  255.322   2.4090  1346.03   25.368  1349.78   36.029  1342.33   35.724  255.674   3.4167  254.969   3.3971 0.7042694 4.818088 
1 1 1   20    1    5 f  163.756   2.2882  552.433   15.307  545.122   20.230  562.224   23.410  162.503   3.0184  165.008   3.4398 -2.505035 4.576322 
1 1 1   20    1    6 o  100.824   2.2218  209.760   9.2359  217.949   13.207  201.923   12.921  102.749   3.1164   98.898   3.1676 3.851288 4.443640 
1 1 1   20    1    7 o  128.992   2.1358  343.313   11.360  353.902   16.252  333.197   15.885  130.936   3.0094  127.047   3.0316 3.888893 4.271627 
1 1 1   20    1    8 o  220.392   2.2841  1002.79   20.762  1008.55   29.495  997.139   29.230  221.019   3.2356  219.766   3.2248 1.252701 4.568177 
1 1 1   20    1    9 o  192.193   2.1964  762.525   17.410  767.981   24.784  757.210   24.461  192.871   3.1156  191.515   3.0968 1.355988 4.392885 
1 1 1   20    1   10 o  284.022   2.5360  1666.13   29.707  1674.19   42.211  1658.22   41.814  284.702   3.5948  283.342   3.5781 1.359467 5.071996 
1 1 1   20    1   11 o   85.336   2.3682  150.211   8.3289  158.610   11.998  142.399   11.571   87.637   3.3194   83.035   3.3788 4.601448 4.736488 
1 1 1   20    1   12 o  153.842   2.3658  491.119   14.824  473.205   22.604  504.637   19.637  151.350   3.6212  156.335   3.0454 -4.985321 4.731528 
1 1 1   20    1   13 o   92.131   3.3830  175.646   12.850  179.279   18.064  171.925   18.284   93.100   4.7044   91.162   4.8629 1.938644 6.766057 
1 1 1   20    1   14 o  122.635   2.3627  311.038   11.837  313.566   15.730  307.737   17.974  123.225   3.0949  122.046   3.5708 1.178360 4.725360 
1 1 1   20    1   15 o  137.687   2.3466  387.633   13.124  413.706   20.697  370.100   16.972  141.504   3.5463  133.870   3.0739 7.633530 4.693131 
1 1 1   20    1   16 o   62.839   2.8277   81.622   7.3284   80.503   10.312   82.765   10.417   62.403   4.0064   63.275   3.9915 -0.8714714 5.655433 
1 1 1   20    1   17 o   49.453   3.8659   50.909   7.8477   47.011   11.358   54.470   10.856   47.619   5.7828   51.287   5.1322 -3.667381 7.731765 
1 1 1   20    1   18 o   93.986   2.7481  182.901   10.631  170.091   15.074  195.580   14.996   90.698   4.0296   97.274   3.7378 -6.576653 5.496265 
1 1 1   20    1   19 o  229.256   2.5099  1086.06   23.730  1093.95   33.841  1078.42   33.284  230.073   3.5663  228.439   3.5326 1.634338 5.019736 
1 1 1   20    1   20 o  136.907   2.4588  387.166   13.880  399.686   19.880  375.258   19.388  139.066   3.4660  134.747   3.4886 4.318665 4.917682 
1 1 1   20    1   21 o  128.670   3.4068  340.867   17.915  357.458   27.513  328.655   23.604  131.341   5.0790  125.999   4.5421 5.342094 6.813673 
1 1 1   20    1   22 f  159.333   3.4876  527.904   22.500  535.465   29.280  517.000   35.161  160.811   4.4145  157.855   5.4005 2.955795 6.975205 
1 1 1   20    1   23 o  115.697   3.0098  276.926   14.354  289.390   20.673  265.324   19.946  118.210   4.2403  113.185   4.2727 5.025543 6.019629 
1 1 1   20    1   24 o   69.249   3.4677   99.737   9.8768   91.520   14.004  107.871   13.933   66.386   5.1144   72.113   4.6844 -5.727348 6.935480 
1 1 1   20    1   25 o  133.989   2.9001  374.308   15.810  357.363   24.135  387.044   20.924  131.257   4.4581  136.721   3.7105 -5.464142 5.800274 
1 1 1   20    1   26 o  234.936   3.3173  1154.75   31.372  1108.94   49.597  1185.31   40.506  230.819   5.2097  239.053   4.1082 -8.234100 6.634668 
1 1 1   20    1   27 o  161.135   4.7930  540.661   31.854   0.0000   0.0000  540.661   31.854  ?   ?   161.135   4.7930      ?      ? 
1 1 1   20    1   28 f   76.165   6.0912  126.051   17.448  129.395   20.974  118.536   31.441   78.410   6.4854   73.919   10.313 4.491417 12.18248 
1 1 1   20    1   29 o   39.993   5.5711   35.978   8.8797   26.001   13.109   44.437   12.071   34.100   9.1362   45.886   6.3780 -11.78568 11.14225 
1 1 1   20    1   30 o  130.596   2.8286  355.635   15.143  349.423   22.587  360.707   20.409  129.486   4.2294  131.705   3.7571 -2.219681 5.657191 
1 1 1   20    1   31 o   55.377   4.0772   64.947   9.2828   70.438   13.088   59.389   13.168   57.799   5.4901   52.954   6.0293 4.845638 8.154364 
1 1 1   20    1   32 f   61.833   4.8608   78.812   11.472   74.041   13.656   90.255   21.148   59.164   5.5962   64.503   7.9493 -5.339317 9.721584 
1 1 1   20    1   33 o   83.583   4.2929  149.717   14.041  144.902   23.721  152.315   17.421   82.118   7.0037   85.048   4.9664 -2.930496 8.585892 
1 1 1   20    1   34 o   43.402   5.2328   42.443   8.9025   32.281   12.971   51.493   12.241   37.651   8.5481   49.153   6.0380 -11.50215 10.46550 
1 1 1   20    1   35 o   68.105   3.8449   98.344   10.769  101.571   15.939   95.633   14.608   69.071   5.5949   67.139   5.2754 1.932663 7.689843 
1 1 1   20    1   36 o   32.979   8.7534   22.768   12.326   12.506   39.407   23.881   12.977   33.955   14.841   32.003   9.2863 1.951931 17.50680 
1 1 1   20    1   37 f   30.659   7.4702   21.685   12.294   6.1066   21.115   29.674   15.121   26.111   11.132   35.207   9.9643 -9.096083 14.94034 
1 1 1   20    1   38 o   18.177   5.6454  -0.8500   8.1611  -2.2422   11.872   0.3973   11.237   17.922   7.9755   18.432   7.9921 -0.5107803 11.29086 
1 1 1   20    1   39 o   61.101   4.0867   81.433   10.212   69.534   14.385   93.522   14.499   56.355   6.1890   65.848   5.3387 -9.493061 8.173438 
1 1 1   20    1   40 o   66.803   4.8085   92.972   12.318   81.750   14.596  120.752   22.965   61.041   5.7976   72.565   7.6731 -11.52489 9.617046 
1 1 1   20    1   41 o   31.562   8.5286   18.459   18.237 -12.5515   26.363   46.917   25.255   22.985   10.816   40.139   13.189 -17.15444 17.05726 
1 1 1   20    1   42 o   27.775   8.4709   12.034   18.584   26.101   25.060  -5.1520   27.700   31.284   12.613   24.267   11.311 7.016745 16.94180 
1 1 1   20    1   43 o   29.191   12.884   17.912   30.369   0.0000   0.0000   17.912   30.369  ?   ?    29.191   12.884      ?      ? 
1 1 1   20    2    0 o  153.695   2.4676  488.221   22.096  488.221   22.096  488.221   22.096  153.695   3.4897  153.695   3.4897 0.000000 0.000000 
1 1 1   20    2    1 o  162.924   2.4615  548.109   16.540  545.080   23.282  551.196   23.502  162.470   3.4744  163.378   3.4877 -0.9081573 4.922934 
1 1 1   20    2    2 o   48.914   3.7164   49.539   7.4894   51.759   10.534   47.271   10.650   50.027   5.1055   47.801   5.4019 2.226089 7.432813 
1 1 1   20    2    3 o  216.911   2.4378  971.655   21.610  970.775   32.853  972.327   28.689  216.805   3.6740  217.017   3.2053 -0.2116089 4.875670 
1 1 1   20    2    4 o  207.642   2.3981  891.658   20.378  878.631   30.675  901.948   27.263  206.266   3.6058  209.019   3.1625 -2.753189 4.796129 
1 1 1   20    2    5 o  284.013   2.5318  1665.76   29.656  1669.05   42.105  1662.53   41.777  284.290   3.5910  283.736   3.5699 0.5537109 5.063515 
1 1 1   20    2    6 o  227.084   2.2926  1064.65   21.473  1063.76   30.367  1065.54   30.366  226.989   3.2437  227.179   3.2409 -0.1905365 4.585245 
1 1 1   20    2    7 o   72.924   2.5211  109.826   7.5822  108.930   10.754  110.712   10.692   72.627   3.5900   73.220   3.5405 -0.5932999 5.042161 
1 1 1   20    2    8 o  104.486   2.2211  225.349   9.5696  223.689   13.375  227.089   13.697  104.093   3.1154  104.879   3.1665 -0.7861633 4.442161 
1 1 1   20    2    9 o  169.269   2.1563  591.442   15.053  599.447   21.409  583.615   21.170  170.402   3.0462  168.136   3.0527 2.265778 4.312568 
1 1 1   20    2   10 o  162.422   2.1522  544.665   14.417  539.764   20.364  549.590   20.413  161.689   3.0536  163.155   3.0335 -1.466324 4.304307 
1 1 1   20    2   11 o  190.989   2.2039  753.193   17.361  751.809   24.527  754.582   24.577  190.813   3.1165  191.165   3.1171 -0.3515778 4.407819 
1 1 1   20    2   12 o  144.680   2.6955  437.846   15.069  416.958   26.087  448.306   18.460  142.008   4.4539  147.352   3.0374 -5.344269 5.391022 
1 1 1   20    2   13 o  115.213   2.8827  271.074   13.368  289.042   21.688  260.065   16.976  118.231   4.4475  112.196   3.6686 6.034958 5.765333 
1 1 1   20    2   14 o  240.841   2.5672  1197.70   25.225  1193.19   33.284  1203.78   38.664  240.343   3.3576  241.340   3.8843 -0.9969177 5.134331 
1 1 1   20    2   15 o  106.259   2.4071  233.760   10.470  237.608   14.039  228.939   15.716  107.259   3.1735  105.260   3.6201 1.998779 4.814133 
1 1 1   20    2   16 o   58.732   3.1856   68.742   7.5598   85.294   12.289   58.665   9.5887   64.206   4.6407   53.259   4.3652 10.94744 6.371109 
1 1 1   20    2   17 o  119.149   2.4898  293.187   12.232  300.372   17.552  286.403   17.056  120.567   3.5297  117.732   3.5125 2.835686 4.979626 
1 1 1   20    2   18 f  109.365   2.5793  247.190   11.633  247.014   16.339  247.371   16.567  109.327   3.6236  109.403   3.6716 -0.7584381E-01 5.158571 
1 1 1   20    2   19 o  224.378   2.4967  1040.31   23.104  1050.38   32.924  1030.54   32.428  225.446   3.5409  223.310   3.5208 2.136307 4.993388 
1 1 1   20    2   20 o  141.715   2.4434  414.831   14.277  404.727   19.914  425.519   20.480  139.941   3.4503  143.489   3.4606 -3.548676 4.886731 
1 1 1   20    2   21 o   88.607   2.9290  162.416   10.704  164.181   15.232  160.694   15.044   89.082   4.1458   88.132   4.1387 0.9506454 5.858039 
1 1 1   20    2   22 f  247.261   3.4020  1275.11   33.550  1300.11   42.588  1234.23   54.467  250.636   4.1199  243.886   5.4148 6.750259 6.803919 
1 1 1   20    2   23 o   45.225   6.2976   46.181   10.651   37.395   18.731   50.379   12.947   41.262   10.859   49.188   6.3821 -7.925392 12.59529 
1 1 1   20    2   24 o  154.583   3.8295  500.823   23.150  510.079   28.670  483.483   39.242  156.854   4.4317  152.311   6.2467 4.542511 7.659037 
1 1 1   20    2   25 o   43.489   5.1229   40.210   8.9632   44.131   12.783   36.417   12.571   45.952   6.7448   41.025   7.7127 4.927113 10.24586 
1 1 1   20    2   26 o   62.832   4.3617   81.223   10.818   86.915   18.423   78.228   13.365   64.376   6.9384   61.289   5.2872 3.086918 8.723310 
1 1 1   20    2   27 o   32.564   6.1389   23.464   8.3974   21.611   12.492   24.992   11.343   31.452   9.1066   33.676   8.2350 -2.223688 12.27786 
1 1 1   20    2   28 o   29.261   6.6066   17.928   8.9352   15.947   11.809   20.582   13.666   27.630   9.0160   30.892   9.6591 -3.262152 13.21318 
1 1 1   20    2   29 o   46.066   4.5824   44.935   8.6823   41.653   12.378   48.113   12.182   44.357   6.7657   47.775   6.1822 -3.418083 9.164852 
1 1 1   20    2   30 o   41.017   5.1019   36.258   8.4248   40.301   12.141   32.503   11.701   43.620   6.7482   38.415   7.6536 5.205135 10.20371 
1 1 1   20    2   31 o  104.464   2.9601  227.592   12.740  242.631   18.446  213.874   17.617  107.770   4.1499  101.159   4.2223 6.610603 5.920257 
1 1 1   20    2   32 o   29.158   6.7700   18.584   10.697   28.181   12.865  -2.9136   19.254   35.184   8.8680   23.131   10.232 12.05277 13.54008 
1 1 1   20    2   33 o   29.118   7.3113   15.786   10.081   23.204   19.292   13.000   11.824   32.764   11.517   25.472   9.0099 7.292368 14.62252 
1 1 1   20    2   34 o   40.818   5.6858   37.481   9.1708   37.593   13.855   37.394   12.235   40.678   8.5306   40.959   7.5195 -0.2809486 11.37156 
1 1 1   20    2   35 o   76.886   3.5391  125.084   11.217  125.535   15.628  124.606   16.110   77.063   4.9168   76.710   5.0919 0.3535156 7.078262 
1 1 1   20    2   36 o   74.769   3.9863  120.217   12.039  115.909   18.825  123.198   15.659   73.338   6.2237   76.200   4.9826 -2.862656 7.972513 
1 1 1   20    2   37 o   60.944   4.3376   80.193   10.851   79.806   14.642   80.664   16.161   60.916   5.8277   60.973   6.4264 -0.5634308E-01 8.675291 
1 1 1   20    2   38 o   16.319   5.2351  -4.6945   7.6582  -2.3723   10.967  -6.9047   10.699   17.177   7.6533   15.460   7.1450 1.716728 10.47017 
1 1 1   20    2   39 o   57.037   4.5697   71.335   10.694   74.578   16.085   68.766   14.317   58.047   6.7187   56.026   6.1958 2.020729 9.139358 
1 1 1   20    2   40 o   41.394   7.9712   42.086   12.026   39.594   13.434   52.136   26.980   40.704   8.2840   42.084   13.621 -1.380489 15.94234 
1 1 1   20    2   41 o   37.196   8.8733   39.214   16.214   41.766   21.396   35.773   24.850   38.794   12.079   35.599   13.002 3.194340 17.74660 
1 1 1   20    2   42 o   32.279   8.7403   11.538   19.095 -22.6263   24.417   65.335   30.640   20.139   9.7269   44.419   14.524 -24.28045 17.48055 
1 1 1   20    2   43 f   64.886   12.629  121.950   32.583   0.0000   0.0000  121.950   32.583  ?   ?    64.886   12.629      ?      ? 
1 1 1   20    3    0 o  207.115   2.5802  886.093   31.149  886.093   31.149  886.093   31.149  207.115   3.6489  207.115   3.6489 0.000000 0.000000 
1 1 1   20    3    1 o  170.467   2.4700  600.027   17.366  594.968   24.444  605.183   24.676  169.742   3.4915  171.193   3.4948 -1.450653 4.940086 
1 1 1   20    3    2 o  222.412   2.6293  1021.64   24.119  1017.09   33.979  1026.26   34.242  221.913   3.7124  222.911   3.7244 -0.9979706 5.258685 
1 1 1   20    3    3 o  113.380   2.3189  266.072   10.756  259.957   16.177  270.918   14.401  112.200   3.4957  114.559   3.0479 -2.359222 4.637862 
1 1 1   20    3    4 o   64.747   2.8285   86.295   7.5124   89.438   11.308   83.812   10.051   65.793   4.1672   63.700   3.8256 2.093395 5.656947 
1 1 1   20    3    5 o  208.558   2.2435  897.947   19.298  890.732   27.198  905.262   27.387  207.714   3.1747  209.402   3.1710 -1.687668 4.487043 
1 1 1   20    3    6 o   81.601   2.3790  137.498   8.0046  133.671   11.297  141.356   11.343   80.459   3.4044   82.742   3.3239 -2.283043 4.757938 
1 1 1   20    3    7 o  302.724   2.6180  1892.09   32.678  1867.48   45.575  1918.13   46.880  300.703   3.6747  304.746   3.7298 -4.043640 5.235926 
1 1 1   20    3    8 o  240.241   2.3500  1191.56   23.283  1202.78   33.197  1180.70   32.664  241.353   3.3349  239.129   3.3118 2.223755 4.699973 
1 1 1   20    3    9 o   70.465   2.5966  102.531   7.5450  105.314   10.766   99.844   10.577   71.405   3.6557   69.525   3.6885 1.880074 5.193153 
1 1 1   20    3   10 o  317.346   2.6947  2079.73   35.256  2112.17   50.738  2049.44   49.025  319.732   3.8475  314.960   3.7739 4.772339 5.389433 
1 1 1   20    3   11 o  292.971   2.5821  1772.51   31.191  1797.09   44.801  1749.39   43.451  294.936   3.6829  291.005   3.6202 3.931488 5.164272 
1 1 1   20    3   12 o   72.501   3.3272  111.257   8.9453  102.836   16.517  114.752   10.641   70.466   5.6833   74.536   3.4613 -4.070747 6.654357 
1 1 1   20    3   13 o   71.960   2.9166  109.718   8.4411  128.456   11.468   87.561   12.470   78.856   3.5260   65.064   4.6469 13.79243 5.833196 
1 1 1   20    3   14 o  211.767   2.8137  928.755   23.095  932.226   28.226  921.724   40.172  212.452   3.2212  211.082   4.6143 1.369904 5.627404 
1 1 1   20    3   15 o  261.860   2.6458  1418.70   28.348  1430.34   37.863  1403.85   42.762  263.120   3.4890  260.600   3.9785 2.519348 5.291616 
1 1 1   20    3   16 o  413.022   3.3227  3535.52   55.096  3505.15   88.532  3554.72   70.387  411.409   5.2175  414.636   4.1159 -3.226959 6.645456 
1 1 1   20    3   17 o   38.922   4.4678   29.382   6.7489   42.587   11.665   22.737   8.2745   45.301   6.2430   32.542   6.3931 12.75928 8.935657 
1 1 1   20    3   18 o  274.418   3.6688  1559.53   41.517  1544.77   58.085  1574.95   59.365  273.098   5.1568  275.738   5.2199 -2.640259 7.337619 
1 1 1   20    3   19 o  219.552   2.6335  993.776   23.716  1020.95   35.656  972.219   31.760  222.212   3.8905  216.892   3.5504 5.320465 5.266948 
1 1 1   20    3   20 o   95.631   3.0201  183.999   11.703  162.803   14.942  217.643   18.824   88.716   4.0835  102.546   4.4508 -13.83003 6.040239 
1 1 1   20    3   21 o  204.492   3.3238  876.783   25.447  892.326   30.351  840.005   46.687  207.766   3.5419  201.217   5.6255 6.548828 6.647690 
1 1 1   20    3   22 o  218.194   3.5740  991.712   31.983  1040.52   43.682  935.319   46.957  224.082   4.7264  212.306   5.3625 11.77605 7.148100 
1 1 1   20    3   23 o   56.656   4.9889   69.641   10.819   59.354   18.421   75.058   13.367   53.195   8.3962   60.118   5.3909 -6.922623 9.977886 
1 1 1   20    3   24 o  109.292   2.9441  246.897   13.168  252.364   19.997  242.711   17.498  110.328   4.3946  108.256   3.9189 2.071625 5.888112 
1 1 1   20    3   25 o   65.850   3.6796   89.948   9.9277  104.874   14.425   76.517   13.684   71.056   4.9221   60.643   5.4710 10.41333 7.359292 
1 1 1   20    3   26 f   88.986   3.3661  163.947   12.255  170.081   18.691  159.322   16.230   90.400   5.0130   87.573   4.4936 2.827385 6.732197 
1 1 1   20    3   27 o   65.066   3.6790   88.286   9.8475   89.017   14.482   87.657   13.430   65.291   5.3780   64.842   5.0218 0.4487762 7.358062 
1 1 1   20    3   28 o   40.229   5.8079   34.680   9.4798   24.216   12.756   47.590   14.168   33.047   9.0792   47.412   7.2453 -14.36465 11.61581 
1 1 1   20    3   29 o   92.298   3.7795  180.307   13.698  172.921   22.956  184.391   17.070   90.571   6.1452   94.025   4.4017 -3.453789 7.558980 
1 1 1   20    3   30 o   87.486   3.1082  159.982   11.193  152.288   16.072  167.227   15.596   85.401   4.5629   89.571   4.2217 -4.170586 6.216378 
1 1 1   20    3   31 o  131.567   3.1539  365.692   16.600  376.647   21.243  348.510   26.604  134.382   3.8327  128.752   5.0100 5.629532 6.307874 
1 1 1   20    3   32 o   29.082   7.6070   11.090   10.365   6.0872   11.647   30.132   22.722   21.678   8.6479   36.486   12.517 -14.80870 15.21402 
1 1 1   20    3   33 o   78.376   4.4399  138.180   12.937  112.414   22.744  150.504   15.730   72.053   7.6535   84.700   4.5028 -12.64674 8.879812 
1 1 1   20    3   34 o   42.529   5.1852   39.800   8.8867   38.026   12.722   41.490   12.419   41.186   7.7742   43.872   6.8633 -2.685780 10.37034 
1 1 1   20    3   35 o   81.911   3.4642  141.197   11.667  126.809   15.976  157.640   17.079   77.416   5.0035   86.406   4.7925 -8.990089 6.928380 
1 1 1   20    3   36 o  109.056   4.2662  255.926   19.100  225.943   26.718  287.265   27.316  102.290   6.3329  115.821   5.7182 -13.53104 8.532449 
1 1 1   20    3   37 o   52.715   4.6676   59.505   10.062   51.506   13.285   70.267   15.410   48.619   6.6252   56.811   6.5768 -8.191025 9.335245 
1 1 1   20    3   38 o   17.433   5.4636  -1.8788   7.8006  -0.5204   11.280  -3.1241   10.800   18.096   7.9239   16.770   7.5244 1.325781 10.92724 
1 1 1   20    3   39 o   30.984   6.3424   23.129   8.5705   23.652   12.123   22.607   12.118   31.325   8.9415   30.643   8.9975 0.6819706 12.68486 
1 1 1   20    3   40 o   61.820   6.7161   92.982   13.532   93.458   15.410   91.380   28.291   65.305   5.7211   58.335   12.153 6.970303 13.43225 
1 1 1   20    3   41 o   28.318   8.4212   15.228   16.440   15.248   21.030   15.197   26.363   27.708   11.410   28.929   12.389 -1.221033 16.84232 
1 1 1   20    3   42 o   47.218   10.060   72.134   21.234   73.705   28.030   70.019   32.531   49.174   13.438   45.261   14.974 3.912739 20.11925 
1 1 1   20    3   43 o   37.399   11.030   50.329   26.031   67.949   53.911   44.971   29.727   38.298   17.022   36.500   14.032 1.798054 22.06010 
1 1 1   20    4    0 o  329.145   3.1675  2237.83   60.787  2237.83   60.787  2237.83   60.787  329.145   4.4796  329.145   4.4796 0.000000 0.000000 
1 1 1   20    4    1 o  137.424   2.4387  389.942   13.821  383.036   19.473  396.955   19.621  136.197   3.4665  138.651   3.4311 -2.454361 4.877426 
1 1 1   20    4    2 o  260.353   2.7982  1400.08   30.043  1390.45   42.109  1410.07   42.877  259.444   3.9352  261.262   3.9791 -1.818817 5.596314 
1 1 1   20    4    3 o  110.328   2.3408  250.780   10.578  255.826   15.996  246.859   14.102  111.305   3.4844  109.352   3.1268 1.953949 4.681682 
1 1 1   20    4    4 o  119.544   2.5882  285.636   12.011  322.954   21.446  268.584   14.497  125.024   4.1591  114.064   3.0816 10.96020 5.176322 
1 1 1   20    4    5 o  188.614   2.3481  733.271   18.072  742.999   27.737  726.094   23.822  189.683   3.5454  187.544   3.0797 2.138641 4.696226 
1 1 1   20    4    6 o  236.840   2.3357  1158.12   22.815  1153.33   32.155  1162.98   32.378  236.347   3.2986  237.333   3.3077 -0.9859467 4.671364 
1 1 1   20    4    7 o  205.170   2.2276  868.999   18.850  860.585   26.539  877.564   26.777  204.168   3.1516  206.173   3.1490 -2.004456 4.455170 
1 1 1   20    4    8 o  143.532   2.1215  425.196   12.558  432.177   17.925  418.468   17.598  144.689   3.0037  142.376   2.9968 2.313004 4.242987 
1 1 1   20    4    9 o  141.927   2.1374  415.817   12.511  410.250   17.573  421.539   17.815  140.964   3.0225  142.890   3.0229 -1.926285 4.274771 
1 1 1   20    4   10 o  154.164   2.1338  490.646   13.566  480.952   19.081  500.553   19.291  152.624   3.0313  155.704   3.0039 -3.080627 4.267520 
1 1 1   20    4   11 o  117.335   2.3436  284.441   11.191  283.622   17.278  285.034   14.689  117.175   3.5751  117.494   3.0312 -0.3191757 4.687168 
1 1 1   20    4   12 o  185.540   2.7273  702.203   19.372  735.797   34.958  687.315   23.272  188.636   4.4932  182.445   3.0926 6.191086 5.454632 
1 1 1   20    4   13 o   59.934   3.1083   73.707   7.5807   70.953   9.8615   77.685   11.852   58.587   4.0811   61.280   4.6894 -2.693310 6.216600 
1 1 1   20    4   14 o  120.028   2.3758  296.717   11.614  292.157   15.211  303.092   17.985  118.940   3.1007  121.115   3.6004 -2.175240 4.751517 
1 1 1   20    4   15 o   82.409   2.8997  141.446   9.7780  129.372   14.356  151.893   13.354   79.089   4.4011   85.730   3.7768 -6.640945 5.799499 
1 1 1   20    4   16 o  302.394   3.0651  1888.46   38.186  1834.02   52.528  1949.48   55.612  297.791   4.2767  306.997   4.3920 -9.206879 6.130278 
1 1 1   20    4   17 o  105.471   2.4732  227.452   10.503  240.731   16.997  219.248   13.360  107.915   3.8187  103.027   3.1440 4.888474 4.946383 
1 1 1   20    4   18 o  148.857   2.6208  459.767   15.937  444.315   24.040  471.883   21.288  146.592   3.9761  151.123   3.4153 -4.530914 5.241558 
1 1 1   20    4   19 o  145.742   2.4828  438.677   14.917  429.249   20.718  448.827   21.496  144.119   3.4855  147.364   3.5367 -3.245346 4.965597 
1 1 1   20    4   20 o   29.413   5.6557   17.798   7.6818   7.0819   10.727   29.076   11.005   22.123   8.4474   36.703   7.5227 -14.57965 11.31147 
1 1 1   20    4   21 o  145.391   3.2777  438.152   18.489  438.921   22.610  436.599   32.123  145.688   3.7628  145.094   5.3679 0.5934906 6.555384 
1 1 1   20    4   22 o   81.277   3.0961  136.983   10.365  143.127   14.542  130.637   14.778   83.142   4.2408   79.411   4.5121 3.731522 6.192198 
1 1 1   20    4   23 o   65.458   4.4251   91.428   11.065   83.165   19.298   95.474   13.505   63.072   7.4185   67.844   4.8262 -4.772640 8.850242 
1 1 1   20    4   24 o   63.868   3.9246   84.906   10.238   84.508   15.580   85.209   13.581   63.697   5.9303   64.040   5.1420 -0.3425102 7.849128 
1 1 1   20    4   25 o   36.422   6.8480   29.362   10.012   26.808   17.981   30.510   12.054   35.438   11.079   37.406   8.0516 -1.967461 13.69607 
1 1 1   20    4   26 o   75.325   3.7166  115.221   11.304  132.941   18.382  104.446   14.334   79.812   5.5843   70.839   4.9061 8.972679 7.433267 
1 1 1   20    4   27 o   76.875   3.2814  123.089   10.400  120.292   14.789  125.826   14.629   75.999   4.7182   77.752   4.5617 -1.753510 6.562788 
1 1 1   20    4   28 o   35.023   6.1692   26.831   9.0443   18.950   12.304   36.096   13.340   29.608   9.1499   40.438   8.2774 -10.82983 12.33837 
1 1 1   20    4   29 o   68.541   3.6072   98.381   10.197   98.744   14.359   98.013   14.482   68.675   5.0696   68.407   5.1330 0.2676697 7.214444 
1 1 1   20    4   30 o  123.718   3.6251  320.768   18.496  314.856   26.009  326.817   26.309  122.558   5.1454  124.879   5.1080 -2.320930 7.250301 
1 1 1   20    4   31 o   65.970   3.5955   91.601   9.7824   91.718   13.760   91.482   13.910   66.021   5.0533   65.919   5.1161 0.1016235 7.191051 
1 1 1   20    4   32 f   39.749   7.1849   30.609   10.215   25.289   11.500   50.507   22.240   33.423   8.3626   46.075   11.686 -12.65235 14.36987 
1 1 1   20    4   33 o   38.828   5.6142   33.749   8.6859   36.072   12.489   31.571   12.089   40.192   7.8150   37.463   8.0625 2.729111 11.22846 
1 1 1   20    4   34 o   51.926   4.3235   57.676   9.2338   63.284   13.199   52.302   12.922   54.470   5.8753   49.383   6.3445 5.087288 8.647066 
1 1 1   20    4   35 o   29.414   6.3701   19.660   8.7580   12.995   12.921   25.325   11.912   25.666   9.3749   33.162   8.6270 -7.496521 12.74024 
1 1 1   20    4   36 o   39.675   5.6659   36.772   9.1171   21.080   12.956   52.167   12.832   30.211   9.3981   49.139   6.3315 -18.92865 11.33189 
1 1 1   20    4   37 o   43.717   5.2735   43.181   9.1965   39.289   13.529   46.524   12.539   41.247   8.2407   46.186   6.5825 -4.938995 10.54696 
1 1 1   20    4   38 o   57.340   4.2607   71.590   10.060   76.128   14.229   67.055   14.224   59.258   5.8217   55.423   6.2226 3.835506 8.521339 
1 1 1   20    4   39 f   22.535   6.7663  -6.7777   10.288 -16.7831   11.892   22.987   20.511   13.951   6.7502   31.120   11.729 -17.16903 13.53262 
1 1 1   20    4   40 o   35.084   7.7043   33.005   11.548   34.872   12.877   25.333   26.099   38.046   8.4279   32.121   12.899 5.925735 15.40854 
1 1 1   20    4   41 o   24.739   7.8522   1.5172   16.912   8.8681   22.420  -8.1870   25.760   26.069   11.296   23.409   10.910 2.659676 15.70442 
1 1 1   20    4   42 o   44.557   9.6297   75.208   25.844   3.2844   51.034  100.015   29.972   30.244   14.465   58.871   12.715 -28.62742 19.25933 
1 1 1   20    4   43 o   30.324   9.8507   18.737   25.722   26.531   50.676   16.033   29.853   32.179   15.096   28.468   12.659 3.710815 19.70139 
1 1 1   20    4   44 o   21.662   10.483 -18.3233   28.706   0.0000   0.0000 -18.3233   28.706  ?   ?    21.662   10.483      ?      ? 
1 1 1   20    5    0 o   40.262   4.6222   36.029   9.9966   36.029   9.9966   36.029   9.9966   40.262   6.5367   40.262   6.5367 0.000000 0.000000 
1 1 1   20    5    1 o  214.905   2.5947  953.813   22.998  951.719   32.431  955.931   32.620  214.669   3.6629  215.142   3.6761 -0.4732971 5.189443 
1 1 1   20    5    2 o  269.065   2.8378  1495.58   31.493  1500.91   44.620  1490.28   44.455  269.543   4.0136  268.587   4.0130 0.9563599 5.675691 
1 1 1   20    5    3 o   75.834   2.6318  119.193   8.1530  115.553   12.312  122.035   10.881   74.790   3.9912   76.877   3.4316 -2.086403 5.263597 
1 1 1   20    5    4 o   78.420   2.6258  127.445   8.4091  123.760   12.721  130.304   11.207   77.401   3.9850   79.439   3.4204 -2.038109 5.251569 
1 1 1   20    5    5 o  220.243   2.4502  1001.12   22.039  1005.39   33.637  997.910   29.173  220.635   3.6964  219.852   3.2173 0.7826691 4.900419 
1 1 1   20    5    6 f  186.255   2.3403  714.810   17.782  726.091   27.337  706.536   23.411  187.510   3.5348  184.999   3.0682 2.510284 4.680669 
1 1 1   20    5    7 o  103.993   2.2148  223.296   9.4985  219.272   13.439  227.314   13.427  103.055   3.1617  104.931   3.1026 -1.875259 4.429682 
1 1 1   20    5    8 o   82.824   2.3812  141.734   8.1226  132.248   11.433  151.400   11.542   80.021   3.4642   85.627   3.2680 -5.605621 4.762420 
1 1 1   20    5    9 o  198.668   2.2142  814.850   18.141  806.080   25.449  823.910   25.867  197.582   3.1229  199.754   3.1397 -2.171860 4.428311 
1 1 1   20    5   10 o  147.968   2.1368  452.057   13.040  453.035   18.466  451.085   18.418  148.128   3.0225  147.809   3.0212 0.3190613 4.273559 
1 1 1   20    5   11 o   80.234   3.0788  134.051   9.3740  130.611   16.880  135.585   11.272   79.444   5.1516   81.023   3.3730 -1.579575 6.157631 
1 1 1   20    5   12 o  204.814   2.9278  863.256   24.028  883.329   39.113  851.088   30.452  206.663   4.5887  202.966   3.6377 3.697281 5.855689 
1 1 1   20    5   13 o  142.545   2.3602  418.566   13.696  412.756   17.922  426.724   21.237  141.377   3.0735  143.713   3.5828 -2.336426 4.720491 
1 1 1   20    5   14 o   86.846   2.7564  156.728   9.8169  172.267   13.700  140.332   14.074   91.306   3.6381   82.385   4.1418 8.920799 5.512715 
1 1 1   20    5   15 o  116.433   2.5250  280.408   12.076  276.760   17.841  283.491   16.405  115.723   3.7380  117.144   3.3954 -1.420654 5.049948 
1 1 1   20    5   16 o  116.003   2.5399  278.629   12.096  271.934   17.870  284.290   16.433  114.702   3.7773  117.304   3.3965 -2.602463 5.079817 
1 1 1   20    5   17 o  123.010   2.3737  315.533   11.736  299.009   18.568  326.527   15.145  120.275   3.7429  125.744   2.9202 -5.468925 4.747315 
1 1 1   20    5   18 o  125.097   2.5052  323.054   12.915  304.817   17.968  342.544   18.575  121.445   3.5873  128.749   3.4981 -7.303291 5.010486 
1 1 1   20    5   19 o   40.613   4.9731   34.902   8.1378   37.244   11.486   32.541   11.531   42.332   6.5784   38.893   7.4600 3.439144 9.946222 
1 1 1   20    5   20 o   24.116   6.1186   10.315   7.7531   8.8258   11.431   11.585   10.551   23.526   8.7775   24.707   8.5265 -1.180946 12.23711 
1 1 1   20    5   21 o   79.169   4.5705  128.999   14.767  121.568   19.310  139.467   22.918   76.486   6.1213   81.853   6.7887 -5.366020 9.140903 
1 1 1   20    5   22 o   93.303   2.9351  180.222   11.294  178.795   15.856  181.692   16.091   92.929   4.1370   93.676   4.1647 -0.7472305 5.870221 
1 1 1   20    5   23 o   90.042   3.5631  172.420   12.600  153.834   20.688  183.379   15.886   85.990   5.8333   94.094   4.0934 -8.104698 7.126271 
1 1 1   20    5   24 o   80.868   4.0104  140.738   12.729  154.155   16.209  119.156   20.559   86.199   4.5593   75.537   6.5988 10.66219 8.020717 
1 1 1   20    5   25 o   25.266   6.5914   9.5222   9.1426   16.622   14.239   4.5425   11.925   28.998   9.9095   21.534   8.6942 7.464890 13.18286 
1 1 1   20    5   26 o   58.151   4.0464   71.345   9.6074   62.172   13.923   79.683   13.274   54.483   6.1960   61.820   5.2061 -7.337517 8.092793 
1 1 1   20    5   27 o   57.895   3.9272   70.052   9.3482   77.799   13.450   62.812   13.002   61.019   5.3445   54.770   5.7556 6.248486 7.854302 
1 1 1   20    5   28 o   19.490   5.7516   1.2146   7.8875   6.0670   11.208  -3.5469   11.102   21.615   8.5271   17.364   7.7209 4.250940 11.50322 
1 1 1   20    5   29 o   25.840   6.3163   13.182   8.3467   16.842   11.394   8.9446   12.261   27.998   8.8301   23.683   9.0339 4.314642 12.63257 
1 1 1   20    5   30 o   74.675   3.3800  116.820   10.396  109.773   14.696  123.878   14.708   72.385   4.9223   76.964   4.6333 -4.578995 6.759934 
1 1 1   20    5   31 o  102.751   3.5171  223.587   14.142  227.063   17.525  217.099   23.943  104.234   4.0764  101.268   5.7325 2.966141 7.034114 
1 1 1   20    5   32 o   24.073   6.2173   10.824   8.0232   9.7161   10.957   12.104   11.781   23.206   8.6063   24.941   8.9751 -1.735023 12.43467 
1 1 1   20    5   33 o  143.046   2.7779  427.029   16.369  417.413   22.508  437.824   23.849  141.371   3.8603  144.721   3.9956 -3.350235 5.555740 
1 1 1   20    5   34 o   36.208   6.1920   36.299   10.356   2.1881   20.216   48.435   12.058   24.863   10.750   47.554   6.1481 -22.69011 12.38399 
1 1 1   20    5   35 o   20.770   6.0202   2.0718   8.3006   11.295   13.406  -3.6624   10.571   24.945   9.4627   16.596   7.4452 8.348841 12.04049 
1 1 1   20    5   36 o   48.767   4.5935   51.695   9.1977   48.996   13.410   54.094   12.639   47.427   6.8554   50.106   6.1159 -2.679474 9.187033 
1 1 1   20    5   37 o   55.989   4.2826   68.576   9.7215   54.865   13.769   82.206   13.728   50.066   6.6679   61.913   5.3760 -11.84769 8.565141 
1 1 1   20    5   38 o   59.000   4.3660   76.783   10.481   83.116   14.157   69.100   15.592   62.043   5.5322   55.956   6.7560 6.087009 8.732023 
1 1 1   20    5   39 o   49.920   7.6125   63.836   12.604   64.710   14.066   60.271   28.400   54.170   6.2955   45.670   13.862 8.499500 15.22496 
1 1 1   20    5   40 o   27.556   7.5019   17.180   11.537   20.522   12.914   3.9623   25.682   28.979   9.4270   26.132   11.672 2.847397 15.00377 
1 1 1   20    5   41 o   54.626   8.1844   71.251   20.625  158.130   34.084   21.062   25.906   78.959   10.466   30.293   12.586 48.66600 16.36887 
1 1 1   20    5   42 f   29.895   9.3845   15.932   25.217 -34.6645   49.334   33.828   29.340   26.288   12.937   33.502   13.598 -7.214087 18.76890 
1 1 1   20    5   43 o   39.381   11.134   63.003   27.119   65.350   51.864   62.120   31.814   37.464   16.671   41.299   14.761 -3.834248 22.26702 
1 1 1   20    5   44 o   24.751   11.549   1.9850   29.003   0.0000   0.0000   1.9850   29.003  ?   ?    24.751   11.549      ?      ? 
1 1 1   20    6    0 o  283.810   2.9176  1663.69   48.276  1663.69   48.276  1663.69   48.276  283.810   4.1261  283.810   4.1261 0.000000 0.000000 
1 1 1   20    6    1 o  276.246   2.8747  1576.57   32.753  1577.23   46.338  1575.92   46.301  276.304   4.0662  276.189   4.0646 0.1151123 5.749302 
1 1 1   20    6    2 o   98.554   2.5442  200.065   10.318  181.730   14.233  220.368   14.978   93.804   3.6789  103.303   3.5153 -9.498451 5.088419 
1 1 1   20    6    3 o  438.334   3.5927  3975.32   64.360  3960.54   97.741  3986.62   85.517  437.530   5.4163  439.138   4.7216 -1.608246 7.185369 
1 1 1   20    6    4 o  214.792   2.4225  954.860   21.320  932.518   31.834  973.029   28.709  212.492   3.6324  217.093   3.2063 -4.601730 4.845043 
1 1 1   20    6    5 o   96.178   2.3888  191.524   9.4188  185.936   13.999  196.145   12.731   94.885   3.5772   97.471   3.1669 -2.585350 4.777612 
1 1 1   20    6    6 o  190.030   2.3536  743.653   18.231  758.688   28.138  732.775   23.934  191.663   3.5595  188.397   3.0802 3.266129 4.707211 
1 1 1   20    6    7 o  221.622   2.4793  1013.07   22.396  1005.66   29.444  1023.25   34.497  220.686   3.2349  222.557   3.7581 -1.870697 4.958625 
1 1 1   20    6    8 o  262.500   2.6399  1424.02   28.298  1426.84   37.495  1420.29   43.133  262.835   3.4588  262.164   3.9891 0.6709595 5.279791 
1 1 1   20    6    9 o   72.139   2.7232  108.080   8.0540  101.222   11.818  114.026   11.005   69.983   4.0945   74.296   3.5914 -4.313370 5.446433 
1 1 1   20    6   10 o   64.387   3.1691   84.427   8.0686   90.203   13.693   81.355   9.9863   66.026   5.0283   62.748   3.8587 3.278828 6.338293 
1 1 1   20    6   11 o  180.824   2.6943  681.259   18.915  658.725   32.573  692.723   23.233  178.487   4.4247  183.161   3.0754 -4.673843 5.388541 
1 1 1   20    6   12 o  235.482   2.5465  1148.16   24.501  1127.06   37.105  1164.46   32.624  233.529   3.8524  237.436   3.3314 -3.907074 5.093017 
1 1 1   20    6   13 o  115.644   2.3908  277.083   11.251  281.463   14.815  271.115   17.292  116.744   3.0769  114.544   3.6602 2.199936 4.781654 
1 1 1   20    6   14 o  130.501   2.3364  348.152   12.398  331.426   16.068  372.762   19.491  126.682   3.0753  134.320   3.5182 -7.638176 4.672853 
1 1 1   20    6   15 o  109.364   2.8860  246.316   12.409  250.537   21.091  244.081   15.347  110.036   4.6472  108.693   3.4234 1.342918 5.771992 
1 1 1   20    6   16 o  324.236   3.1905  2174.52   42.657  2145.54   59.585  2204.98   61.097  322.027   4.4862  326.444   4.5378 -4.417389 6.381028 
1 1 1   20    6   17 o  198.962   2.8105  800.948   20.439  856.406   40.078  781.455   23.761  203.402   4.7773  194.523   2.9617 8.879761 5.620908 
1 1 1   20    6   18 o  110.965   2.6175  254.516   11.979  255.930   17.053  253.140   16.830  111.268   3.7159  110.662   3.6874 0.6061859 5.234957 
1 1 1   20    6   19 o  141.365   2.5562  413.416   14.863  408.664   21.776  417.560   20.336  140.590   3.7554  142.139   3.4689 -1.548920 5.112363 
1 1 1   20    6   20 o  146.971   2.6736  447.025   16.105  449.926   21.637  443.421   24.116  147.529   3.5559  146.413   3.9935 1.116470 5.347198 
1 1 1   20    6   21 o   42.690   6.6833   45.483   10.630   53.153   12.360   23.704   20.828   50.578   5.9253   34.802   11.981 15.77573 13.36658 
1 1 1   20    6   22 o  198.332   2.5195  813.646   20.609  822.420   29.218  804.958   29.074  199.398   3.5528  197.266   3.5734 2.131638 5.039032 
1 1 1   20    6   23 o  141.674   3.4626  414.318   20.116  437.373   30.423  396.409   26.814  145.121   5.0829  138.227   4.7034 6.893311 6.925129 
1 1 1   20    6   24 o  198.580   2.6509  817.660   21.661  799.104   31.520  834.265   29.817  196.411   3.8910  200.749   3.6012 -4.338699 5.301712 
1 1 1   20    6   25 o  129.735   3.3389  347.866   17.005  356.106   29.027  343.561   20.982  130.748   5.3827  128.722   3.9522 2.026001 6.677824 
1 1 1   20    6   26 o  165.308   2.5676  566.450   17.502  580.973   25.050  552.598   24.464  167.378   3.6286  163.238   3.6337 4.139816 5.135216 
1 1 1   20    6   27 o   43.520   4.7932   39.956   8.5984   41.128   12.086   38.755   12.235   44.187   6.6317   42.854   6.9225 1.333702 9.586417 
1 1 1   20    6   28 o  195.187   3.0215  795.536   24.039  805.258   31.780  782.534   36.753  196.745   3.9163  193.629   4.6021 3.116196 6.042958 
1 1 1   20    6   29 o   79.507   3.5142  132.026   11.349  130.912   14.794  133.620   17.693   79.197   4.5291   79.817   5.3745 -0.6202011 7.028418 
1 1 1   20    6   30 o   84.615   3.1228  149.720   10.884  139.944   15.267  159.825   15.522   81.777   4.5265   87.454   4.3032 -5.677116 6.245540 
1 1 1   20    6   31 o  108.115   3.9344  248.635   15.442  250.402   18.046  243.804   29.844  109.481   3.9964  106.749   6.7785 2.732201 7.868878 
1 1 1   20    6   32 o   59.035   4.0492   74.691   9.6942   89.519   13.666   59.675   13.753   65.169   5.0845   52.902   6.3033 12.26707 8.098407 
1 1 1   20    6   33 o   72.893   3.4249  111.965   10.276  103.644   14.506  120.346   14.559   70.118   5.0158   75.668   4.6649 -5.550079 6.849774 
1 1 1   20    6   34 o   30.664   6.8554   23.215   10.480  -1.1108   22.364   30.061   11.864   25.005   11.046   36.323   8.1228 -11.31838 13.71077 
1 1 1   20    6   35 o   22.838   6.2518   8.5365   8.4430   6.1618   12.269   10.672   11.636   21.853   8.8202   23.824   8.8625 -1.971981 12.50360 
1 1 1   20    6   36 o   48.739   4.9037   53.010   9.4363   42.873   13.502   62.689   13.193   43.483   7.8161   53.996   5.9240 -10.51373 9.807408 
1 1 1   20    6   37 o   32.363   6.1472   24.458   8.4827   30.740   12.453   19.020   11.586   36.156   8.4950   28.571   8.8875 7.584963 12.29438 
1 1 1   20    6   38 o   15.993   5.2137  -6.6341   7.9515  -6.8952   10.779  -6.3222   11.778   15.497   7.1654   16.489   7.5755 -0.9916611 10.42741 
1 1 1   20    6   39 o   77.917   5.1728  132.498   13.969  128.299   15.872  146.921   29.417   77.138   4.9889   78.695   9.0631 -1.557632 10.34551 
1 1 1   20    6   40 o   37.594   7.9465   36.262   11.986   35.407   13.579   39.279   25.508   38.083   8.8185   37.105   13.222 0.9782639 15.89300 
1 1 1   20    6   41 o   50.838   8.5008   74.313   18.078   85.589   23.448   57.789   28.384   58.727   9.6807   42.948   13.976 15.77921 17.00164 
1 1 1   20    6   42 f   33.743   9.5786   33.326   21.526   14.665   31.435   49.802   29.537   28.847   12.898   38.638   14.165 -9.790735 19.15721 
1 1 1   20    6   43 o   25.207   8.3203  -4.5989   23.299 -80.8398   49.160   17.486   26.459   22.452   11.325   27.962   12.193 -5.509789 16.64063 
1 1 1   20    6   44 o   36.996   14.312   52.841   31.074   0.0000   0.0000   52.841   31.074  ?   ?    36.996   14.312      ?      ? 
1 1 1   20    7    0 o  161.647   2.4493  539.956   23.070  539.956   23.070  539.956   23.070  161.647   3.4639  161.647   3.4639 0.000000 0.000000 
1 1 1   20    7    1 o  230.306   2.6585  1095.56   25.253  1097.75   35.729  1093.37   35.697  230.536   3.7577  230.075   3.7618 0.4604645 5.317072 
1 1 1   20    7    2 o  225.025   2.6348  1045.33   24.445  1026.73   34.015  1065.19   35.154  222.959   3.6989  227.090   3.7533 -4.131561 5.269675 
1 1 1   20    7    3 o  335.286   3.2060  2322.80   44.315  2293.04   61.607  2354.70   63.792  333.070   4.4846  337.502   4.5828 -4.431183 6.411980 
1 1 1   20    7    4 o  295.911   2.7838  1813.30   33.824  1759.86   49.841  1858.93   46.051  291.831   4.1409  299.991   3.7219 -8.159943 5.567691 
1 1 1   20    7    5 o  187.356   2.3349  724.244   17.869  729.247   27.271  720.479   23.655  187.906   3.5188  186.807   3.0702 1.099152 4.669887 
1 1 1   20    7    6 f   65.791   2.8083   89.865   7.5493   86.065   11.347   92.883   10.112   64.527   4.2634   67.055   3.6565 -2.527824 5.616578 
1 1 1   20    7    7 o  168.171   2.2894  584.189   15.741  582.820   23.875  585.242   20.935  167.982   3.4460  168.361   3.0149 -0.3791656 4.578742 
1 1 1   20    7    8 o  159.251   2.1233  523.302   13.942  509.889   19.430  537.537   20.017  157.149   2.9977  161.353   3.0079 -4.203720 4.246592 
1 1 1   20    7    9 o  286.555   2.5481  1696.19   30.114  1686.33   42.363  1706.25   42.816  285.715   3.5949  287.395   3.6121 -1.679810 5.096163 
1 1 1   20    7   10 o  100.719   2.4085  209.613   9.8891  208.958   15.174  210.096   13.038  100.570   3.6581  100.868   3.1341 -0.2979507 4.817090 
1 1 1   20    7   11 o  157.631   2.6506  514.979   16.183  508.962   28.158  517.946   19.776  156.887   4.3517  158.376   3.0275 -1.489380 5.301194 
1 1 1   20    7   12 o  276.092   3.0917  1583.49   33.284  1554.70   57.045  1598.36   40.984  274.050   5.0469  278.135   3.5727 -4.084839 6.183454 
1 1 1   20    7   13 o  252.638   2.8047  1318.68   29.215  1345.83   41.975  1293.16   40.687  255.156   3.9886  250.120   3.9441 5.036621 5.609331 
1 1 1   20    7   14 o  166.932   2.4536  576.152   16.844  570.112   24.712  581.394   23.020  166.102   3.6071  167.763   3.3269 -1.660767 4.907110 
1 1 1   20    7   15 o  138.518   2.3318  391.875   12.979  415.907   21.136  377.324   16.446  141.865   3.6122  135.172   2.9499 6.693222 4.663673 
1 1 1   20    7   16 o  214.668   2.5462  947.558   22.284  982.970   34.494  922.195   29.192  218.062   3.8353  211.273   3.3501 6.788483 5.092444 
1 1 1   20    7   17 o  225.004   2.5425  1050.41   23.445  1005.42   34.744  1088.03   31.768  220.531   3.8198  229.477   3.3565 -8.946289 5.085013 
1 1 1   20    7   18 o  199.167   2.5624  820.577   21.002  810.327   30.633  829.670   28.851  197.976   3.7515  200.359   3.4913 -2.382950 5.124771 
1 1 1   20    7   19 o  108.346   2.6206  242.607   11.708  235.541   16.390  249.969   16.729  106.735   3.7231  109.958   3.6888 -3.222939 5.241113 
1 1 1   20    7   20 o  347.341   4.7337  2499.21   67.815  2499.21   67.815   0.0000   0.0000  347.341   4.7337  ?   ?       ?      ? 
1 1 1   20    7   21 o  319.410   3.1472  2101.53   40.533  2058.33   51.861  2169.34   64.976  315.358   3.9872  323.462   4.8704 -8.104034 6.294337 
1 1 1   20    7   22 o  159.809   2.5262  528.263   16.648  522.288   23.301  534.493   23.795  158.888   3.5557  160.729   3.5894 -1.840851 5.052343 
1 1 1   20    7   23 f  100.460   3.3221  209.538   13.225  209.066   21.975  209.807   16.560  100.283   5.3129  100.636   3.9896 -0.3533096 6.644123 
1 1 1   20    7   24 o  139.273   3.0156  405.671   16.777  387.983   27.040  416.742   21.393  136.682   4.7965  141.865   3.6562 -5.183914 6.031119 
1 1 1   20    7   25 o   77.076   3.8523  122.891   11.847  127.919   19.560  119.979   14.888   78.207   6.0638   75.946   4.7531 2.261391 7.704691 
1 1 1   20    7   26 o  109.815   2.7835  249.973   12.593  266.944   18.201  234.387   17.443  113.394   3.8917  106.237   3.9808 7.156090 5.567051 
1 1 1   20    7   27 o   94.096   2.9847  184.305   11.580  179.001   16.362  189.629   16.391   92.728   4.2782   95.465   4.1630 -2.736870 5.969345 
1 1 1   20    7   28 o  117.409   3.8607  287.875   18.591  302.102   28.064  276.750   24.817  119.900   5.6751  114.918   5.2358 4.981598 7.721416 
1 1 1   20    7   29 o   91.209   4.3678  186.999   15.248  116.231   22.594  246.185   20.662   73.855   7.4174  108.563   4.6146 -34.70830 8.735668 
1 1 1   20    7   30 o   24.053   5.9586   10.759   7.6475   16.655   10.718   4.6432   10.915   27.569   8.5433   20.536   8.3086 7.032892 11.91721 
1 1 1   20    7   31 o   43.771   6.9345   50.913   11.299   58.848   12.995   26.334   22.872   52.644   5.9852   34.899   12.511 17.74453 13.86902 
1 1 1   20    7   32 o   59.741   3.9525   75.900   9.6663   86.343   13.675   65.470   13.666   63.976   5.1824   55.506   5.9692 8.470261 7.905039 
1 1 1   20    7   33 o   43.774   5.1994   43.193   8.8822   31.000   12.732   54.752   12.397   36.856   8.5426   50.692   5.9294 -13.83554 10.39876 
1 1 1   20    7   34 o   41.213   7.2005   52.286   12.172  -4.9193   33.575   60.943   13.060   29.028   13.123   53.398   5.9301 -24.37055 14.40100 
1 1 1   20    7   35 o   60.607   4.0054   78.846   9.9704   74.185   14.473   83.055   13.755   58.776   5.9701   62.438   5.3413 -3.662365 8.010718 
1 1 1   20    7   36 o   57.850   4.1881   72.580   9.9083   65.459   14.450   78.899   13.613   54.959   6.3747   60.741   5.4337 -5.782188 8.376249 
1 1 1   20    7   37 o   75.386   3.5551  121.618   11.038  120.404   15.986  122.725   15.260   74.948   5.1716   75.825   4.8796 -0.8769455 7.110271 
1 1 1   20    7   38 o   45.055   5.2176   46.280   9.3782   39.967   13.369   52.396   13.159   41.349   8.1291   48.760   6.5432 -7.411602 10.43527 
1 1 1   20    7   39 o   21.335   6.9510  -4.2259   10.864  -6.1780   12.036   4.3591   25.241   16.565   7.6281   26.104   11.622 -9.538584 13.90191 
1 1 1   20    7   40 o   25.350   7.6006   6.3294   10.816   2.8003   11.918   22.799   25.747   19.539   8.3477   31.162   12.704 -11.62300 15.20119 
1 1 1   20    7   41 o   29.463   8.1348   20.845   12.614   20.906   14.007   20.584   29.014   28.732   9.8284   30.193   12.965 -1.461267 16.26955 
1 1 1   20    7   42 o   22.298   7.5844 -18.2367   20.031 -18.4848   31.808 -18.0737   25.787   23.350   11.233   21.246   10.193 2.103354 15.16881 
1 1 1   20    7   43 o   28.036   9.4959  -7.6540   24.955   57.877   51.047 -28.2337   28.607   35.510   16.106   20.563   10.064 14.94721 18.99181 
1 1 1   20    7   44 o   31.871   13.192   34.430   28.311   0.0000   0.0000   34.430   28.311  ?   ?    31.871   13.192      ?      ? 
1 1 1   20    8    0 o   84.887   2.6620  149.602   13.121  149.602   13.121  149.602   13.121   84.887   3.7646   84.887   3.7646 0.000000 0.000000 
1 1 1   20    8    1 o  116.883   2.7507  278.263   12.932  299.826   21.064  265.218   16.383  120.446   4.2401  113.320   3.5053 7.125122 5.501409 
1 1 1   20    8    2 o   54.563   3.6671   61.320   7.8451   62.492   13.417   60.711   9.6704   54.929   5.9223   54.196   4.3263 0.7335548 7.334197 
1 1 1   20    8    3 f  243.736   2.5390  1228.56   25.327  1214.96   38.154  1239.28   33.864  242.503   3.8147  244.968   3.3517 -2.464996 5.077955 
1 1 1   20    8    4 o   60.166   2.9945   75.873   7.3271   64.715   10.718   85.661   10.039   55.942   4.6455   64.391   3.7800 -8.449680 5.989097 
1 1 1   20    8    5 o  167.680   2.3005  581.824   15.779  570.985   23.775  590.357   21.096  166.266   3.4669  169.095   3.0248 -2.828613 4.600986 
1 1 1   20    8    6 f  167.457   2.3053  581.262   15.808  559.326   23.565  599.208   21.315  164.558   3.4721  170.356   3.0336 -5.797867 4.610625 
1 1 1   20    8    7 o  148.397   2.2924  455.230   13.915  451.091   21.027  458.454   18.560  147.783   3.4497  149.011   3.0200 -1.228455 4.584831 
1 1 1   20    8    8 o  127.989   2.3208  338.009   12.099  340.147   18.664  336.460   15.890  128.324   3.5265  127.654   3.0181 0.6691971 4.641644 
1 1 1   20    8    9 o   88.109   2.7011  160.117   9.7897  144.430   13.552  177.238   14.157   83.599   3.9304   92.619   3.7061 -9.020317 5.402123 
1 1 1   20    8   10 o  166.227   2.7609  576.619   18.745  507.239   27.281  638.667   25.799  156.632   4.2229  175.822   3.5577 -19.18996 5.521800 
1 1 1   20    8   11 o  168.092   2.3480  583.984   16.088  581.349   24.686  585.929   21.210  167.740   3.5682  168.443   3.0530 -0.7022705 4.696021 
1 1 1   20    8   12 o   90.607   2.3250  169.643   8.6838  163.041   12.282  176.242   12.280   88.841   3.3518   92.373   3.2231 -3.532501 4.650069 
1 1 1   20    8   13 o   64.594   3.1109   87.331   8.1048   91.841   10.580   80.926   12.608   66.659   3.8484   62.529   4.8890 4.129951 6.221886 
1 1 1   20    8   14 o  170.500   2.4651  601.038   17.289  595.263   25.322  606.081   23.664  169.720   3.6174  171.281   3.3497 -1.560699 4.930138 
1 1 1   20    8   15 o  247.801   2.6132  1272.44   26.521  1239.62   39.650  1299.01   35.676  244.867   3.9260  250.735   3.4498 -5.868698 5.226367 
1 1 1   20    8   16 o  258.317   2.8598  1377.00   30.430  1326.03   41.762  1434.68   44.430  253.240   3.9984  263.394   4.0898 -10.15399 5.719568 
1 1 1   20    8   17 o  165.853   2.4713  564.471   16.785  600.845   25.598  537.034   22.231  170.492   3.6402  161.214   3.3434 9.277847 4.942647 
1 1 1   20    8   18 o  121.516   2.6313  305.652   13.158  299.294   19.146  311.342   18.114  120.306   3.8585  122.727   3.5786 -2.421005 5.262505 
1 1 1   20    8   19 o   51.993   4.0359   56.657   8.5310   67.329   12.035   45.879   12.095   56.995   5.1196   46.991   6.2404 10.00458 8.071739 
1 1 1   20    8   20 o  178.831   3.2521  666.423   22.776  675.196   28.205  649.979   38.613  180.664   3.7852  176.997   5.2894 3.667145 6.504248 
1 1 1   20    8   21 o  259.003   2.6277  1387.91   28.069  1398.96   39.875  1377.06   39.520  260.024   3.7181  257.982   3.7141 2.041901 5.255370 
1 1 1   20    8   22 o   49.128   4.4151   50.882   8.7935   40.320   12.461   61.359   12.411   43.936   6.8766   54.321   5.5395 -10.38542 8.830273 
1 1 1   20    8   23 o  170.596   2.6281  603.173   18.462  591.536   26.731  613.786   25.527  168.999   3.8351  172.193   3.5944 -3.194122 5.256145 
1 1 1   20    8   24 o  152.858   3.7510  499.225   21.029  457.791   39.394  515.737   24.868  147.960   6.4553  157.755   3.8221 -9.794586 7.501987 
1 1 1   20    8   25 o   79.538   3.2395  132.146   10.569  117.064   15.008  146.986   14.887   74.975   4.8535   84.101   4.2919 -9.126526 6.478927 
1 1 1   20    8   26 f   69.838   3.6274  102.900   10.313   93.609   15.440  110.383   13.856   66.880   5.5976   72.796   4.6151 -5.916031 7.254785 
1 1 1   20    8   27 o  110.541   3.7738  255.747   17.190  261.070   24.938  250.928   23.728  111.610   5.4175  109.473   5.2551 2.137543 7.547529 
1 1 1   20    8   28 o   21.255   5.8409   5.0254   7.7132   11.673   11.013  -1.3744   10.806   24.607   8.6964   17.904   7.7998 6.703768 11.68180 
1 1 1   20    8   29 o   62.799   3.7838   84.025   9.5666   63.237   13.493  105.039   13.566   54.733   5.9771   70.866   4.6414 -16.13301 7.567549 
1 1 1   20    8   30 f  102.799   3.2610  220.361   13.684  212.945   17.972  230.590   21.107  100.860   4.3203  104.739   4.8859 -3.878952 6.522084 
1 1 1   20    8   31 o   67.715   3.5850   96.560   10.006   91.690   13.982  101.670   14.324   65.946   5.1407   69.484   4.9983 -3.537987 7.170063 
1 1 1   20    8   32 o   30.626   5.6992   19.900   8.4933   3.7254   11.948   36.420   12.075   20.753   8.5784   40.499   7.5056 -19.74611 11.39838 
1 1 1   20    8   33 o   68.744   3.6239   99.975   10.265  101.421   14.898   98.668   14.163   69.184   5.2210   68.305   5.0272 0.8788681 7.247879 
1 1 1   20    8   34 o   40.459   8.5779   28.224   11.302   63.528   32.044   23.208   12.078   49.183   14.680   31.734   8.8790 17.44952 17.15589 
1 1 1   20    8   35 o   27.366   6.1826   16.839   8.0044   13.062   11.672   20.193   10.998   25.128   8.9451   29.603   8.5371 -4.474205 12.36512 
1 1 1   20    8   36 o   29.208   6.4014   19.739   8.4489   20.297   12.936   19.324   11.157   29.550   9.4182   28.866   8.6724 0.6840477 12.80283 
1 1 1   20    8   37 o   50.215   4.5801   55.370   9.4598   54.064   13.782   56.534   13.008   49.527   6.7471   50.903   6.1957 -1.376152 9.160218 
1 1 1   20    8   38 o   77.094   5.1243  134.479   14.248  136.030   16.679  130.293   27.405   79.509   5.0860   74.678   8.8976 4.830864 10.24867 
1 1 1   20    8   39 o   36.201   10.347   20.043   12.451   16.278   12.804   85.567   53.418   26.489   9.3752   45.912   18.449 -19.42336 20.69415 
1 1 1   20    8   40 o   27.775   7.8406   14.145   11.496   10.989   12.946   25.920   25.006   23.632   9.2113   31.918   12.691 -8.286083 15.68129 
1 1 1   20    8   41 o   25.789   7.7731   11.949   12.995   13.583   14.512   5.3384   29.193   24.970   9.7472   26.607   12.111 -1.636906 15.54613 
1 1 1   20    8   42 o   25.974   8.4140   1.4091   21.025 -17.0297   30.445   18.221   29.070   22.977   11.038   28.971   12.702 -5.994251 16.82795 
1 1 1   20    8   43 o   22.714   7.8946 -22.3240   23.235 -51.8426   49.022 -13.7718   26.387   23.870   11.937   21.558   10.335 2.312414 15.78916 
1 1 1   20    9    0 o  118.966   2.4698  292.849   17.105  292.849   17.105  292.849   17.105  118.966   3.4929  118.966   3.4929 0.000000 0.000000 
1 1 1   20    9    1 o  172.772   2.4611  616.347   17.534  605.278   24.518  627.934   25.086  171.185   3.4726  174.359   3.4884 -3.173111 4.922179 
1 1 1   20    9    2 o  190.545   2.3462  751.679   18.303  733.725   27.427  766.094   24.576  188.471   3.5283  192.619   3.0934 -4.148895 4.692347 
1 1 1   20    9    3 o  210.499   2.6999  924.724   22.451  882.779   37.150  948.855   28.178  206.640   4.3589  214.359   3.1872 -7.718781 5.399838 
1 1 1   20    9    4 o  278.190   3.2203  1596.02   36.108  1620.43   57.732  1580.35   46.276  279.853   5.0018  276.526   4.0575 3.326782 6.440547 
1 1 1   20    9    5 o  149.763   2.7318  461.044   16.427  453.188   20.875  473.820   26.622  148.128   3.4169  151.398   4.2634 -3.269547 5.463695 
1 1 1   20    9    6 o  333.720   3.3706  2322.84   44.530  2233.45   73.461  2374.76   55.990  328.454   5.4227  338.985   4.0046 -10.53146 6.741108 
1 1 1   20    9    7 o  217.075   2.7818  974.403   23.480  971.917   40.638  975.648   28.768  216.791   4.5449  217.359   3.2090 -0.5674591 5.563593 
1 1 1   20    9    8 o  191.411   2.3721  756.403   18.519  759.151   28.403  754.370   24.425  191.692   3.5925  191.131   3.0984 0.5602875 4.744099 
1 1 1   20    9    9 o  246.223   2.5690  1251.11   25.788  1262.79   39.677  1242.56   33.933  247.182   3.8919  245.264   3.3544 1.917969 5.137981 
1 1 1   20    9   10 o  119.619   2.7256  300.891   12.590  280.723   21.697  311.129   15.459  116.495   4.5157  122.743   3.0537 -6.248619 5.451272 
1 1 1   20    9   11 o  262.469   2.6546  1422.95   28.385  1428.49   43.733  1418.92   37.312  262.867   4.0338  262.071   3.4520 0.7958069 5.309184 
1 1 1   20    9   12 o  203.125   2.2482  852.184   18.835  849.750   26.561  854.646   26.712  202.834   3.1749  203.416   3.1839 -0.5826111 4.496387 
1 1 1   20    9   13 o  142.554   2.4724  417.257   14.473  447.479   21.737  393.187   19.399  147.155   3.5815  137.952   3.4094 9.202484 4.944821 
1 1 1   20    9   14 o  253.602   2.8432  1329.11   29.727  1307.37   41.329  1352.42   42.790  251.460   3.9849  255.744   4.0566 -4.283829 5.686472 
1 1 1   20    9   15 o  247.035   2.7768  1258.03   28.249  1192.99   38.678  1332.38   41.356  240.216   3.9039  253.855   3.9499 -13.63898 5.553528 
1 1 1   20    9   16 o  152.374   2.7682  480.049   17.272  479.765   23.084  480.410   26.035  152.347   3.6737  152.401   4.1420 -0.5377197E-01 5.536411 
1 1 1   20    9   17 o   65.192   3.3328   87.184   8.9015   94.908   13.573   81.354   11.791   67.693   4.8615   62.690   4.5604 5.003494 6.665655 
1 1 1   20    9   18 o  194.330   2.5443  781.668   20.335  766.594   29.740  794.903   27.867  192.549   3.7448  196.112   3.4452 -3.562775 5.088543 
1 1 1   20    9   19 o  139.920   2.6472  406.434   15.160  418.473   20.398  391.579   22.658  142.272   3.4761  137.569   3.9934 4.702988 5.294397 
1 1 1   20    9   20 o   87.241   3.4306  151.420   11.885  135.934   14.640  181.357   20.355   81.008   4.3817   93.475   5.2798 -12.46689 6.861146 
1 1 1   20    9   21 o  134.648   2.5482  375.091   14.148  363.697   19.894  386.750   20.125  132.575   3.6382  136.721   3.5689 -4.145859 5.096455 
1 1 1   20    9   22 o   50.289   4.2997   53.338   8.7910   43.855   12.592   62.355   12.279   45.823   6.6625   54.755   5.4372 -8.932476 8.599501 
1 1 1   20    9   23 o   74.287   4.0875  119.439   11.850  131.668   15.032   99.367   19.259   79.647   4.5760   68.928   6.7744 10.71964 8.175069 
1 1 1   20    9   24 o   65.491   5.6016   78.770   12.120  111.761   29.091   71.840   13.333   72.303   9.7553   58.680   5.5088 13.62242 11.20327 
1 1 1   20    9   25 o   43.079   5.1100   39.851   8.6519   53.261   12.680   28.169   11.835   50.408   6.0988   35.750   8.2009 14.65749 10.22008 
1 1 1   20    9   26 o   69.682   3.6122  100.049   10.296  112.813   15.852   90.736   13.541   73.449   5.2328   65.915   4.9809 7.534744 7.224390 
1 1 1   20    9   27 o   93.589   2.9477  182.277   11.367  193.968   16.341  171.316   15.822   96.508   4.1054   90.670   4.2310 5.837715 5.895360 
1 1 1   20    9   28 o   46.602   4.8667   47.778   8.8377   36.069   12.777   58.519   12.238   40.429   7.9455   52.775   5.6222 -12.34534 9.733438 
1 1 1   20    9   29 o   68.879   3.4816   99.302   9.8648  110.010   14.362   89.738   13.573   72.412   4.8088   65.347   5.0361 7.065247 6.963265 
1 1 1   20    9   30 o   51.415   8.3569   91.681   14.084   99.731   14.562 -24.8715   55.412   68.802   5.1316   34.028   15.907 34.77428 16.71382 
1 1 1   20    9   31 o   78.227   3.4135  128.727   11.009  128.199   15.763  129.230   15.383   78.048   4.8968   78.406   4.7571 -0.3576965 6.827016 
1 1 1   20    9   32 o  100.320   3.6536  219.600   14.120  190.709   23.842  235.209   17.524   94.601   6.1106  106.040   4.0069 -11.43887 7.307147 
1 1 1   20    9   33 o  105.141   3.2936  232.004   14.096  239.839   21.915  226.475   18.409  106.477   4.9903  103.805   4.2999 2.671883 6.587233 
1 1 1   20    9   34 o   87.333   4.7360  164.910   17.042  170.513   24.778  159.880   23.477   88.691   6.7736   85.975   6.6209 2.716339 9.471936 
1 1 1   20    9   35 o  106.164   4.1010  241.735   17.951  249.313   25.789  234.613   25.001  107.776   5.8017  104.553   5.7976 3.222649 8.201951 
1 1 1   20    9   36 o   46.417   4.9967   47.429   9.2687   57.413   13.931   39.499   12.416   51.205   6.5962   41.630   7.5072 9.574657 9.993385 
1 1 1   20    9   37 o   29.470   6.3956   20.158   8.7169   26.745   12.717   14.319   11.972   33.353   9.0251   25.587   9.0645 7.765985 12.79130 
1 1 1   20    9   38 o   35.895   8.1545   31.773   12.517   29.083   14.530   39.515   24.648   34.098   9.8069   37.692   13.031 -3.594540 16.30894 
1 1 1   20    9   39 o   44.049   8.3901   63.241   13.866   67.041   14.356   10.429   53.517   54.950   6.3344   33.148   15.539 21.80113 16.78029 
1 1 1   20    9   40 o   23.090   7.1832   0.6888   10.849  -3.8470   12.196   17.881   23.745   17.261   7.8457   28.919   12.035 -11.65780 14.36638 
1 1 1   20    9   41 o   34.107   7.8221   34.541   13.183   39.674   15.109   18.176   26.978   39.254   9.4467   28.960   12.470 10.29424 15.64420 
1 1 1   20    9   42 o   27.602   8.7846   8.0216   21.343   31.775   32.165 -10.6622   28.527   32.122   13.719   23.081   10.976 9.041378 17.56920 
1 1 1   20    9   43 o   25.001   8.7358 -19.6953   23.908   25.224   52.064 -31.6987   26.914   30.627   14.638   19.375   9.5388 11.25204 17.47156 
1 1 1   20   10    0 o  125.431   3.0243  325.971   22.068  325.971   22.068  325.971   22.068  125.431   4.2770  125.431   4.2770 0.000000 0.000000 
1 1 1   20   10    1 f  154.471   3.3482  498.427   18.840  504.119   22.051  483.042   36.254  156.229   3.4221  152.713   5.7559 3.516327 6.696352 
1 1 1   20   10    2 o  239.320   2.5258  1181.79   24.674  1192.25   37.779  1174.01   32.584  240.214   3.8131  238.425   3.3135 1.788940 5.051652 
1 1 1   20   10    3 o   92.174   2.3880  174.916   9.0004  179.610   13.736  171.384   11.914   93.246   3.5716   91.102   3.1709 2.143791 4.776095 
1 1 1   20   10    4 o  202.173   2.3776  846.174   19.679  827.074   29.503  861.482   26.413  200.093   3.5750  204.253   3.1354 -4.160049 4.755107 
1 1 1   20   10    5 f   18.657   5.0069   4.4794   5.5692  -0.3152   8.3038   8.3992   7.5082   16.291   6.9642   21.023   7.1957 -4.732548 10.01387 
1 1 1   20   10    6 o  196.895   2.3720  801.496   19.110  794.632   28.840  806.869   25.515  196.122   3.5653  197.667   3.1296 -1.544846 4.744065 
1 1 1   20   10    7 o  164.477   2.2971  556.481   15.428  574.355   23.708  543.354   20.318  166.743   3.4474  162.212   3.0370 4.530991 4.594274 
1 1 1   20   10    8 o  255.228   2.9327  1346.97   29.195  1346.30   50.238  1347.32   35.875  255.073   4.7753  255.383   3.4059 -0.3095245 5.865496 
1 1 1   20   10    9 o  102.403   2.5695  216.638   10.850  210.898   15.236  222.546   15.456  101.025   3.6565  103.780   3.6109 -2.754951 5.138949 
1 1 1   20   10   10 o  105.916   2.5784  231.739   11.258  233.933   16.219  229.700   15.639  106.396   3.6960  105.435   3.5962 0.9611816 5.156821 
1 1 1   20   10   11 o  116.525   2.5776  280.640   12.386  276.809   17.604  284.396   17.429  115.735   3.6879  117.316   3.6021 -1.581024 5.155157 
1 1 1   20   10   12 o  242.445   2.5775  1213.15   25.440  1224.65   39.351  1204.88   33.345  243.391   3.9200  241.498   3.3477 1.892563 5.154933 
1 1 1   20   10   13 o  129.082   2.4952  342.866   13.234  360.264   19.763  328.722   17.819  132.031   3.6291  126.133   3.4253 5.897331 4.990305 
1 1 1   20   10   14 o  164.152   2.4541  557.550   16.560  546.886   24.306  566.789   22.623  162.670   3.6228  165.633   3.3116 -2.963120 4.908283 
1 1 1   20   10   15 o   59.742   3.4107   77.680   7.9096   60.689   12.721   88.390   10.099   54.096   5.7015   65.389   3.7447 -11.29334 6.821302 
1 1 1   20   10   16 o  130.782   2.3798  355.890   12.581  340.607   19.639  366.527   16.384  128.355   3.7096  133.209   2.9820 -4.853348 4.759607 
1 1 1   20   10   17 o   74.009   3.0896  114.225   9.3500  104.816   13.791  122.228   12.719   71.146   4.6999   76.871   4.0118 -5.725372 6.179264 
1 1 1   20   10   18 o  102.443   2.8112  216.406   11.835  243.938   17.238  191.854   16.278  108.597   3.8485   96.289   4.0989 12.30829 5.622437 
1 1 1   20   10   19 o  117.789   2.7723  285.613   13.376  274.994   17.766  299.509   20.324  115.294   3.7361  120.285   4.0967 -4.990860 5.544503 
1 1 1   20   10   20 o   48.165   5.4829   49.892   10.117   51.378   12.676   47.286   16.793   49.676   6.1868   46.653   9.0538 3.023083 10.96578 
1 1 1   20   10   21 f  227.331   2.8021  1069.86   26.263  1050.33   36.538  1090.74   37.775  225.193   3.9339  229.469   3.9913 -4.276001 5.604104 
1 1 1   20   10   22 o  135.929   2.5676  382.515   14.395  379.731   20.298  385.330   20.416  135.431   3.6339  136.426   3.6284 -0.9956207 5.135240 
1 1 1   20   10   23 o   54.347   4.3428   60.414   9.5719   68.824   15.310   55.018   12.264   57.346   6.4732   51.347   5.7910 5.998444 8.685504 
1 1 1   20   10   24 o  109.299   3.3860  258.030   14.620  208.741   22.865  292.119   19.015   99.959   5.5460  118.639   3.8860 -18.67933 6.771934 
1 1 1   20   10   25 o   16.587   5.2439  -4.0145   7.3325  -4.1310   10.750  -3.9131   10.027   16.879   7.5448   16.295   7.2848 0.5843811 10.48773 
1 1 1   20   10   26 o   69.798   3.6048  103.025   10.253   92.311   15.192  111.988   13.895   66.336   5.5527   73.260   4.5985 -6.923782 7.209591 
1 1 1   20   10   27 o  151.298   3.2465  477.769   20.235  510.408   28.954  446.606   28.291  156.389   4.4888  146.208   4.6915 10.18045 6.493079 
1 1 1   20   10   28 f   85.061   3.2570  151.238   11.412  152.143   16.582  150.423   15.730   85.275   4.7145   84.847   4.4949 0.4279251 6.513913 
1 1 1   20   10   29 o   74.158   3.4583  115.399   10.562  124.613   15.253  106.910   14.639   77.023   4.8013   71.293   4.9786 5.729187 6.916558 
1 1 1   20   10   30 o   40.160   10.501   13.329   11.257   9.6304   11.522   90.765   52.721   23.439   8.7993   56.880   19.070 -33.44074 21.00179 
1 1 1   20   10   31 o   58.614   3.9447   72.417   9.5151   79.009   13.963   66.701   13.002   61.105   5.5402   56.124   5.6167 4.980610 7.889305 
1 1 1   20   10   32 o   66.708   3.6240   94.145   9.9523   94.132   14.519   94.157   13.668   66.652   5.2817   66.765   4.9637 -0.1133804 7.248081 
1 1 1   20   10   33 o   84.008   3.5986  151.332   12.247  137.402   18.619  161.954   16.259   80.315   5.6209   87.701   4.4950 -7.386093 7.197185 
1 1 1   20   10   34 o   15.749   5.1342  -7.1239   7.7478  -8.3009   11.200  -6.0438   10.729   15.612   7.2484   15.886   7.2734 -0.2745600 10.26848 
1 1 1   20   10   35 o   35.226   5.8275   29.369   8.8080   17.133   12.967   39.850   12.002   27.739   9.4566   42.714   6.8125 -14.97435 11.65495 
1 1 1   20   10   36 o   20.978   5.9994   4.7845   8.4785  -2.9336   12.541   11.282   11.507   18.179   8.1356   23.778   8.8194 -5.599461 11.99873 
1 1 1   20   10   37 f   45.192   5.0401   45.775   9.1564   51.937   13.433   40.427   12.514   48.452   6.7218   41.932   7.5118 6.519516 10.08016 
1 1 1   20   10   38 o   57.456   7.0204   89.714   13.595  100.426   16.049   62.499   25.581   67.697   5.7480   47.214   12.810 20.48368 14.04087 
1 1 1   20   10   39 o   38.929   7.6032   50.241   13.795   56.923   14.279 -43.4297   53.457   50.264   6.8875   27.594   13.557 22.66983 15.20640 
1 1 1   20   10   40 o   24.308   7.4189   8.4623   12.554   11.516   14.192  -2.5239   26.916   24.047   9.5608   24.569   11.347 -0.5214195 14.83785 
1 1 1   20   10   41 o   28.098   8.2324   13.557   12.661   8.6279   14.065   34.620   29.074   22.577   9.3178   33.618   13.575 -11.04095 16.46480 
1 1 1   20   10   42 o   25.779   8.2900   1.8262   20.898 -28.8598   31.795   25.165   27.729   21.611   10.584   29.947   12.762 -8.336561 16.58003 
1 1 1   20   10   43 o   43.107   10.324   71.120   22.379   59.553   32.212   81.912   31.113   38.708   14.672   47.507   14.529 -8.799213 20.64816 
1 1 1   20   11    0 o  294.601   2.9743  1793.10   51.086  1793.10   51.086  1793.10   51.086  294.601   4.2063  294.601   4.2063 0.000000 0.000000 
1 1 1   20   11    1 o  106.115   2.4805  232.368   10.848  219.827   15.096  245.759   15.599  103.155   3.5481  109.074   3.4674 -5.919060 4.961053 
1 1 1   20   11    2 o  301.619   2.8192  1880.44   34.729  1879.17   52.931  1881.41   46.019  301.482   4.2568  301.755   3.6976 -0.2734680 5.638485 
1 1 1   20   11    3 o   88.301   2.4438  162.203   8.7966  152.741   13.274  169.612   11.746   85.976   3.7433   90.626   3.1425 -4.650551 4.887517 
1 1 1   20   11    4 o   48.097   3.5924   45.411   6.8650   57.273   11.800   39.342   8.4404   52.587   5.4406   43.608   4.6928 8.978470 7.184861 
1 1 1   20   11    5 f  125.483   2.5440  314.731   12.425  357.035   22.082  295.133   15.029  131.418   4.0739  119.548   3.0481 11.86991 5.088021 
1 1 1   20   11    6 o  205.768   2.5429  874.818   21.580  877.385   30.741  872.323   30.300  206.064   3.6171  205.473   3.5754 0.5907593 5.085887 
1 1 1   20   11    7 o  188.603   2.6532  736.021   19.584  732.229   33.427  738.004   24.165  188.169   4.3070  189.037   3.0994 -0.8677979 5.306315 
1 1 1   20   11    8 o  187.032   2.6439  716.596   19.213  741.670   33.604  704.418   23.419  189.378   4.3023  184.687   3.0744 4.690613 5.287861 
1 1 1   20   11    9 o  110.872   2.3593  254.883   10.682  246.812   16.150  261.159   14.242  109.291   3.5828  112.452   3.0706 -3.161148 4.718636 
1 1 1   20   11   10 o  223.984   2.5082  1034.36   22.828  1049.94   35.589  1023.46   29.757  225.378   3.8286  222.591   3.2412 2.786530 5.016341 
1 1 1   20   11   11 o  147.115   2.1486  447.001   13.036  442.067   18.434  451.938   18.439  146.301   3.0549  147.928   3.0222 -1.626770 4.297182 
1 1 1   20   11   12 o   42.765   4.2552   39.686   6.9448   33.974   11.246   43.207   8.8297   39.840   7.1044   45.691   4.6855 -5.850735 8.510316 
1 1 1   20   11   13 o   75.031   3.1044  116.514   9.5985  122.518   13.611  110.574   13.538   76.960   4.2881   73.102   4.4901 3.858109 6.208725 
1 1 1   20   11   14 o   87.205   2.9180  157.280   10.493  153.225   14.766  161.418   14.915   86.068   4.1596   88.343   4.0934 -2.275139 5.835975 
1 1 1   20   11   15 f   80.811   3.4804  135.651   11.336  137.119   14.603  133.426   17.981   81.401   4.3496   80.220   5.4345 1.181129 6.960799 
1 1 1   20   11   16 o  164.997   2.3733  564.220   15.818  554.472   24.924  570.794   20.468  163.765   3.6901  166.230   2.9854 -2.465805 4.746512 
1 1 1   20   11   17 o  121.885   2.5808  307.749   12.932  299.376   18.920  315.089   17.716  120.311   3.8128  123.458   3.4792 -3.147072 5.161641 
1 1 1   20   11   18 o  164.163   2.6615  556.679   18.000  595.310   25.973  520.977   24.969  169.642   3.7121  158.684   3.8151 10.95789 5.323019 
1 1 1   20   11   19 o  203.119   2.7760  850.724   22.726  838.722   29.097  869.500   36.393  201.367   3.5034  204.871   4.3070 -3.504120 5.551927 
1 1 1   20   11   20 o  200.188   2.5081  829.292   20.707  840.214   29.345  818.459   29.225  201.504   3.5308  198.872   3.5629 2.632034 5.016115 
1 1 1   20   11   21 o   77.348   3.1927  124.001   10.178  117.837   14.176  130.560   14.624   75.361   4.5607   79.335   4.4692 -3.973747 6.385418 
1 1 1   20   11   22 o  117.596   2.7182  286.596   13.181  279.018   18.611  294.223   18.670  116.029   3.8890  119.162   3.7988 -3.132950 5.436488 
1 1 1   20   11   23 o   66.217   3.8119   89.636   10.285  103.841   16.149   79.941   13.342   70.518   5.5524   61.917   5.2243 8.600891 7.623840 
1 1 1   20   11   24 f   91.350   3.9699  174.364   14.945  184.657   21.504  164.748   20.785   93.970   5.5485   88.731   5.6795 5.239616 7.939898 
1 1 1   20   11   25 o   83.204   3.0763  144.184   10.555  144.765   15.064  143.624   14.795   83.362   4.3812   83.045   4.3196 0.3174133 6.152557 
1 1 1   20   11   26 o   65.768   3.5571   90.587   9.6386   89.311   13.897   91.769   13.380   65.296   5.1603   66.240   4.8973 -0.9433975 7.114255 
1 1 1   20   11   27 o   60.621   3.9350   76.893   9.7571   79.553   14.885   74.889   12.920   61.474   5.8708   59.768   5.2411 1.705410 7.869932 
1 1 1   20   11   28 o   45.376   4.6395   43.920   8.6667   42.614   12.521   45.120   12.008   44.676   6.7955   46.077   6.3184 -1.401649 9.279070 
1 1 1   20   11   29 o  143.365   2.9644  428.671   17.391  419.815   23.087  440.290   26.443  141.773   3.9482  144.956   4.4230 -3.182404 5.928870 
1 1 1   20   11   30 o   35.349   7.0514   27.323   10.012   25.036   11.889   32.900   18.566   33.193   8.6106   37.505   11.169 -4.311951 14.10271 
1 1 1   20   11   31 o   90.072   3.4522  171.893   12.630  177.475   16.652  164.335   19.379   91.984   4.3893   88.161   5.3295 3.822105 6.904306 
1 1 1   20   11   32 o   70.898   3.5972  106.832   10.455  102.214   15.451  110.732   14.200   69.362   5.4009   72.434   4.7530 -3.072426 7.194490 
1 1 1   20   11   33 o   52.306   4.3924   58.812   9.4606   54.606   13.262   63.170   13.499   50.341   6.3875   54.271   6.0309 -3.930389 8.784750 
1 1 1   20   11   34 o   32.976   5.9760   24.895   8.2453   31.296   12.166   19.456   11.214   36.864   8.2119   29.088   8.6843 7.775612 11.95207 
1 1 1   20   11   35 o   69.390   4.6639  105.614   12.163  104.335   22.162  106.165   14.550   68.247   7.8734   70.533   5.0015 -2.286743 9.327703 
1 1 1   20   11   36 o   38.722   5.9178   35.135   9.1521   37.018   13.538   33.550   12.420   39.606   8.5389   37.838   8.1956 1.767628 11.83555 
1 1 1   20   11   37 o   45.041   7.5545   45.412   12.428   38.162   14.325   67.475   24.990   39.734   8.9554   50.348   12.169 -10.61407 15.10906 
1 1 1   20   11   38 o   26.454   7.3290   14.818   11.572   19.079   13.331   1.7947   23.306   28.141   9.5884   24.767   11.087 3.374229 14.65805 
1 1 1   20   11   39 o   35.915   7.3909   37.902   12.359   44.552   14.030   14.875   26.107   43.140   8.1847   28.691   12.309 14.44888 14.78170 
1 1 1   20   11   40 o   36.394   7.7854   40.948   13.329   46.329   14.775   17.428   30.889   43.328   8.5715   29.461   12.999 13.86692 15.57089 
1 1 1   20   11   41 o   20.187   6.8360  -8.9184   12.145  -9.6246   13.412  -5.7040   28.616   16.313   7.6884   24.060   11.305 -7.746971 13.67199 
1 1 1   20   11   42 o   41.583   10.108   64.571   21.894   49.818   32.189   77.272   29.867   36.128   14.388   47.037   14.202 -10.90854 20.21678 
1 1 1   20   12    0 o  162.452   2.4406  545.455   23.103  545.455   23.103  545.455   23.103  162.452   3.4516  162.452   3.4516 0.000000 0.000000 
1 1 1   20   12    1 o  185.180   2.4901  708.437   19.018  715.164   27.022  701.836   26.770  186.051   3.5214  184.309   3.5216 1.741821 4.980168 
1 1 1   20   12    2 o  135.274   2.2650  378.661   12.513  372.756   19.001  383.183   16.627  134.326   3.4297  136.223   2.9593 -1.896561 4.529953 
1 1 1   20   12    3 o  188.377   2.3469  732.441   18.044  736.955   27.619  729.079   23.834  188.861   3.5457  187.893   3.0756 0.9680023 4.693731 
1 1 1   20   12    4 o  133.462   2.2713  367.407   12.363  371.147   19.000  364.661   16.280  134.035   3.4368  132.889   2.9703 1.146439 4.542551 
1 1 1   20   12    5 o  146.375   2.2670  441.676   13.538  448.253   20.803  436.844   17.829  147.302   3.4241  145.447   2.9721 1.854752 4.534086 
1 1 1   20   12    6 o  181.247   2.3257  679.931   17.233  667.910   26.037  689.302   22.989  179.797   3.5111  182.696   3.0509 -2.898666 4.651455 
1 1 1   20   12    7 o  139.046   2.5565  397.152   13.884  406.829   23.969  392.265   17.032  140.269   4.1431  137.823   2.9963 2.446625 5.113071 
1 1 1   20   12    8 o  269.465   3.0049  1503.76   31.648  1495.12   54.151  1508.24   39.003  268.753   4.8852  270.176   3.5001 -1.423462 6.009703 
1 1 1   20   12    9 o  172.224   3.4161  606.949   19.261  625.606   43.807  602.478   21.445  173.651   6.1164  170.796   3.0443 2.854553 6.832151 
1 1 1   20   12   10 o  235.883   2.9033  1146.38   26.422  1162.53   46.621  1138.74   32.069  236.990   4.7696  234.777   3.3118 2.212372 5.806686 
1 1 1   20   12   11 o  196.762   2.3715  791.469   18.961  753.804   24.536  847.316   29.877  191.036   3.1140  202.487   3.5774 -11.45143 4.742903 
1 1 1   20   12   12 o  219.558   2.4242  994.914   21.395  1001.31   34.394  990.877   27.326  220.084   3.7891  219.031   3.0249 1.053146 4.848386 
1 1 1   20   12   13 o   55.070   3.6653   62.584   8.3081   67.502   12.210   58.344   11.337   57.076   5.1867   53.064   5.1803 4.012245 7.330529 
1 1 1   20   12   14 o  149.646   2.4791  463.459   15.262  453.638   22.265  472.163   20.960  148.135   3.6442  151.157   3.3621 -3.021835 4.958231 
1 1 1   20   12   15 o  141.701   2.5399  414.771   14.799  419.026   21.846  411.162   20.119  142.360   3.7206  141.043   3.4586 1.317291 5.079836 
1 1 1   20   12   16 o  187.352   2.6405  725.169   20.392  704.247   28.262  747.890   29.453  184.539   3.7132  190.165   3.7552 -5.626007 5.281031 
1 1 1   20   12   17 o  123.424   2.4830  319.737   12.351  290.094   19.124  340.948   16.178  118.401   3.9162  128.447   3.0537 -10.04546 4.966059 
1 1 1   20   12   18 o  203.397   2.7264  856.315   22.869  872.432   32.355  840.224   32.329  205.317   3.8208  201.478   3.8905 3.838715 5.452875 
1 1 1   20   12   19 o   79.764   3.7564  132.933   11.583  134.326   14.151  130.105   20.165   80.509   4.2616   79.019   6.1873 1.490074 7.512860 
1 1 1   20   12   20 o  177.067   2.6945  648.572   19.662  631.782   27.150  667.088   28.513  174.668   3.7688  179.466   3.8520 -4.797485 5.389024 
1 1 1   20   12   21 o   80.624   3.6975  135.707   11.805  137.005   14.802  133.438   19.568   81.256   4.4168   79.992   5.9311 1.263290 7.394988 
1 1 1   20   12   22 o   31.430   6.4696   21.751   9.0353   16.419   13.728   25.825   12.001   28.617   9.7303   34.243   8.5291 -5.626253 12.93929 
1 1 1   20   12   23 o   48.871   4.3241   49.986   8.7086   52.573   12.608   47.625   12.043   50.080   6.1040   47.662   6.1263 2.417610 8.648153 
1 1 1   20   12   24 o   30.395   6.7354   20.342   9.1125   14.750   17.023   22.588   10.788   28.832   10.720   31.959   8.1571 -3.127884 13.47090 
1 1 1   20   12   25 o   36.181   5.6830   29.069   8.2385   28.366   12.183   29.662   11.183   35.684   8.4148   36.677   7.6406 -0.9928703 11.36605 
1 1 1   20   12   26 o   86.124   3.0820  154.792   10.938  148.068   15.519  161.430   15.419   84.240   4.4666   88.008   4.2478 -3.768036 6.163943 
1 1 1   20   12   27 o   84.196   3.3020  151.704   11.201  126.686   16.781  171.807   15.042   77.632   5.2408   90.761   4.0183 -13.12911 6.603999 
1 1 1   20   12   28 o   69.991   3.4938  103.271   10.045   92.784   14.201  113.773   14.211   66.356   5.1890   73.626   4.6799 -7.269943 6.987642 
1 1 1   20   12   29 o   55.340   5.9520   69.720   11.612   72.323   13.736   63.201   21.738   58.420   5.7007   52.260   10.450 6.159859 11.90391 
1 1 1   20   12   30 o   30.016   5.5971   18.551   8.0604   34.941   11.814   4.2771   11.025   39.651   7.4987   20.380   8.3114 19.27026 11.19423 
1 1 1   20   12   31 o   97.279   5.3577  223.729   16.327  235.667   18.315  177.525   36.031  105.976   4.1902   88.581   9.8622 17.39559 10.71547 
1 1 1   20   12   32 o   52.241   4.9682   62.778   9.8046   45.475   14.980   75.745   12.968   44.735   8.4284   59.747   5.2625 -15.01243 9.936347 
1 1 1   20   12   33 o  110.084   3.6788  269.146   15.461  224.259   26.157  293.250   19.168  101.989   6.2184  118.178   3.9326 -16.18962 7.357535 
1 1 1   20   12   34 o   61.585   3.9531   82.232   9.9111   70.171   14.365   93.190   13.692   56.997   6.1106   66.173   5.0167 -9.176617 7.906143 
1 1 1   20   12   35 o   47.786   6.7468   60.903   11.365   40.079   21.898   68.582   13.297   39.251   12.219   56.321   5.7241 -17.06990 13.49369 
1 1 1   20   12   36 f   67.723   3.7607   99.043   10.474   95.696   15.221  102.053   14.437   66.504   5.5491   68.941   5.0772 -2.437347 7.521303 
1 1 1   20   12   37 o   33.797   7.9521   28.972   12.130   28.297   14.153   30.839   23.543   33.580   9.6849   34.015   12.615 -0.4348183 15.90421 
1 1 1   20   12   38 o   29.400   8.0127   16.383   12.095   11.138   13.872   33.003   24.696   24.115   9.4952   34.685   12.909 -10.56939 16.02531 
1 1 1   20   12   39 o   19.959   6.3257  -4.6378   11.901   8.2419   13.729 -43.5620   23.867   22.513   9.2388   17.405   8.6430 5.108334 12.65134 
1 1 1   20   12   40 o   18.857   8.4900  -1.6331   13.885  -1.6331   13.885   0.0000   0.0000   18.857   8.4900  ?   ?       ?      ? 
1 1 1   20   12   41 o   21.602   9.1270   6.9389   13.978   6.9389   13.978   0.0000   0.0000   21.602   9.1270  ?   ?       ?      ? 
1 1 1   20   12   42 o   31.984   8.6743   18.309   21.596 -42.4329   31.912   69.637   29.335   20.052   9.9639   43.916   14.202 -23.86315 17.34867 
1 1 1   20   13    0 o  158.966   2.4562  522.356   22.750  522.356   22.750  522.356   22.750  158.966   3.4736  158.966   3.4736 0.000000 0.000000 
1 1 1   20   13    1 o  191.277   2.5240  755.948   19.912  752.639   28.025  759.323   28.296  190.855   3.5602  191.699   3.5788 -0.8436584 5.048049 
1 1 1   20   13    2 o  183.544   2.3347  694.828   17.482  703.063   26.843  688.762   23.038  184.465   3.5281  182.623   3.0586 1.842468 4.669314 
1 1 1   20   13    3 o  186.686   2.3352  722.048   17.850  701.147   26.693  738.955   24.008  184.214   3.5133  189.158   3.0772 -4.943375 4.670383 
1 1 1   20   13    4 o   81.795   2.4989  136.956   8.3563  147.591   12.867  129.197   10.989   84.509   3.6914   79.081   3.3693 5.427399 4.997858 
1 1 1   20   13    5 o   42.635   3.6233   37.331   6.3390   40.725   9.5736   34.681   8.4589   44.343   5.2346   40.928   5.0111 3.415379 7.246503 
1 1 1   20   13    6 o   99.132   2.6798  205.375   10.412  195.736   17.517  210.641   12.947   97.276   4.3660  100.988   3.1084 -3.711456 5.359515 
1 1 1   20   13    7 o   98.394   2.6368  198.115   10.164  206.413   17.506  193.894   12.484   99.900   4.2487   96.888   3.1241 3.012024 5.273669 
1 1 1   20   13    8 o  138.486   2.2834  394.305   12.890  408.134   19.954  384.401   16.887  140.544   3.4423  136.428   3.0011 4.115891 4.566840 
1 1 1   20   13    9 o  177.383   2.6708  656.310   18.457  632.107   31.530  668.928   22.766  174.802   4.3733  179.964   3.0671 -5.162613 5.341646 
1 1 1   20   13   10 o  184.461   2.7014  709.488   19.396  684.773   33.212  722.281   23.895  181.925   4.4263  186.997   3.0981 -5.072266 5.402795 
1 1 1   20   13   11 o  165.565   2.4414  567.924   16.612  546.112   24.254  587.200   22.800  162.546   3.6178  168.584   3.2791 -6.038239 4.882717 
1 1 1   20   13   12 o  321.227   2.8456  2135.54   36.648  2128.39   59.184  2139.99   46.672  320.680   4.4747  321.775   3.5167 -1.095123 5.691268 
1 1 1   20   13   13 o  193.924   2.5138  777.039   20.020  780.619   29.755  774.077   27.061  194.312   3.7127  193.537   3.3902 0.7750854 5.027660 
1 1 1   20   13   14 o  122.672   2.8633  311.005   13.994  312.471   23.005  310.145   17.632  122.852   4.5402  122.492   3.4900 0.3595963 5.726537 
1 1 1   20   13   15 o  129.413   2.8589  347.113   14.781  344.260   24.056  348.843   18.734  128.929   4.5238  129.896   3.4969 -0.9663391 5.717772 
1 1 1   20   13   16 o  207.039   2.6263  885.042   22.399  827.281   30.982  948.294   32.421  199.968   3.7564  214.110   3.6713 -14.14198 5.252545 
1 1 1   20   13   17 o  132.884   2.7942  360.390   15.184  327.526   19.946  405.680   23.415  125.795   3.8444  139.973   4.0559 -14.17756 5.588361 
1 1 1   20   13   18 o   61.007   3.6832   78.293   9.1487   68.358   13.460   86.824   12.473   57.321   5.6933   64.693   4.6746 -7.372372 7.366487 
1 1 1   20   13   19 o   45.930   7.6235   46.039   11.156   46.488   12.132   43.580   28.390   47.211   6.2305   44.648   13.916 2.563614 15.24692 
1 1 1   20   13   20 o  137.091   2.5335  389.034   14.322  400.295   20.427  378.146   20.086  139.045   3.5619  135.137   3.6038 3.907913 5.066976 
1 1 1   20   13   21 o  142.391   2.5431  420.052   14.932  413.227   20.838  427.253   21.406  141.207   3.5780  143.576   3.6149 -2.369217 5.086240 
1 1 1   20   13   22 o  161.189   2.9903  538.519   19.481  547.317   30.898  532.714   25.097  162.158   4.6198  160.220   3.7979 1.938080 5.980548 
1 1 1   20   13   23 o   71.407   3.3716  106.426   9.9136   99.237   13.993  113.671   14.047   68.959   4.9197   73.856   4.6115 -4.897606 6.743149 
1 1 1   20   13   24 o  134.922   3.9312  406.366   19.133  329.036   35.393  438.293   22.742  124.651   6.8843  145.193   3.7976 -20.54237 7.862321 
1 1 1   20   13   25 o   61.468   3.8378   79.079   9.6539   93.269   14.053   66.400   13.284   66.737   5.1056   56.198   5.7313 10.53863 7.675600 
1 1 1   20   13   26 o   65.823   3.6204   90.795   9.8229   86.492   13.695   95.354   14.097   64.207   5.1714   67.439   5.0682 -3.232010 7.240846 
1 1 1   20   13   27 o   71.520   4.3290  107.557   12.376  104.292   15.586  113.131   20.362   70.305   5.3749   72.736   6.7876 -2.430817 8.657993 
1 1 1   20   13   28 o   74.272   4.6142  122.677   12.661  130.031   15.191  105.945   22.915   78.690   4.6806   69.855   7.9534 8.835083 9.228434 
1 1 1   20   13   29 o   65.495   4.6128   92.492   11.868   94.557   14.812   88.791   19.834   66.896   5.3685   64.094   7.5028 2.801300 9.225628 
1 1 1   20   13   30 o   77.885   3.3198  128.101   10.624  119.659   15.337  135.890   14.732   75.327   4.9364   80.444   4.4401 -5.116440 6.639532 
1 1 1   20   13   31 o   62.367   4.1421   83.194   10.604   84.573   14.398   81.558   15.678   63.047   5.5369   61.687   6.1620 1.360065 8.284184 
1 1 1   20   13   32 o   35.805   6.3028   28.841   9.2551   37.708   14.424   22.636   12.067   40.333   8.9086   31.278   8.9184 9.054777 12.60558 
1 1 1   20   13   33 o   47.608   4.6709   49.594   9.0870   43.796   13.154   54.887   12.568   44.727   7.1304   50.488   6.0355 -5.761269 9.341855 
1 1 1   20   13   34 o   68.340   3.6723  100.345   10.304   91.359   14.748  108.913   14.401   65.195   5.4847   71.484   4.8846 -6.288857 7.344506 
1 1 1   20   13   35 o   29.536   7.0030   21.352   10.023   10.636   20.207   24.849   11.543   26.720   11.110   32.351   8.5293 -5.630915 14.00610 
1 1 1   20   13   36 o   18.682   5.6457  -0.8291   8.1454   8.3858   11.883  -8.9974   11.188   22.192   8.7720   15.172   7.1097 7.019897 11.29143 
1 1 1   20   13   37 f   37.987   7.6785   40.117   12.631   44.446   14.785   28.423   24.300   42.935   8.6483   33.040   12.690 9.894920 15.35698 
1 1 1   20   13   38 o   44.413   8.2396   66.868   15.102   72.613   15.848   10.123   49.809   56.744   6.7717   32.082   15.024 24.66241 16.47911 
1 1 1   20   13   39 o   20.980   6.9462  -5.0816   12.772  -4.1274   14.471  -8.4452   27.170   18.525   8.4686   23.435   11.013 -4.910038 13.89247 
1 1 1   20   13   40 f   29.814   10.110   23.591   14.819   23.591   14.819   0.0000   0.0000   29.814   10.110  ?   ?       ?      ? 
1 1 1   20   13   41 o   31.615   8.4973   22.785   13.216   14.256   14.971   52.900   28.130   24.744   9.8254   38.485   13.867 -13.74078 16.99467 
1 1 1   20   13   42 o   32.870   7.8770   34.677   13.494   39.340   15.373   19.028   28.164   37.856   9.7776   27.884   12.353 9.972015 15.75396 
1 1 1   20   14    0 o   19.204   6.5809   11.255   8.6104   11.255   8.6104   11.255   8.6104   19.204   9.3069   19.204   9.3069 0.000000 0.000000 
1 1 1   20   14    1 o  204.936   2.3990  868.880   20.124  857.992   30.285  877.490   26.930  203.760   3.6036  206.111   3.1678 -2.351166 4.798031 
1 1 1   20   14    2 o  135.348   2.2766  376.160   12.555  392.468   19.501  364.616   16.407  137.823   3.4305  132.873   2.9939 4.950348 4.553232 
1 1 1   20   14    3 o  110.991   2.3090  255.004   10.487  250.187   15.773  258.820   14.040  110.037   3.4755  111.945   3.0408 -1.908035 4.617957 
1 1 1   20   14    4 o  200.988   2.3832  833.974   19.557  839.012   29.893  830.203   25.859  201.492   3.5970  200.483   3.1273 1.008926 4.766380 
1 1 1   20   14    5 o  123.320   2.3228  315.198   11.684  306.955   17.773  321.472   15.506  121.878   3.5357  124.762   3.0135 -2.883446 4.645658 
1 1 1   20   14    6 o  152.669   3.0056  481.374   18.926   0.0000   0.0000  481.374   18.926  ?   ?   152.669   3.0056      ?      ? 
1 1 1   20   14    7 f   63.278   3.1546   80.395   7.8409   90.774   13.653   75.287   9.5779   66.209   4.9998   60.348   3.8481 5.861195 6.309172 
1 1 1   20   14    8 o  154.404   2.2918  492.452   14.455  493.034   22.025  492.011   19.159  154.465   3.4571  154.343   3.0096 0.1225128 4.583647 
1 1 1   20   14    9 f  120.652   2.6871  299.915   12.505  303.907   22.072  298.027   15.175  121.188   4.4158  120.117   3.0632 1.071823 5.374204 
1 1 1   20   14   10 o  255.706   2.9141  1344.52   27.878  1371.60   52.041  1333.61   33.015  257.339   4.9031  254.072   3.1506 3.266342 5.828112 
1 1 1   20   14   11 o  155.313   2.2909  499.554   14.316  493.158   22.844  503.692   18.372  154.458   3.5858  156.167   2.8523 -1.708679 4.581888 
1 1 1   20   14   12 o  147.262   2.3642  452.186   14.171  419.673   21.404  477.559   18.908  142.478   3.6423  152.046   3.0151 -9.568100 4.728357 
1 1 1   20   14   13 o  245.217   2.6509  1244.19   26.674  1236.64   39.714  1250.39   36.005  244.503   3.9381  245.930   3.5496 -1.426956 5.301752 
1 1 1   20   14   14 o  129.533   2.6271  346.663   14.016  321.752   19.496  373.307   20.164  124.715   3.7903  134.352   3.6388 -9.636909 5.254252 
1 1 1   20   14   15 f  249.956   2.6971  1294.29   27.707  1274.35   40.761  1311.42   37.778  248.126   3.9829  251.786   3.6378 -3.659943 5.394182 
1 1 1   20   14   16 o  159.497   2.8314  529.283   18.431  546.079   24.586  507.734   27.848  162.451   3.6694  156.542   4.3132 5.908569 5.662858 
1 1 1   20   14   17 o  109.990   2.8727  248.959   12.987  225.316   17.591  277.289   19.256  104.285   4.0897  115.696   4.0353 -11.41104 5.745388 
1 1 1   20   14   18 o   86.161   3.2942  155.866   11.540  167.697   15.464  141.001   17.334   89.948   4.1685   82.374   5.1021 7.573822 6.588440 
1 1 1   20   14   19 o   91.297   3.2324  171.129   11.956  163.426   15.372  182.924   19.022   88.772   4.1986   93.821   4.9159 -5.049377 6.464796 
1 1 1   20   14   20 o   85.032   3.2736  150.712   11.298  148.219   17.537  152.480   14.771   84.364   5.0401   85.699   4.1789 -1.334770 6.547208 
1 1 1   20   14   21 o   54.593   4.3075   62.011   9.5057   64.665   15.153   60.289   12.206   55.471   6.6231   53.716   5.5095 1.754501 8.615075 
1 1 1   20   14   22 o   52.376   4.6440   57.557   9.9274   59.193   15.264   56.357   13.069   52.948   6.9894   51.805   6.1167 1.142643 9.287943 
1 1 1   20   14   23 o  126.166   3.1588  337.939   16.079  296.130   24.481  369.653   21.322  119.007   4.9877  133.325   3.8775 -14.31774 6.317601 
1 1 1   20   14   24 o   38.587   6.0882   38.734   9.7005   13.341   17.179   50.621   11.754   28.120   10.701   49.054   5.8094 -20.93419 12.17631 
1 1 1   20   14   25 o  100.887   3.5104  221.256   13.648  188.189   22.908  239.451   16.993   94.512   5.8768  107.262   3.8411 -12.74980 7.020737 
1 1 1   20   14   26 o   28.068   6.1431   17.416   7.8980   14.480   11.889   19.736   10.566   26.448   9.0548   29.687   8.3042 -3.239546 12.28613 
1 1 1   20   14   27 o   33.290   6.1371   25.083   8.4934   26.097   12.524   24.219   11.557   33.873   8.8622   32.707   8.4923 1.165863 12.27427 
1 1 1   20   14   28 o   29.281   6.4324   19.083   8.5981   17.878   12.339   20.220   11.987   28.558   9.2084   30.004   8.9837 -1.445412 12.86471 
1 1 1   20   14   29 o   48.411   5.5350   48.898   10.682   43.494   13.229   59.024   18.108   44.930   7.1388   51.892   8.4607 -6.962269 11.07006 
1 1 1   20   14   30 o   16.308   5.2324  -5.1780   7.6446  -6.6954   11.009  -3.7651   10.623   15.991   7.3384   16.625   7.4606 -0.6338062 10.46480 
1 1 1   20   14   31 o   25.167   6.5796   11.847   9.1571   15.826   13.099   8.0429   12.806   27.261   9.4952   23.072   9.1108 4.188276 13.15926 
1 1 1   20   14   32 o   61.194   4.0530   80.499   10.186   72.944   14.497   87.866   14.316   58.222   6.0370   64.165   5.4094 -5.942078 8.106029 
1 1 1   20   14   33 o   87.375   4.6219  165.804   16.474  135.519   22.631  199.938   24.026   78.581   6.9827   96.168   6.0574 -17.58722 9.243893 
1 1 1   20   14   34 o   45.963   6.4431   49.072   11.183   48.036   13.519   51.318   19.901   46.570   7.0383   45.356   10.794 1.213436 12.88629 
1 1 1   20   14   35 o   32.586   8.3824   25.729   14.551   30.241   21.728   22.061   19.594   34.417   12.210   30.755   11.489 3.661413 16.76488 
1 1 1   20   14   36 o   31.444   7.3448   10.957   11.352  -3.0386   13.045   54.612   23.039   18.237   8.2186   44.650   12.175 -26.41230 14.68954 
1 1 1   20   14   37 f   42.241   7.4184   51.089   12.943   58.257   15.051   30.736   25.361   50.660   7.2034   33.822   12.971 16.83767 14.83682 
1 1 1   20   14   38 o   26.587   7.1569   16.485   11.584   22.961   13.239  -4.6674   23.928   30.047   9.5226   23.126   10.687 6.921419 14.31388 
1 1 1   20   14   39 o   22.701   7.2075   3.4236   12.420   5.1396   14.040  -2.7529   26.637   21.225   9.0641   24.177   11.209 -2.952019 14.41507 
1 1 1   20   14   40 o   23.900   9.7771   11.602   15.316   11.602   15.316   0.0000   0.0000   23.900   9.7771  ?   ?       ?      ? 
1 1 1   20   14   41 o   30.489   9.2890   26.178   20.747   45.169   33.434   14.286   26.457   34.315   14.281   26.663   11.883 7.652058 18.57791 
1 1 1   20   15    0 o  208.170   2.5890  895.479   31.414  895.479   31.414  895.479   31.414  208.170   3.6613  208.170   3.6613 0.000000 0.000000 
1 1 1   20   15    1 o   87.841   2.4820  159.212   8.9062  161.111   13.603  157.786   11.783   88.287   3.7357   87.394   3.2689 0.8921967 4.963947 
1 1 1   20   15    2 o  102.858   2.3619  218.839   9.9177  216.767   15.108  220.408   13.147  102.416   3.5765  103.301   3.0858 -0.8843842 4.723738 
1 1 1   20   15    3 o  126.446   2.2807  329.991   11.768  332.360   18.031  328.234   15.533  126.826   3.4470  126.067   2.9873 0.7587204 4.561324 
1 1 1   20   15    4 o  132.611   2.2823  364.530   12.375  353.265   18.612  373.457   16.569  130.752   3.4512  134.470   2.9874 -3.718521 4.564623 
1 1 1   20   15    5 o  240.927   2.8816  1196.82   26.952  1211.13   46.961  1189.79   32.912  241.884   4.7072  239.970   3.3253 1.913849 5.763263 
1 1 1   20   15    6 o  247.520   2.9007  1268.06   27.992  1264.45   48.180  1269.89   34.392  247.135   4.7268  247.905   3.3636 -0.7704620 5.801452 
1 1 1   20   15    7 o  138.146   2.2747  393.836   12.832  397.479   19.617  391.111   16.965  138.686   3.4295  137.605   2.9892 1.080658 4.549359 
1 1 1   20   15    8 o  280.656   2.7330  1624.43   31.192  1654.55   48.538  1603.25   40.711  282.805   4.1613  278.506   3.5442 4.298889 5.466041 
1 1 1   20   15    9 o   61.567   3.5352   80.343   8.2519   73.816   14.643   83.380   9.9890   59.634   5.9535   63.501   3.8140 -3.867508 7.070420 
1 1 1   20   15   10 o   26.345   5.7268   14.806   6.5854   10.969   12.279   16.356   7.8025   25.183   9.1482   27.507   6.8917 -2.324068 11.45354 
1 1 1   20   15   11 o  124.471   2.6714  325.972   12.718  305.226   22.337  335.924   15.470  121.421   4.4602  127.521   2.9414 -6.100166 5.342773 
1 1 1   20   15   12 o  110.183   2.4480  251.842   10.927  246.364   17.046  255.663   14.237  109.135   3.7869  111.231   3.1033 -2.095772 4.896067 
1 1 1   20   15   13 o   70.396   3.1425  102.583   9.0697  103.307   13.609  102.005   12.165   70.603   4.6736   70.190   4.2021 0.4129333 6.284933 
1 1 1   20   15   14 o  109.495   2.6228  249.004   11.798  233.213   17.093  263.375   16.305  106.147   3.9042  112.843   3.5034 -6.695862 5.245637 
1 1 1   20   15   15 o  127.257   2.5479  335.018   13.339  336.297   19.598  333.915   18.206  127.468   3.7277  127.046   3.4745 0.4219971 5.095891 
1 1 1   20   15   16 o  111.110   2.5567  258.053   11.556  237.909   17.450  273.785   15.422  107.170   3.9478  115.049   3.2500 -7.878967 5.113484 
1 1 1   20   15   17 o  138.230   2.8287  394.606   16.004  385.757   21.252  406.199   24.325  136.481   3.7754  139.978   4.2134 -3.497208 5.657405 
1 1 1   20   15   18 o  204.116   3.1044  858.205   25.255  840.179   31.702  889.512   41.780  201.362   3.8172  206.870   4.8967 -5.508377 6.208756 
1 1 1   20   15   19 o   84.194   3.4491  150.420   11.666  163.098   15.291  132.766   18.045   88.625   4.1832   79.763   5.4850 8.861595 6.898209 
1 1 1   20   15   20 o   74.308   3.1952  114.841   9.7888  116.452   14.079  113.333   13.620   74.806   4.5631   73.810   4.4739 0.9958344 6.390444 
1 1 1   20   15   21 o   95.985   3.0845  188.909   11.997  206.682   19.152  177.433   15.390   99.581   4.6631   92.388   4.0389 7.192856 6.169056 
1 1 1   20   15   22 o   52.380   4.0492   57.921   8.6711   49.214   12.253   66.655   12.272   48.344   6.1453   56.416   5.2743 -8.071636 8.098348 
1 1 1   20   15   23 o   92.482   2.9164  178.458   11.079  158.889   15.570  198.527   15.767   87.292   4.3245   97.672   3.9140 -10.38011 5.832717 
1 1 1   20   15   24 o   37.350   5.4914   30.995   8.2910   24.802   12.203   36.304   11.300   33.297   8.7656   41.403   6.6171 -8.105335 10.98281 
1 1 1   20   15   25 o   93.390   3.6928  190.556   13.206  163.288   22.470  204.945   16.323   87.695   6.2125   99.086   3.9941 -11.39058 7.385682 
1 1 1   20   15   26 o   28.200   5.9568   14.056   8.0213   30.427   13.156   4.3689   10.120   36.580   8.8222   19.819   8.0065 16.76151 11.91368 
1 1 1   20   15   27 o   20.607   5.7419  -0.0269   7.8991   14.962   12.543  -9.8793   10.169   26.856   9.2950   14.357   6.7439 12.49940 11.48375 
1 1 1   20   15   28 o  103.683   3.8982  226.665   15.910  224.747   19.729  230.232   26.904  103.449   4.6240  103.916   6.2772 -0.4675217 7.796418 
1 1 1   20   15   29 o   23.802   6.1589   10.793   7.8791   11.514   11.512   10.159   10.807   24.345   8.8555   23.258   8.5620 1.086386 12.31781 
1 1 1   20   15   30 o   27.083   6.1615   16.000   8.0966   10.131   11.725   21.348   11.194   23.628   8.8753   30.538   8.5489 -6.909943 12.32293 
1 1 1   20   15   31 o   53.479   4.6002   60.830   10.037   69.350   15.666   54.898   13.071   56.515   6.7210   50.443   6.2828 6.072056 9.200327 
1 1 1   20   15   32 o   43.550   5.5382   42.188   9.6811   35.669   13.020   50.250   14.478   39.323   8.2890   47.778   7.3472 -8.454319 11.07647 
1 1 1   20   15   33 f   20.400   5.9205   2.5956   8.4396   11.239   12.173  -5.4032   11.711   24.029   9.0398   16.771   7.6480 7.258102 11.84101 
1 1 1   20   15   34 o   67.122   3.7555   97.068   10.382   96.143   15.040   97.910   14.350   66.734   5.4642   67.511   5.1534 -0.7776947 7.511046 
1 1 1   20   15   35 o   27.136   6.8672   17.480   10.084   2.5484   20.432   22.288   11.594   23.946   10.569   30.326   8.7714 -6.380674 13.73447 
1 1 1   20   15   36 f   81.712   4.6940  146.865   14.266  143.693   16.849  154.895   26.813   81.544   5.0099   81.881   7.9395 -0.3372421 9.388012 
1 1 1   20   15   37 o   23.039   7.0366   5.7033   10.814   5.4269   12.403   6.5798   22.085   20.806   8.6817   25.272   11.076 -4.465734 14.07329 
1 1 1   20   15   38 o   26.821   7.8129   2.7263   18.604 -71.7370   33.745   35.243   22.300   19.005   9.5597   34.636   12.360 -15.63099 15.62581 
1 1 1   20   15   39 o   42.128   8.7555   45.239   14.244   36.549   16.206   74.761   29.871   36.655   10.295   47.602   14.165 -10.94700 17.51110 
1 1 1   20   15   40 o   61.944   7.5181  101.298   15.880   98.235   18.316  110.571   31.873   64.760   6.8573   59.129   13.382 5.630669 15.03629 
1 1 1   20   15   41 o   50.787   8.0783   70.383   14.832   65.188   17.042   86.610   30.118   51.421   8.0354   50.153   14.017 1.268158 16.15664 
1 1 1   20   16    0 o  141.291   2.4376  412.857   20.062  412.857   20.062  412.857   20.062  141.291   3.4473  141.291   3.4473 0.000000 0.000000 
1 1 1   20   16    1 o  135.836   2.2926  381.301   12.702  380.727   19.456  381.727   16.769  135.728   3.4755  135.944   2.9907 -0.2161865 4.585127 
1 1 1   20   16    2 f  226.547   2.4784  1058.81   22.885  1073.24   35.275  1048.32   30.072  227.840   3.7538  225.253   3.2369 2.587341 4.956708 
1 1 1   20   16    3 o   44.529   3.5533   40.590   6.4846   45.688   9.8666   36.714   8.6038   46.959   5.0943   42.100   4.9550 4.858704 7.106600 
1 1 1   20   16    4 o  197.820   3.1335  808.453   25.566   0.0000   0.0000  808.453   25.566  ?   ?   197.820   3.1335      ?      ? 
1 1 1   20   16    5 o   69.804   3.0675   98.912   8.4047  106.999   14.534   94.849   10.302   71.873   4.9030   67.734   3.6876 4.138832 6.134959 
1 1 1   20   16    6 o  122.555   2.5738  307.470   12.369  320.207   21.258  300.950   15.209  124.411   4.1429  120.699   3.0551 3.711777 5.147553 
1 1 1   20   16    7 o  108.009   2.4550  241.206   10.927  239.017   15.756  243.234   15.165  107.531   3.5527  108.487   3.3893 -0.9560318 4.910078 
1 1 1   20   16    8 o  175.433   2.6772  633.591   18.111  644.438   32.010  628.484   21.964  176.448   4.3985  174.418   3.0532 2.030502 5.354352 
1 1 1   20   16    9 o  198.954   2.7382  818.744   21.105  818.729   36.814  818.750   25.758  198.849   4.4887  199.057   3.1374 -0.2080841 5.476419 
1 1 1   20   16   10 o  150.216   2.6382  467.064   15.364  465.726   26.741  467.724   18.772  149.979   4.3230  150.454   3.0252 -0.4741821 5.276325 
1 1 1   20   16   11 o   96.480   2.7917  191.536   10.224  195.464   18.615  189.840   12.234   97.119   4.6472   95.842   3.0949 1.277191 5.583464 
1 1 1   20   16   12 o   30.893   5.3447   19.640   6.5068   24.969   11.163   16.897   8.0080   33.865   8.1007   27.920   6.9744 5.945124 10.68946 
1 1 1   20   16   13 o  185.318   2.4962  710.397   19.011  711.596   28.114  709.386   25.805  185.438   3.6759  185.199   3.3783 0.2385406 4.992455 
1 1 1   20   16   14 o   44.356   4.8347   45.129   7.9468   25.297   11.711   62.053   10.819   34.032   8.3956   54.680   4.7971 -20.64877 9.669480 
1 1 1   20   16   15 o   34.055   5.4581   25.080   7.4830   28.494   11.063   22.201   10.160   36.204   7.6485   31.905   7.7887 4.299015 10.91619 
1 1 1   20   16   16 o   29.425   5.0224   20.560   6.7402   4.7660   11.154   29.644   8.4592   21.106   8.4481   37.744   5.4339 -16.63812 10.04483 
1 1 1   20   16   17 o   53.504   3.4272   57.546   7.3976   69.185   12.100   50.599   9.3481   57.658   5.0883   49.350   4.5927 8.307487 6.854445 
1 1 1   20   16   18 o   88.348   3.3465  160.879   11.978  154.495   15.413  170.614   19.032   86.222   4.3341   90.474   5.1002 -4.252670 6.693040 
1 1 1   20   16   19 o   72.134   3.5232  107.012   10.345   99.924   13.409  117.430   16.258   69.269   4.6935   74.999   5.2558 -5.730293 7.046443 
1 1 1   20   16   20 o   93.947   3.1290  181.080   11.955  168.568   15.457  199.709   18.861   90.021   4.1630   97.874   4.6723 -7.853394 6.257913 
1 1 1   20   16   21 o   92.080   3.6568  178.734   13.760  204.193   19.335  152.607   19.587   98.880   4.7410   85.280   5.5688 13.60092 7.313641 
1 1 1   20   16   22 f   94.962   2.8950  187.839   11.332  179.720   15.957  196.100   16.096   92.875   4.1657   97.049   4.0213 -4.174034 5.789955 
1 1 1   20   16   23 o   78.320   3.1391  128.205   10.101  125.995   14.878  130.096   13.759   77.648   4.6455   78.992   4.2231 -1.343605 6.278161 
1 1 1   20   16   24 o  211.143   3.0759  934.437   26.409  921.635   40.753  943.705   34.674  209.632   4.7134  212.654   3.9534 -3.021713 6.151867 
1 1 1   20   16   25 o   79.594   3.8561  132.824   11.784  136.581   21.003  131.098   14.235   80.070   6.3600   79.119   4.3623 0.9507751 7.712274 
1 1 1   20   16   26 o   62.363   3.7002   81.738   9.4965   89.284   13.921   75.169   12.988   65.057   5.1880   59.670   5.2774 5.387047 7.400452 
1 1 1   20   16   27 o   47.086   4.7689   48.644   8.8418   38.144   12.552   58.986   12.457   41.424   7.6279   52.749   5.7257 -11.32558 9.537720 
1 1 1   20   16   28 o   51.217   5.6009   52.572   10.981   36.154   13.471   85.089   18.957   39.841   8.4593   62.593   7.3432 -22.75266 11.20186 
1 1 1   20   16   29 o   87.631   4.5532  165.135   16.453  169.981   23.431  160.422   23.109   88.927   6.3884   86.335   6.4898 2.592751 9.106479 
1 1 1   20   16   30 o   99.876   3.6700  212.665   15.071  198.973   21.652  225.533   20.991   96.605   5.4342  103.147   4.9341 -6.542618 7.340031 
1 1 1   20   16   31 o   71.301   3.7429  109.102   10.929   99.914   15.952  117.229   15.003   68.283   5.6641   74.319   4.8946 -6.035591 7.485888 
1 1 1   20   16   32 o  115.538   4.6670  299.737   18.692  307.272   21.521  276.595   37.716  120.481   4.3309  110.596   8.2684 9.884163 9.333984 
1 1 1   20   16   33 o   33.079   6.4245   27.242   9.2266   19.555   14.828   32.099   11.786   29.038   10.103   37.120   7.9386 -8.081608 12.84901 
1 1 1   20   16   34 o   37.602   6.2548   33.348   9.4644   40.119   14.702   28.557   12.368   40.779   8.9838   34.425   8.7053 6.353462 12.50964 
1 1 1   20   16   35 o   28.232   7.5265   17.705   10.830   18.982   22.251   17.309   12.397   29.432   11.879   27.032   9.2463 2.399498 15.05300 
1 1 1   20   16   36 o   69.111   5.5490  113.412   13.822  117.633   16.340  102.793   25.918   73.428   5.3953   64.795   9.6982 8.633415 11.09794 
1 1 1   20   16   37 o   20.064   6.5709 -14.3904   10.398 -22.6587   11.752   15.414   22.311   12.591   6.2185   27.538   11.577 -14.94700 13.14173 
1 1 1   20   16   38 o   33.933   8.4274   31.529   13.610   28.644   16.020   39.010   25.800   32.487   10.494   35.378   13.189 -2.890503 16.85479 
1 1 1   20   16   39 o   35.815   8.6255   36.319   14.083   30.420   16.590   51.534   26.642   32.727   10.687   38.903   13.542 -6.175350 17.25103 
1 1 1   20   16   40 o   30.820   7.1604   29.333   13.037   40.641   15.065  -4.3767   26.011   38.852   9.4844   22.788   10.730 16.06332 14.32076 
1 1 1   20   17    0 o  114.801   2.4830  272.863   16.591  272.863   16.591  272.863   16.591  114.801   3.5115  114.801   3.5115 0.000000 0.000000 
1 1 1   20   17    1 o  143.809   2.2852  428.178   13.445  420.337   20.245  434.365   17.983  142.609   3.4420  145.008   3.0068 -2.398178 4.570386 
1 1 1   20   17    2 o  115.886   2.3095  276.171   10.924  286.494   16.835  268.663   14.357  117.733   3.4669  114.039   3.0523 3.693703 4.619094 
1 1 1   20   17    3 o  140.943   2.5893  411.389   14.229  408.608   24.466  412.811   17.491  140.524   4.2212  141.363   2.9999 -0.8391724 5.178663 
1 1 1   20   17    4 o  121.370   2.5924  305.047   12.285  303.070   21.062  306.066   15.125  121.020   4.2196  121.719   3.0127 -0.6991196 5.184755 
1 1 1   20   17    5 o   96.333   2.7127  193.664   10.249  186.232   17.259  197.713   12.739   94.847   4.4120   97.819   3.1575 -2.971672 5.425451 
1 1 1   20   17    6 o  100.103   2.3760  206.374   9.7277  212.775   14.842  201.554   12.880  101.446   3.5472   98.760   3.1620 2.684975 4.751936 
1 1 1   20   17    7 o  114.045   2.3383  268.410   10.895  271.963   16.639  265.743   14.415  114.687   3.5175  113.403   3.0819 1.284355 4.676650 
1 1 1   20   17    8 o   78.002   3.1302  126.548   9.2245  124.704   16.785  127.345   11.041   77.525   5.2495   78.480   3.4111 -0.9552841 6.260409 
1 1 1   20   17    9 o  162.203   2.6196  546.978   16.165  537.326   29.035  551.314   19.461  161.059   4.3709  163.346   2.8886 -2.287140 5.239141 
1 1 1   20   17   10 o  173.122   2.6400  620.668   17.321  618.909   31.444  621.434   20.754  172.829   4.4112  173.414   2.9017 -0.5848389 5.280063 
1 1 1   20   17   11 o   99.513   2.7591  200.130   10.402  217.370   19.279  193.049   12.355  102.392   4.5650   96.634   3.1000 5.758446 5.518119 
1 1 1   20   17   12 f  162.167   2.6678  539.937   16.663  557.083   29.616  531.996   20.155  163.924   4.3805  160.409   3.0464 3.514679 5.335676 
1 1 1   20   17   13 o  107.046   2.7060  237.309   11.901  210.424   16.591  265.803   17.081  100.781   3.9914  113.311   3.6548 -12.53028 5.411941 
1 1 1   20   17   14 o   57.784   3.5403   69.912   8.3662   63.803   12.299   75.173   11.413   55.383   5.3845   60.186   4.5979 -4.802761 7.080499 
1 1 1   20   17   15 o  168.154   2.6647  586.209   18.462  595.293   25.653  576.450   26.591  169.527   3.6689  166.782   3.8656 2.745148 5.329477 
1 1 1   20   17   16 o   97.319   2.6645  198.986   10.498  180.589   16.025  212.816   13.894   93.268   4.1658  101.371   3.3232 -8.103012 5.328969 
1 1 1   20   17   17 o   48.053   4.1507   48.953   8.0773   44.339   12.297   52.455   10.712   45.958   6.4877   50.148   5.1791 -4.190140 8.301373 
1 1 1   20   17   18 o  118.127   2.6351  289.724   12.806  288.072   18.755  291.168   17.529  117.783   3.8608  118.470   3.5874 -0.6870346 5.270236 
1 1 1   20   17   19 o   92.595   3.1181  178.635   11.770  178.828   15.519  178.373   18.059   92.725   4.0580   92.465   4.7352 0.2599716 6.236169 
1 1 1   20   17   20 o  139.267   3.1881  402.270   18.210  383.438   24.279  426.488   27.532  135.622   4.3404  142.911   4.6709 -7.289520 6.376239 
1 1 1   20   17   21 o   51.009   4.1042   55.196   8.5147   44.831   12.038   65.573   12.045   46.080   6.3340   55.938   5.2209 -9.858322 8.208337 
1 1 1   20   17   22 o   36.559   5.4236   29.551   7.8934   29.648   11.682   29.470   10.708   36.535   7.9760   36.584   7.3517 -0.4904175E-01 10.84727 
1 1 1   20   17   23 o   55.781   3.7950   65.024   8.6909   73.887   12.965   57.790   11.712   59.217   5.3083   52.346   5.4248 6.870972 7.589911 
1 1 1   20   17   24 o   54.174   3.9125   61.750   8.7214   67.365   12.833   56.930   11.889   56.457   5.5111   51.890   5.5551 4.566742 7.825016 
1 1 1   20   17   25 o  102.810   5.1890  240.728   20.335  271.805   25.560  187.138   33.564  113.370   5.4663   92.249   8.8216 21.12064 10.37796 
1 1 1   20   17   26 o   70.306   3.3911  103.687   9.8180  112.072   14.243   96.095   13.552   73.027   4.7289   67.585   4.8616 5.441277 6.782206 
1 1 1   20   17   27 o   74.182   4.8181  116.049   14.742  116.049   14.742   0.0000   0.0000   74.182   4.8181  ?   ?       ?      ? 
1 1 1   20   17   28 o   40.200   5.5525   36.377   8.8992   33.694   13.597   38.387   11.770   38.243   8.8031   42.157   6.7695 -3.914318 11.10493 
1 1 1   20   17   29 o   25.380   6.3301   13.441   8.2114   11.615   12.980   14.660   10.603   24.872   9.3389   25.888   8.5478 -1.015768 12.66016 
1 1 1   20   17   30 o   38.201   6.2371   33.944   9.3767   33.996   15.486   33.914   11.782   37.760   9.8432   38.643   7.6629 -0.8830566 12.47429 
1 1 1   20   17   31 o   39.380   5.5879   35.737   8.7553   34.223   12.553   37.171   12.217   38.414   8.1743   40.347   7.6211 -1.933773 11.17587 
1 1 1   20   17   32 o   44.448   5.6189   45.678   9.9146   35.546   14.022   55.810   14.021   38.583   8.9797   50.314   6.7566 -11.73088 11.23775 
1 1 1   20   17   33 o   78.463   3.4843  132.304   11.203  129.393   16.701  134.686   15.105   77.489   5.2255   79.437   4.6104 -1.948425 6.968660 
1 1 1   20   17   34 o   21.872   5.8457   5.7406   8.4449  -8.3098   12.310   18.230   11.607   16.176   7.5400   27.567   8.9352 -11.39122 11.69142 
1 1 1   20   17   35 o   21.583   6.8224  -0.1852   10.844  -2.0308   12.534   5.3059   21.620   18.185   8.1362   24.981   10.954 -6.795822 13.64476 
1 1 1   20   17   36 o   32.385   7.2158   29.485   11.701   36.421   13.789   11.639   22.119   38.240   8.9080   26.529   11.354 11.71118 14.43154 
1 1 1   20   17   37 o   38.525   7.8389   40.144   12.708   37.019   15.765   45.942   21.474   37.380   10.021   39.670   12.057 -2.290836 15.67782 
1 1 1   20   17   38 o   36.606   8.4371   38.151   13.720   34.556   16.263   47.027   25.551   35.317   10.438   37.895   13.258 -2.577477 16.87411 
1 1 1   20   17   39 o   26.849   7.5201   18.854   13.202   25.484   15.187  -1.6576   26.712   30.143   10.234   23.555   11.021 6.588869 15.04016 
1 1 1   20   18    0 o   83.696   2.7123  145.597   13.178  145.597   13.178  145.597   13.178   83.696   3.8358   83.696   3.8358 0.000000 0.000000 
1 1 1   20   18    1 o  266.301   2.6628  1461.56   28.812  1497.91   45.027  1436.36   37.492  269.028   4.0580  263.573   3.4488 5.454651 5.325540 
1 1 1   20   18    2 o  183.043   2.3515  693.125   17.580  688.951   26.753  696.298   23.322  182.526   3.5536  183.560   3.0805 -1.033875 4.702961 
1 1 1   20   18    3 o  120.644   2.6254  304.251   12.306  291.469   21.106  310.834   15.147  118.640   4.3134  122.649   2.9943 -4.008965 5.250832 
1 1 1   20   18    4 o  211.557   2.7476  926.372   22.632  925.436   39.075  926.845   27.762  211.357   4.4825  211.757   3.1787 -0.3998566 5.495150 
1 1 1   20   18    5 o  126.437   2.3113  331.739   11.935  321.041   18.035  340.074   15.919  124.593   3.5095  128.281   3.0087 -3.688408 4.622671 
1 1 1   20   18    6 o  163.914   2.1678  555.234   14.652  558.795   20.984  551.847   20.466  164.423   3.0943  163.405   3.0368 1.018539 4.335527 
1 1 1   20   18    7 o   52.423   3.9149   57.326   7.7703   56.519   14.081   57.680   9.3174   52.077   6.5558   52.768   4.2812 -0.6901703 7.829856 
1 1 1   20   18    8 o   62.591   3.5454   85.392   8.2101   71.698   14.787   91.495   9.8714   58.684   6.1094   66.499   3.5992 -7.814442 7.090759 
1 1 1   20   18    9 o   86.436   3.0184  160.216   9.7338  141.838   17.570  168.354   11.692   82.638   5.1550   90.233   3.1417 -7.595428 6.036870 
1 1 1   20   18   10 o   42.619   4.9455   42.861   7.2010   30.274   13.481   47.887   8.5179   37.175   8.9089   48.063   4.2969 -10.88770 9.891001 
1 1 1   20   18   11 o   59.774   3.6969   77.287   7.9925   67.855   15.120   80.944   9.4154   57.018   6.4296   62.529   3.6508 -5.510513 7.393783 
1 1 1   20   18   12 o   79.130   3.0605  129.331   9.1541  131.169   16.761  128.549   10.928   79.442   5.1154   78.819   3.3616 0.6226578 6.121095 
1 1 1   20   18   13 o  135.918   2.6083  382.712   14.616  369.544   20.626  395.993   20.715  133.561   3.7443  138.276   3.6322 -4.715454 5.216573 
1 1 1   20   18   14 o  136.197   2.5407  383.545   14.221  393.885   21.137  374.994   19.222  137.847   3.7178  134.546   3.4638 3.300568 5.081356 
1 1 1   20   18   15 o  147.896   2.8029  448.490   16.894  420.403   21.984  489.002   26.403  142.362   3.7440  153.431   4.1722 -11.06819 5.605816 
1 1 1   20   18   16 o   54.616   3.3364   59.922   7.2442   70.327   12.338   54.447   8.9492   58.054   5.1527   51.178   4.2397 6.876171 6.672742 
1 1 1   20   18   17 o   51.362   3.9749   56.911   8.1369   46.878   12.516   64.257   10.709   47.201   6.4290   55.523   4.6763 -8.322079 7.949858 
1 1 1   20   18   18 o   74.586   3.1736  117.422   9.6382  100.784   14.049  132.214   13.247   69.453   4.9046   79.718   4.0290 -10.26427 6.347240 
1 1 1   20   18   19 o  111.685   2.7017  259.759   12.400  255.607   18.247  263.321   16.903  110.812   3.9925  112.559   3.6410 -1.747971 5.403438 
1 1 1   20   18   20 o   70.818   3.9816  105.871   11.569   96.071   16.633  115.055   16.101   67.546   5.9706   74.089   5.2692 -6.542412 7.963188 
1 1 1   20   18   21 o   80.348   3.1097  134.797   10.304  132.769   14.416  136.916   14.733   79.734   4.3835   80.963   4.4121 -1.228928 6.219485 
1 1 1   20   18   22 o   45.752   4.3752   44.823   8.1860   39.976   11.888   49.193   11.288   43.275   6.6608   48.230   5.6747 -4.955456 8.750354 
1 1 1   20   18   23 o   57.706   4.1101   70.435   9.6769   69.589   12.755   71.582   14.855   57.409   5.3866   58.003   6.2094 -0.5943413 8.220238 
1 1 1   20   18   24 o   71.655   3.4993  109.258   10.217   97.755   15.124  118.918   13.858   68.010   5.3917   75.299   4.4622 -7.289337 6.998656 
1 1 1   20   18   25 o   40.741   6.1935   40.110   9.2783   29.964   17.680   43.966   10.900   35.959   10.942   45.523   5.8054 -9.563709 12.38709 
1 1 1   20   18   26 o   60.747   3.8818   78.346   9.7196   78.068   13.978   78.607   13.525   60.610   5.5915   60.884   5.3858 -0.2740746 7.763548 
1 1 1   20   18   27 o   96.734   3.4821  197.365   13.498  195.923   17.155  199.710   21.873   96.549   4.3079   96.919   5.4720 -0.3703842 6.964224 
1 1 1   20   18   28 o   26.952   6.3078   15.672   8.1106   18.719   12.431   13.414   10.702   28.790   9.2385   25.113   8.5909 3.677233 12.61561 
1 1 1   20   18   29 o   35.298   5.8336   31.261   9.2319   10.861   14.643   44.721   11.894   25.113   9.7942   45.483   6.3402 -20.37043 11.66722 
1 1 1   20   18   30 o   33.503   6.4672   25.810   9.0559   31.728   14.440   21.973   11.626   36.394   9.5136   30.611   8.7631 5.783054 12.93442 
1 1 1   20   18   31 o   33.114   6.0220   26.684   8.5716   17.577   12.806   34.077   11.537   27.711   9.3979   38.517   7.5324 -10.80654 12.04393 
1 1 1   20   18   32 o   42.833   5.2313   41.853   8.9723   36.931   12.794   46.616   12.586   39.726   8.0835   45.940   6.6426 -6.214310 10.46266 
1 1 1   20   18   33 o   48.742   5.2938   53.891   10.311   44.987   13.828   65.041   15.475   43.719   7.9623   53.765   6.9784 -10.04642 10.58758 
1 1 1   20   18   34 o   49.164   5.1711   56.087   9.8786   40.757   13.858   71.923   14.085   41.198   8.4396   57.131   5.9777 -15.93313 10.34214 
1 1 1   20   18   35 o   30.104   7.4513   22.990   10.898   23.883   12.711   20.514   21.171   30.820   9.2561   29.387   11.679 1.433357 14.90254 
1 1 1   20   18   36 o   30.654   8.3476   24.402   15.007   17.243   20.252   33.119   22.348   27.581   11.258   33.726   12.328 -6.144512 16.69510 
1 1 1   20   18   37 o   29.853   6.8875   23.645   13.096   40.282   15.393 -19.9530   24.919   39.208   9.5968   20.498   9.8820 18.70918 13.77506 
1 1 1   20   18   38 o   26.292   7.8167   14.895   12.970   12.912   14.998   20.775   25.827   24.169   9.7530   28.415   12.218 -4.245808 15.63337 
1 1 1   20   18   39 o   22.035   7.2137  -6.3021   12.648 -14.5420   14.385   21.759   26.546   15.660   7.5390   28.410   12.301 -12.74988 14.42748 
1 1 1   20   19    0 o  287.613   2.9552  1710.71   49.552  1710.71   49.552  1710.71   49.552  287.613   4.1792  287.613   4.1792 0.000000 0.000000 
1 1 1   20   19    1 o   98.070   2.4522  200.938   9.7633  186.194   14.874  212.098   12.941   94.847   3.8023  101.292   3.0977 -6.444862 4.904397 
1 1 1   20   19    2 o   66.054   3.1999   90.428   8.1709   90.498   14.311   90.395   9.9526   66.014   5.2562   66.095   3.6509 -0.8162689E-01 6.399726 
1 1 1   20   19    3 o  181.547   2.6549  684.786   18.764  674.145   32.284  690.214   23.058  180.368   4.3398  182.727   3.0595 -2.358841 5.309836 
1 1 1   20   19    4 o  132.732   2.9908  364.173   16.373   0.0000   0.0000  364.173   16.373  ?   ?   132.732   2.9908      ?      ? 
1 1 1   20   19    5 o  239.837   2.3687  1189.73   23.430  1175.42   32.973  1204.32   33.301  238.380   3.3537  241.295   3.3461 -2.915085 4.737474 
1 1 1   20   19    6 o  220.774   2.2131  1007.80   20.090  1009.06   29.600  1006.73   27.355  220.879   3.2492  220.670   3.0056 0.2086945 4.426134 
1 1 1   20   19    7 o   93.127   2.5557  181.985   9.5384  168.303   15.095  191.079   12.307   90.127   4.0608   96.126   3.1041 -5.998627 5.111304 
1 1 1   20   19    8 o   90.997   2.5830  171.348   9.4102  171.752   15.273  171.100   11.947   91.041   4.0675   90.953   3.1848 0.8815765E-01 5.165996 
1 1 1   20   19    9 o   49.183   4.6140   57.416   7.5735   39.192   14.131   64.759   8.9706   42.453   8.3681   55.912   3.8900 -13.45986 9.228015 
1 1 1   20   19   10 o  114.779   2.7309  277.361   11.820  261.863   21.334  284.225   14.199  112.316   4.6054  117.242   2.9363 -4.925507 5.461858 
1 1 1   20   19   11 o   51.632   4.0392   57.554   7.5802   51.317   14.285   59.999   8.9431   49.474   7.0007   53.791   4.0310 -4.317142 8.078313 
1 1 1   20   19   12 o  175.035   2.6935  639.411   18.311  622.970   31.559  647.756   22.483  173.160   4.4188  176.909   3.0813 -3.748672 5.387051 
1 1 1   20   19   13 o   66.556   3.6674   96.549   9.5021   77.611   15.330  108.364   12.108   60.873   6.1061   72.240   4.0639 -11.36673 7.334852 
1 1 1   20   19   14 o   70.405   3.3375  103.453   9.6570   93.360   13.642  113.589   13.672   66.923   4.9425   73.888   4.4863 -6.964874 6.674969 
1 1 1   20   19   15 o   76.071   3.0820  121.266   9.5939  111.668   14.115  129.507   13.080   73.202   4.6751   78.940   4.0173 -5.738007 6.164083 
1 1 1   20   19   16 o   80.505   2.8273  138.433   8.9775  120.994   14.499  149.277   11.433   76.169   4.6151   84.841   3.2672 -8.671417 5.654581 
1 1 1   20   19   17 o  120.579   3.0061  306.123   14.744  326.675   19.723  280.092   22.197  125.335   3.8153  115.823   4.6465 9.512711 6.012249 
1 1 1   20   19   18 o   97.558   2.7195  198.026   10.936  197.271   15.725  198.733   15.219   97.362   3.9159   97.754   3.7748 -0.3912888 5.439036 
1 1 1   20   19   19 o   28.777   6.0667   16.417   7.8155   26.263   12.671   10.370   9.9295   34.245   8.8921   23.309   8.2554 10.93613 12.13342 
1 1 1   20   19   20 o   86.062   3.2639  152.119   11.455  136.010   14.897  175.425   17.918   80.632   4.4794   91.492   4.7483 -10.86059 6.527738 
1 1 1   20   19   21 o   98.387   3.3952  202.221   13.692  193.878   18.227  213.027   20.745   96.146   4.5963  100.628   4.9983 -4.482567 6.790350 
1 1 1   20   19   22 o   66.729   3.3905   94.015   9.2819   87.831   13.541   99.495   12.748   64.572   5.0844   68.886   4.4869 -4.314369 6.781094 
1 1 1   20   19   23 o   65.595   3.4526   90.181   9.3195   95.975   13.760   85.270   12.667   67.518   4.9413   63.672   4.8235 3.846203 6.905255 
1 1 1   20   19   24 o   49.834   4.2080   52.267   8.6012   60.451   12.844   45.611   11.582   53.366   5.8353   46.302   6.0647 7.063644 8.416095 
1 1 1   20   19   25 o   77.193   3.9023  129.860   11.586  116.804   19.820  136.637   14.279   73.721   6.5185   80.665   4.2920 -6.943268 7.804596 
1 1 1   20   19   26 o   71.857   4.7555  119.542   12.305   92.886   22.356  131.126   14.738   64.807   8.3637   78.907   4.5284 -14.09958 9.510990 
1 1 1   20   19   27 o   29.289   6.7462   15.967   9.5795   7.2852   11.961   31.496   15.997   22.206   8.7935   36.373   10.233 -14.16722 13.49235 
1 1 1   20   19   28 o   83.180   3.2042  146.622   10.958  138.458   15.829  154.136   15.184   80.853   4.7466   85.507   4.3055 -4.654716 6.408401 
1 1 1   20   19   29 o   99.212   4.1296  210.976   16.841  235.857   24.864  189.886   22.891  104.642   5.7610   93.782   5.9182 10.86044 8.259176 
1 1 1   20   19   30 o   70.599   3.8477  109.161   10.968   87.516   15.883  128.896   15.166   63.424   6.0717   77.773   4.7278 -14.34946 7.695315 
1 1 1   20   19   31 o   61.365   4.0077   83.748   9.7958   61.776   14.168  103.873   13.559   52.984   6.4831   69.746   4.7135 -16.76195 8.015482 
1 1 1   20   19   32 o   61.994   3.9922   84.372   10.141   76.629   14.670   91.459   14.034   59.014   6.0269   64.974   5.2371 -5.959267 7.984408 
1 1 1   20   19   33 o   55.925   4.5800   68.928   10.483   58.355   14.122   81.904   15.644   51.047   6.7073   60.802   6.2384 -9.754768 9.159986 
1 1 1   20   19   34 o   26.870   5.9648   13.359   8.6596   32.010   13.202  -0.7240   11.472   35.911   8.9466   17.828   7.8915 18.08282 11.92968 
1 1 1   20   19   35 o   58.068   5.5582   72.700   12.212   63.018   14.307   98.693   23.442   52.666   6.5865   63.470   8.9550 -10.80340 11.11637 
1 1 1   20   19   36 o   30.126   8.8320   20.674   16.905   37.504   30.032   12.868   20.454   34.268   13.811   25.983   11.013 8.284277 17.66392 
1 1 1   20   19   37 o   46.876   7.9907   61.651   14.410   59.072   17.255   67.597   26.197   47.927   9.0608   45.825   13.165 2.102882 15.98145 
1 1 1   20   19   38 o   24.564   6.9326   10.957   13.043   25.798   15.358 -27.4409   24.704   30.177   10.291   18.950   9.2914 11.22613 13.86519 
1 1 1   20   20    0 o   37.468   4.9984   32.028   9.7889   32.028   9.7889   32.028   9.7889   37.468   7.0688   37.468   7.0688 0.000000 0.000000 
1 1 1   20   20    1 o  165.867   2.6414  573.795   17.049  557.027   29.250  582.424   20.982  163.904   4.3268  167.831   3.0312 -3.926773 5.282898 
1 1 1   20   20    2 o  190.745   2.6982  752.080   19.945  757.682   34.827  749.346   24.330  191.135   4.4178  190.355   3.0989 0.7800751 5.396307 
1 1 1   20   20    3 o  139.529   2.6009  399.719   14.011  412.597   24.789  393.672   16.985  141.072   4.2604  137.985   2.9845 3.086853 5.201722 
1 1 1   20   20    4 o  166.663   2.3337  573.092   15.845  584.542   24.505  564.867   20.770  168.051   3.5355  165.276   3.0469 2.774323 4.667322 
1 1 1   20   20    5 o  203.621   2.2352  857.584   18.771  850.560   26.520  864.636   26.572  202.783   3.1708  204.458   3.1511 -1.674866 4.470308 
1 1 1   20   20    6 o  179.465   2.3808  670.323   17.442  636.977   26.251  696.680   23.338  175.395   3.6287  183.534   3.0831 -8.138382 4.761625 
1 1 1   20   20    7 o   81.165   2.6803  136.148   8.6813  137.791   14.240  135.176   10.952   81.507   4.2358   80.822   3.2855 0.6850204 5.360641 
1 1 1   20   20    8 o  158.885   2.3076  521.839   14.684  525.385   23.837  519.672   18.640  159.250   3.6292  158.520   2.8511 0.7299652 4.615161 
1 1 1   20   20    9 o  141.623   2.3130  411.267   13.088  431.286   21.579  399.619   16.461  144.258   3.6269  138.989   2.8715 5.268951 4.625950 
1 1 1   20   20   10 o  161.414   2.6209  540.590   15.986  539.628   29.168  541.003   19.112  161.130   4.3891  161.698   2.8657 -0.5679321 5.241766 
1 1 1   20   20   11 o  138.714   2.6581  396.738   14.192  406.086   25.200  392.396   17.174  139.755   4.3719  137.672   3.0245 2.083862 5.316110 
1 1 1   20   20   12 o   65.256   3.4918   94.953   8.2487   75.264   15.097  103.332   9.8487   59.909   6.1100   70.604   3.3821 -10.69489 6.983610 
1 1 1   20   20   13 o   76.836   3.3468  125.064   10.260  114.561   16.365  131.866   13.169   74.017   5.3607   79.654   4.0085 -5.636536 6.693644 
1 1 1   20   20   14 o  168.807   2.6729  592.226   18.605  600.177   26.134  584.055   26.493  169.973   3.7278  167.640   3.8317 2.333023 5.345893 
1 1 1   20   20   15 o   53.772   3.7398   61.376   8.1722   54.375   12.183   67.103   11.019   50.860   5.8076   56.684   4.7134 -5.823486 7.479541 
1 1 1   20   20   16 o  118.949   2.8659  295.389   13.980  302.443   18.923  286.915   20.742  120.584   3.8048  117.313   4.2869 3.271278 5.731868 
1 1 1   20   20   17 o   61.519   3.4097   75.964   8.0398   87.709   14.762   71.012   9.5863   64.631   5.5379   58.407   3.9794 6.223461 6.819412 
1 1 1   20   20   18 o   28.205   5.9625   17.489   7.4566   16.587   11.220   18.203   9.9790   27.729   8.7642   28.681   8.0868 -0.9520721 11.92507 
1 1 1   20   20   19 o   98.510   3.0569  205.480   12.082  191.607   19.093  214.744   15.603   95.522   4.8463  101.498   3.7271 -5.976112 6.113764 
1 1 1   20   20   20 o   66.922   3.3751   93.866   9.3005   97.546   13.635   90.664   12.718   68.125   4.8529   65.719   4.6921 2.406517 6.750246 
1 1 1   20   20   21 o   33.910   6.1499   26.072   8.6082   25.407   11.573   26.894   12.879   33.488   8.3952   34.331   8.9892 -0.8439598 12.29981 
1 1 1   20   20   22 o   86.668   3.9432  171.363   12.632  127.296   21.770  193.732   15.511   77.037   6.8517   96.299   3.9052 -19.26199 7.886465 
1 1 1   20   20   23 o   90.806   3.5108  177.106   12.383  163.132   20.961  184.597   15.347   87.649   5.7984   93.963   3.9600 -6.313896 7.021570 
1 1 1   20   20   24 o   65.047   3.4878   89.661   9.3132   86.353   13.693   92.510   12.704   63.839   5.2003   66.254   4.6492 -2.414768 6.975573 
1 1 1   20   20   25 o   72.308   4.1240  110.379   11.716  115.817   20.034  107.553   14.443   73.286   6.6279   71.329   4.9092 1.956284 8.247951 
1 1 1   20   20   26 o   61.715   4.6212   82.472   10.605   82.044   19.735   82.646   12.575   60.967   7.8482   62.462   4.8812 -1.494514 9.242363 
1 1 1   20   20   27 o   67.199   3.5921   95.712   9.9386  101.528   14.584   90.669   13.580   69.083   5.1183   65.314   5.0413 3.769119 7.184114 
1 1 1   20   20   28 o   25.657   5.8788   13.757   8.0789   1.6619   12.139   23.375   10.824   19.646   8.4099   31.668   8.2167 -12.02164 11.75759 
1 1 1   20   20   29 o  112.960   2.8957  269.862   13.469  267.132   19.550  272.330   18.584  112.330   4.2197  113.590   3.9667 -1.258987 5.791422 
1 1 1   20   20   30 o   28.526   5.7533   18.876   8.6922  -0.4201   13.533   32.427   11.341   19.625   8.6341   37.427   7.6061 -17.80217 11.50655 
1 1 1   20   20   31 o   56.054   4.1806   69.132   9.6009   66.937   14.263   70.951   12.982   55.018   6.2857   57.089   5.5135 -2.071342 8.361120 
1 1 1   20   20   32 o   46.936   4.9520   50.661   9.2118   43.504   13.404   57.066   12.681   43.011   7.8452   50.861   6.0449 -7.850685 9.903913 
1 1 1   20   20   33 o   29.415   6.6802   21.128   9.1986   17.493   12.334   25.683   13.807   26.997   9.2229   31.834   9.6664 -4.837690 13.36045 
1 1 1   20   20   34 o   24.897   6.8637   12.989   11.003   20.189   13.024  -4.9632   20.565   28.279   9.4781   21.516   9.9303 6.763401 13.72748 
1 1 1   20   20   35 o   21.755   6.7850   3.8192   10.958   4.6274   12.833   1.6431   21.058   20.411   8.6897   23.100   10.423 -2.689169 13.57009 
1 1 1   20   20   36 f   30.507   8.7960   20.098   16.891   50.398   29.783   5.7328   20.508   37.479   14.132   23.535   10.477 13.94422 17.59203 
1 1 1   20   20   37 o   19.895   6.2095  -3.1891   11.772   12.620   13.995 -41.4330   21.767   23.698   9.4709   16.092   8.0333 7.605598 12.41905 
1 1 1   20   21    0 o  159.923   2.5912  529.472   24.142  529.472   24.142  529.472   24.142  159.923   3.6645  159.923   3.6645 0.000000 0.000000 
1 1 1   20   21    1 o   64.653   3.2180   82.508   8.0969   99.840   14.548   74.731   9.7458   69.269   5.0922   60.037   3.9358 9.232006 6.435952 
1 1 1   20   21    2 f  132.529   3.0020  363.361   16.409   0.0000   0.0000  363.361   16.409  ?   ?   132.529   3.0020      ?      ? 
1 1 1   20   21    3 o  165.101   2.3089  565.700   15.569  553.874   23.600  574.812   20.716  163.522   3.4992  166.679   3.0134 -3.157272 4.617900 
1 1 1   20   21    4 o   32.882   4.2440   23.132   5.5984   21.165   8.1671   24.876   7.6892   31.221   6.5514   34.544   5.3969 -3.322670 8.488068 
1 1 1   20   21    5 o   66.576   2.9882   94.540   7.7528   83.924   12.918  100.516   9.6923   63.492   4.9332   69.660   3.3735 -6.168217 5.976307 
1 1 1   20   21    6 o  103.836   2.4371  224.957   10.116  217.021   16.316  229.913   12.893  102.274   3.8680  105.399   2.9659 -3.125458 4.874186 
1 1 1   20   21    7 o   61.535   3.0983   79.772   7.5647   74.674   12.314   82.862   9.5871   59.862   4.9875   63.208   3.6775 -3.346565 6.196660 
1 1 1   20   21    8 o   58.171   3.1798   70.290   7.3039   70.770   12.260   70.026   9.0939   58.252   5.1028   58.090   3.7956 0.1616516 6.359630 
1 1 1   20   21    9 o  151.197   2.3616  477.962   14.524  445.503   22.018  502.961   19.323  146.541   3.6430  155.852   3.0061 -9.311798 4.723121 
1 1 1   20   21   10 o  191.662   2.4237  763.625   18.945  749.195   28.892  774.508   25.093  189.986   3.6872  193.338   3.1467 -3.352768 4.847401 
1 1 1   20   21   11 o  193.849   2.6916  781.349   19.693  778.896   35.985  782.399   23.529  193.344   4.5126  194.355   2.9353 -1.010956 5.383229 
1 1 1   20   21   12 o  186.564   2.8023  720.339   20.706  736.823   34.653  711.186   25.823  188.000   4.4691  185.128   3.3819 2.872406 5.604503 
1 1 1   20   21   13 o   71.598   3.5482  106.795   10.367  110.403   15.969  104.166   13.630   72.571   5.3350   70.624   4.6794 1.947197 7.096388 
1 1 1   20   21   14 o   43.865   4.7097   39.935   8.3565   44.731   13.458   36.925   10.661   45.888   7.1110   41.842   6.1773 4.045387 9.419423 
1 1 1   20   21   15 o   83.359   2.9241  145.220   9.9837  140.361   14.878  149.200   13.465   82.032   4.3975   84.686   3.8551 -2.654716 5.848118 
1 1 1   20   21   16 o   58.504   3.5354   72.340   8.3779   68.117   12.916   75.408   11.008   56.920   5.5017   60.089   4.4415 -3.169437 7.070815 
1 1 1   20   21   17 o   77.473   2.7317  121.072   8.4126  140.386   14.306  110.863   10.401   81.955   4.2324   72.992   3.4548 8.962601 5.463436 
1 1 1   20   21   18 o  126.811   3.8078  360.292   16.682  299.712   33.118  380.888   19.311  118.372   6.7834  135.250   3.4617 -16.87782 7.615613 
1 1 1   20   21   19 o   91.580   3.4422  179.311   12.029  168.255   21.175  184.579   14.616   89.106   5.7617   94.054   3.7678 -4.947731 6.884317 
1 1 1   20   21   20 o   87.334   2.9812  160.251   10.695  145.962   15.274  173.997   14.980   83.430   4.4387   91.239   3.9808 -7.808708 5.962305 
1 1 1   20   21   21 o   74.615   3.5513  116.159   10.815  109.969   14.156  124.837   16.762   72.334   4.7448   76.895   5.2853 -4.561035 7.102689 
1 1 1   20   21   22 o   39.283   5.7502   34.529   8.9900   30.242   12.129   39.756   13.392   36.498   8.2511   42.068   8.0112 -5.570339 11.50042 
1 1 1   20   21   23 o   25.742   6.0612   14.223   7.4895   14.902   11.350   13.699   9.9673   26.304   8.8480   25.179   8.2865 1.124378 12.12239 
1 1 1   20   21   24 o   61.681   3.7226   81.846   9.3218   67.789   13.473   94.756   12.911   56.343   5.7975   67.018   4.6710 -10.67453 7.445124 
1 1 1   20   21   25 o   59.408   5.3982   87.182   11.091   55.610   18.785  104.077   13.742   48.690   9.6948   70.126   4.7511 -21.43528 10.79640 
1 1 1   20   21   26 o   19.734   6.2077 -11.4054   10.887   8.8510   16.618 -26.6377   14.411   25.106   10.218   14.362   7.0528 10.74394 12.41536 
1 1 1   20   21   27 o   31.675   6.1026   23.271   8.1447   26.651   12.404   20.710   10.799   33.568   8.8378   29.782   8.4177 3.786030 12.20513 
1 1 1   20   21   28 o   87.358   3.4790  164.736   12.115  156.136   19.516  170.127   15.454   85.057   5.5632   89.658   4.1790 -4.601791 6.958010 
1 1 1   20   21   29 o   27.348   6.2801   16.789   8.2152   22.716   12.323   12.048   11.021   30.750   9.0860   23.947   8.6719 6.803400 12.56013 
1 1 1   20   21   30 o   22.946   6.0894   10.116   8.3334   0.9361   13.419   15.879   10.632   19.837   8.6656   26.055   8.5575 -6.218590 12.17876 
1 1 1   20   21   31 o   22.795   6.1634   10.195   8.1238   8.0114   12.147   11.961   10.927   21.984   8.8101   23.606   8.6216 -1.622513 12.32680 
1 1 1   20   21   32 o   46.393   4.8021   48.296   9.1600   51.850   13.627   45.366   12.372   47.877   6.9011   44.909   6.6794 2.967747 9.604113 
1 1 1   20   21   33 o   30.195   6.4017   22.187   8.7560   30.945   13.374   15.617   11.584   34.848   9.1777   25.541   8.9274 9.307621 12.80345 
1 1 1   20   21   34 o   38.230   8.7089   43.185   13.206   43.702   13.813   37.689   45.008   42.248   8.2232   34.212   15.354 8.036865 17.41778 
1 1 1   20   21   35 o   31.286   6.8930   26.756   12.473   44.216   15.836  -1.7790   20.245   40.932   9.5542   21.641   9.9384 19.29102 13.78609 
1 1 1   20   21   36 o   24.554   7.9836   2.9978   17.547   16.834   29.762  -4.3738   21.724   27.721   12.460   21.386   9.9845 6.335207 15.96718 
1 1 1   20   22    0 o  138.724   2.5067  398.723   20.253  398.723   20.253  398.723   20.253  138.724   3.5451  138.724   3.5451 0.000000 0.000000 
1 1 1   20   22    1 f  160.589   2.6252  535.822   16.402  532.625   28.317  537.437   20.122  160.067   4.2892  161.111   3.0282 -1.044525 5.250431 
1 1 1   20   22    2 o   21.945   5.5293   8.6630   6.0711   9.7591   10.356   8.0892   7.4937   23.263   8.4090   20.627   7.1820 2.636414 11.05858 
1 1 1   20   22    3 o   92.719   2.4484  179.149   9.2548  171.740   14.039  184.843   12.308   90.974   3.7415   94.465   3.1590 -3.490692 4.896710 
1 1 1   20   22    4 o   55.514   3.3768   68.155   7.1997   51.160   11.644   78.674   9.1607   49.444   5.7099   61.584   3.6066 -12.14058 6.753520 
1 1 1   20   22    5 o  125.538   2.3107  326.461   11.689  327.373   18.643  325.870   15.005  125.616   3.5984  125.460   2.8998 0.1565704 4.621414 
1 1 1   20   22    6 o   98.335   2.4710  201.453   9.8201  196.118   15.407  205.102   12.744   97.174   3.8443   99.497   3.1055 -2.323120 4.941930 
1 1 1   20   22    7 o   85.383   2.5955  148.561   8.9585  165.084   14.448  138.239   11.419   89.127   3.9302   81.640   3.3912 7.487869 5.191006 
1 1 1   20   22    8 o  108.694   2.5519  245.906   11.398  237.185   16.673  253.557   15.617  106.844   3.7836  110.545   3.4254 -3.700439 5.103772 
1 1 1   20   22    9 o   45.723   4.0605   40.512   7.0233   52.619   13.482   36.002   8.2279   49.926   6.5471   41.519   4.8048 8.407177 8.120963 
1 1 1   20   22   10 f   74.586   2.7120  112.141   8.0408  128.851   13.655  103.270   9.9487   78.644   4.2097   70.527   3.4201 8.116570 5.423909 
1 1 1   20   22   11 o   94.154   2.5638  187.193   9.5800  172.733   15.519  196.096   12.177   91.060   4.1322   97.248   3.0359 -6.187889 5.127582 
1 1 1   20   22   12 o  111.372   2.6821  252.879   11.264  270.577   20.967  245.699   13.354  113.875   4.4642  108.868   2.9741 5.007545 5.364210 
1 1 1   20   22   13 o   89.290   3.1992  167.689   11.612  158.246   17.705  174.816   15.383   86.964   4.9363   91.616   4.0711 -4.651505 6.398456 
1 1 1   20   22   14 o   94.475   3.0303  188.794   11.418  175.900   18.322  196.980   14.600   91.643   4.8474   97.306   3.6378 -5.663589 6.060552 
1 1 1   20   22   15 o  168.902   2.8242  597.409   18.968  587.965   31.139  602.981   23.917  167.560   4.5057  170.244   3.4062 -2.683319 5.648303 
1 1 1   20   22   16 o   63.708   4.5928   88.683   11.725   74.181   17.826   99.739   15.566   58.704   7.3625   68.712   5.4924 -10.00830 9.185516 
1 1 1   20   22   17 o   58.236   3.6735   73.022   8.6179   61.607   12.962   82.064   11.537   53.905   5.8302   62.568   4.4707 -8.662525 7.347021 
1 1 1   20   22   18 o   38.086   5.5251   32.456   8.1871   30.454   13.681   33.573   10.219   36.476   9.1186   39.695   6.2416 -3.218941 11.05014 
1 1 1   20   22   19 o   49.120   3.9646   50.775   7.9993   54.544   11.992   47.754   10.737   50.723   5.7321   47.517   5.4787 3.206078 7.929269 
1 1 1   20   22   20 o   88.654   2.9314  164.659   10.707  156.312   15.156  172.975   15.129   86.374   4.2545   90.934   4.0338 -4.559418 5.862767 
1 1 1   20   22   21 o   84.933   2.9661  151.761   10.358  145.472   15.053  157.416   14.274   83.189   4.3874   86.678   3.9928 -3.488991 5.932279 
1 1 1   20   22   22 o   54.651   4.3559   65.561   9.5523   74.891   12.809   53.872   14.338   59.429   5.2258   49.873   6.9703 9.555580 8.711724 
1 1 1   20   22   23 o   45.195   4.4386   44.167   8.2135   41.515   12.122   46.418   11.167   43.801   6.7103   46.589   5.8117 -2.788601 8.877164 
1 1 1   20   22   24 f   65.124   3.6192   90.452   9.6725   80.387   13.684  100.502   13.674   61.379   5.4054   68.869   4.8141 -7.490501 7.238307 
1 1 1   20   22   25 o   28.753   5.9139   19.561   7.8373   11.050   12.288   25.397   10.176   24.175   9.0847   33.331   7.5739 -9.156609 11.82780 
1 1 1   20   22   26 o   40.807   7.0436   38.634   12.119   59.467   18.772   23.747   15.868   50.066   9.4369   31.548   10.459 18.51745 14.08712 
1 1 1   20   22   27 o   20.048   5.5147   3.2266   7.6981 -11.1624   11.842   13.758   10.131   15.240   7.1951   24.856   8.3592 -9.615951 11.02932 
1 1 1   20   22   28 o   27.386   6.1732   16.044   8.0879   25.730   12.616   9.2848   10.539   32.626   9.0552   22.147   8.3927 10.47894 12.34641 
1 1 1   20   22   29 o   78.510   3.3665  132.364   10.884  134.570   15.895  130.416   14.935   79.048   4.8752   77.972   4.6440 1.076340 6.733083 
1 1 1   20   22   30 o   40.080   5.8079   41.122   9.3133   23.786   14.384   53.635   12.221   30.833   9.9422   49.327   6.0068 -18.49446 11.61587 
1 1 1   20   22   31 o   66.388   3.9611   98.904   10.543   82.777   15.941  111.443   14.056   60.898   6.3467   71.879   4.7414 -10.98104 7.922194 
1 1 1   20   22   32 o   46.135   4.9388   48.654   9.3740   53.577   13.682   44.300   12.869   48.414   6.8520   43.856   7.1145 4.557812 9.877528 
1 1 1   20   22   33 o   22.734   6.7334   8.3116   10.396   10.944   12.507   2.4277   18.697   23.075   9.0372   22.393   9.9841 0.6811485 13.46676 
1 1 1   20   22   34 f   38.474   7.7730   50.752   13.969   55.418   14.609   0.9827   47.710   48.456   7.3097   28.493   13.720 19.96302 15.54600 
1 1 1   20   22   35 o   18.700   5.9602 -10.1015   11.675   10.664   14.439 -49.3092   19.840   23.010   9.4622   14.390   7.2500 8.619496 11.92038 
1 1 1   20   23    0 o  143.323   2.4795  425.754   20.700  425.754   20.700  425.754   20.700  143.323   3.5065  143.323   3.5065 0.000000 0.000000 
1 1 1   20   23    1 o  150.589   2.7706  473.961   16.912  457.431   26.223  485.733   22.129  148.208   4.2899  152.971   3.5074 -4.763016 5.541202 
1 1 1   20   23    2 o   88.659   2.4775  163.307   9.0105  161.841   13.426  164.507   12.154   88.266   3.6881   89.053   3.3090 -0.7873154 4.954961 
1 1 1   20   23    3 o  123.401   2.8006  314.857   13.730  323.651   22.841  309.881   17.181  124.606   4.4444  122.195   3.4089 2.410461 5.601208 
1 1 1   20   23    4 o   42.160   5.0825   45.277   7.1990   25.186   13.342   53.528   8.5505   33.609   9.3067   50.711   4.0881 -17.10281 10.16495 
1 1 1   20   23    5 o  103.674   2.7621  222.268   10.728  226.742   19.965  220.452   12.721  104.217   4.6446  103.130   2.9907 1.087868 5.524212 
1 1 1   20   23    6 o   31.734   4.7160   18.142   6.1848   38.890   10.788   7.9834   7.5486   42.965   6.0878   20.504   7.2043 22.46105 9.432022 
1 1 1   20   23    7 o   84.468   2.6116  147.261   8.8633  152.992   14.368  143.740   11.261   85.714   4.0643   83.223   3.2808 2.491470 5.223231 
1 1 1   20   23    8 o   76.960   2.7073  122.752   8.2849  124.924   13.720  121.506   10.394   77.407   4.2976   76.513   3.2936 0.8945160 5.414505 
1 1 1   20   23    9 o   18.766   5.2398   3.6982   5.5981   7.4782   10.182   2.0603   6.7021   21.701   8.2432   15.831   6.4709 5.870195 10.47961 
1 1 1   20   23   10 o   78.083   2.7251  128.336   8.4071  121.497   13.863  132.314   10.573   76.313   4.4045   79.853   3.2103 -3.540741 5.450278 
1 1 1   20   23   11 o  123.570   2.7475  315.093   12.563  324.509   23.915  311.503   14.765  124.574   4.6545  122.566   2.9207 2.008133 5.494996 
1 1 1   20   23   12 o  110.926   3.1107  259.682   13.880  245.868   21.883  268.981   17.954  108.249   4.9013  113.602   3.8318 -5.353470 6.221351 
1 1 1   20   23   13 o   74.444   3.4223  118.888   10.034  107.313   16.406  125.805   12.683   71.263   5.5818   77.624   3.9614 -6.361664 6.844682 
1 1 1   20   23   14 o   88.437   3.0512  162.033   10.763  170.361   17.818  157.247   13.506   90.053   4.7973   86.822   3.7717 3.230621 6.102427 
1 1 1   20   23   15 o  128.353   3.1093  345.583   16.439  335.053   23.619  355.477   22.894  126.392   4.5308  130.314   4.2596 -3.922157 6.218689 
1 1 1   20   23   16 f   26.735   5.5087   16.232   7.6649  -1.4139   12.971   25.699   9.5012   19.441   8.5053   34.030   7.0029 -14.58994 11.01730 
1 1 1   20   23   17 o  109.444   3.0869  256.147   13.353  231.527   21.676  271.204   16.952  104.840   5.0130  114.048   3.6038 -9.208191 6.173898 
1 1 1   20   23   18 o   24.803   5.8420   12.827   6.9123   13.973   10.813   12.035   8.9889   25.728   8.6360   23.878   7.8698 1.849262 11.68390 
1 1 1   20   23   19 o   60.612   3.5389   77.972   8.7879   73.853   12.982   81.456   11.940   59.030   5.3320   62.194   4.6546 -3.163982 7.077797 
1 1 1   20   23   20 o   52.462   3.8934   58.409   8.3773   59.778   12.585   57.320   11.226   52.936   5.7640   51.988   5.2355 0.9480095 7.786819 
1 1 1   20   23   21 o   61.003   3.6305   80.162   8.9746   67.376   13.183   91.205   12.252   56.207   5.6868   65.799   4.5146 -9.591534 7.260961 
1 1 1   20   23   22 o   29.372   6.1408   19.962   8.2209   25.157   11.103   13.659   12.231   33.057   8.1864   25.687   9.1554 7.369358 12.28165 
1 1 1   20   23   23 o   57.690   4.2472   72.564   9.9288   78.558   13.264   64.924   14.974   60.703   5.2979   54.677   6.6399 6.026276 8.494442 
1 1 1   20   23   24 o   22.668   5.8612   9.6743   7.5011   3.1142   11.538   14.476   9.8718   19.872   8.3386   25.464   8.2391 -5.591845 11.72244 
1 1 1   20   23   25 o   55.010   4.7584   67.072   10.538   69.428   13.687   63.643   16.514   56.618   5.8614   53.401   7.4976 3.216553 9.516823 
1 1 1   20   23   26 o   26.741   6.8346   14.855   8.8512   17.710   17.249   13.835   10.312   28.560   10.758   24.921   8.4335 3.639561 13.66927 
1 1 1   20   23   27 o   29.427   6.0031   21.828   8.4985   7.9792   14.135   29.669   10.636   23.093   9.4135   35.762   7.4524 -12.66961 12.00628 
1 1 1   20   23   28 o   32.157   6.0964   25.534   8.4068   19.841   12.404   30.371   11.433   28.587   9.2341   35.728   7.9622 -7.141544 12.19288 
1 1 1   20   23   29 o   36.209   5.6764   31.851   8.4571   23.353   12.589   38.841   11.417   30.746   9.2064   41.671   6.6429 -10.92435 11.35283 
1 1 1   20   23   30 o  101.456   2.9700  220.894   12.368  199.699   17.667  241.268   17.321   96.453   4.4409  106.460   3.9449 -10.00658 5.940034 
1 1 1   20   23   31 o   34.648   5.8344   32.107   9.0737   14.056   14.402   43.989   11.684   25.179   9.7429   44.116   6.4216 -18.93674 11.66880 
1 1 1   20   23   32 o   23.819   6.3150   12.680   8.4565   10.162   12.298   14.937   11.647   22.618   8.9293   25.019   8.9323 -2.400709 12.63006 
1 1 1   20   23   33 o   26.369   7.2609   16.940   10.921   17.205   13.097   16.334   19.785   26.128   9.4547   26.609   11.022 -0.4812069 14.52175 
1 1 1   20   23   34 o   23.218   7.6161   5.5389   12.354   8.0942   12.797 -29.4817   47.375   21.401   8.8647   25.035   12.387 -3.633940 15.23229 
1 1 1   20   24    0 o   35.557   7.9250   33.539   14.443   33.539   14.443   33.539   14.443   35.557   11.208   35.557   11.208 0.000000 0.000000 
1 1 1   20   24    1 o  144.364   3.0391  434.509   18.095  438.644   25.580  430.367   25.600  145.060   4.2755  143.669   4.3202 1.391235 6.078197 
1 1 1   20   24    2 o   54.547   3.8584   60.508   8.3108   69.092   14.319   56.147   10.206   57.263   6.0629   51.831   4.7740 5.432114 7.716846 
1 1 1   20   24    3 o   38.848   4.6882   30.459   6.6267   37.257   12.829   27.986   7.7391   41.142   7.8466   36.555   5.1331 4.586601 9.376477 
1 1 1   20   24    4 o   84.366   2.6147  150.628   8.7787  137.011   14.064  159.319   11.236   81.086   4.2054   87.645   3.1083 -6.558693 5.229431 
1 1 1   20   24    5 o   69.420   2.8802  101.918   7.9023   94.643   12.946  106.238   9.9765   67.309   4.6633   71.531   3.3816 -4.222054 5.760372 
1 1 1   20   24    6 o   86.283   2.6157  156.260   9.0726  148.021   14.338  161.762   11.716   84.281   4.1248   88.286   3.2177 -4.004684 5.231359 
1 1 1   20   24    7 o   78.315   3.0435  130.683   8.9684  121.246   16.151  134.890   10.784   76.028   5.1508   80.603   3.2437 -4.574898 6.087073 
1 1 1   20   24    8 o   26.743   5.4245   16.207   6.7761   6.9766   10.731   22.329   8.7389   21.673   8.4033   31.812   6.8620 -10.13870 10.84908 
1 1 1   20   24    9 o   54.345   3.5047   66.766   7.1482   48.610   11.926   76.945   8.9299   47.896   6.0373   60.793   3.5615 -12.89675 7.009469 
1 1 1   20   24   10 f   42.877   4.5074   45.511   6.6757   25.602   11.190   56.511   8.3179   33.718   8.1393   52.037   3.8756 -18.31914 9.014874 
1 1 1   20   24   11 o  119.216   2.4667  296.709   11.948  291.648   18.477  300.346   15.663  118.235   3.7890  120.197   3.1596 -1.961060 4.933461 
1 1 1   20   24   12 o   40.974   4.1101   34.492   6.5839   39.040   11.569   32.314   8.0071   42.758   6.5599   39.190   4.9537 3.567913 8.220225 
1 1 1   20   24   13 o   85.294   2.6983  154.219   9.0651  143.538   14.970  160.403   11.391   82.760   4.3858   87.828   3.1446 -5.068558 5.396611 
1 1 1   20   24   14 o   41.804   4.6805   38.387   7.6618   35.334   11.963   40.509   9.9763   39.856   7.5542   43.752   5.5284 -3.896725 9.361019 
1 1 1   20   24   15 o  174.239   3.7425  652.008   26.135  696.545   33.967  587.388   40.915  182.207   4.5199  166.271   5.9662 15.93593 7.485021 
1 1 1   20   24   16 o   22.484   6.0065   8.3101   7.2181   10.322   12.765   7.3646   8.7515   24.372   9.2366   20.597   7.6811 3.775240 12.01304 
1 1 1   20   24   17 o   41.391   5.9903   37.845   8.6434   39.612   17.867   37.305   9.8759   40.914   10.527   41.868   5.7192 -0.9537964 11.98050 
1 1 1   20   24   18 o   59.430   3.5140   74.350   8.5696   78.066   12.898   71.413   11.466   60.697   5.1522   58.162   4.7799 2.535439 7.027969 
1 1 1   20   24   19 o   34.146   5.2991   27.431   7.4944   16.048   11.280   36.427   10.028   27.006   8.8117   41.287   5.8888 -14.28084 10.59826 
1 1 1   20   24   20 o  162.952   2.6898  555.951   18.059  521.360   25.136  592.851   25.961  157.676   3.8652  168.227   3.7417 -10.55118 5.379566 
1 1 1   20   24   21 o   37.158   5.1030   30.979   7.5562   29.117   11.580   32.359   9.9717   35.595   8.0733   38.722   6.2439 -3.126362 10.20606 
1 1 1   20   24   22 o   93.787   2.9505  185.410   11.381  167.855   15.942  203.654   16.252   89.179   4.3342   98.395   4.0046 -9.215630 5.901039 
1 1 1   20   24   23 o   22.978   6.1622   7.1321   8.5421  -1.1037   11.379   17.765   12.929   18.005   7.9194   27.952   9.4433 -9.946947 12.32446 
1 1 1   20   24   24 o   58.264   3.8382   73.520   9.1579   68.238   13.435   78.104   12.516   56.120   5.8044   60.407   5.0236 -4.286633 7.676388 
1 1 1   20   24   25 o   41.013   6.0316   39.987   9.7773   42.440   12.498   36.118   15.697   43.732   6.9291   38.294   9.8748 5.437603 12.06328 
1 1 1   20   24   26 o   42.212   6.0894   52.936   9.9113   18.288   18.467   66.956   11.747   28.711   11.054   55.712   5.1121 -27.00077 12.17879 
1 1 1   20   24   27 o   27.604   6.1635   18.517   7.9815   14.392   12.322   21.498   10.476   25.342   9.1706   29.867   8.2374 -4.525118 12.32697 
1 1 1   20   24   28 o   77.943   3.3956  131.186   10.887  123.824   15.636  138.113   15.168   75.667   5.0103   80.218   4.5844 -4.550652 6.791110 
1 1 1   20   24   29 o   91.579   3.0576  179.218   11.515  187.668   17.087  172.189   15.585   93.460   4.4329   89.697   4.2127 3.762657 6.115291 
1 1 1   20   24   30 o   30.874   6.0905   24.625   8.3028   17.678   12.853   29.599   10.877   26.780   9.4013   34.968   7.7456 -8.188314 12.18108 
1 1 1   20   24   31 o   16.681   5.2694  -4.6906   8.1261 -18.6054   12.631   5.1347   10.614   13.910   6.7822   19.452   8.0666 -5.541306 10.53889 
1 1 1   20   24   32 o   57.604   4.2943   75.702   10.131   71.087   14.880   79.689   13.831   55.583   6.4909   59.626   5.6242 -4.043041 8.588532 
1 1 1   20   24   33 o   30.468   7.5700   24.714   11.092   20.430   13.333   34.340   19.987   27.615   9.5820   33.320   11.722 -5.705412 15.14002 
1 1 1   20   25    0 f   19.394   6.5335   11.700   8.4496   11.700   8.4496   11.700   8.4496   19.394   9.2398   19.394   9.2398 0.000000 0.000000 
1 1 1   20   25    1 o   24.875   5.3933   14.051   6.8834  -1.4297   12.759   20.406   8.1753   19.354   8.4524   30.396   6.7015 -11.04104 10.78670 
1 1 1   20   25    2 o   33.610   5.9712   27.648   7.9034   16.018   16.178   31.293   9.0578   28.732   10.491   38.487   5.7061 -9.755423 11.94238 
1 1 1   20   25    3 o   78.696   2.8202  128.064   9.0953  139.781   13.848  119.175   12.062   81.804   4.1043   75.588   3.8689 6.216309 5.640387 
1 1 1   20   25    4 f   73.029   2.7266  106.251   7.9534  131.718   13.449   92.555   9.8628   79.398   4.1070   66.659   3.5874 12.73909 5.453111 
1 1 1   20   25    5 o  108.559   2.3821  245.550   10.378  243.842   16.692  246.626   13.250  108.136   3.7427  108.981   2.9478 -0.8447037 4.764158 
1 1 1   20   25    6 o   19.323   5.2636   5.7824   5.7213   3.9128   10.080   6.6710   6.9491   19.565   7.9595   19.082   6.8896 0.4838409 10.52712 
1 1 1   20   25    7 o   59.133   3.2606   73.910   7.8459   69.502   11.901   77.299   10.435   57.468   5.0209   60.797   4.1613 -3.329163 6.521215 
1 1 1   20   25    8 o   35.038   4.8494   26.847   6.6249   28.325   10.614   25.903   8.4792   35.653   7.4579   34.422   6.2005 1.231552 9.698799 
1 1 1   20   25    9 o   58.881   3.1894   73.996   7.2895   68.705   12.393   76.796   9.0138   57.064   5.2655   60.697   3.6006 -3.632874 6.378839 
1 1 1   20   25   10 o   52.427   3.3014   57.580   6.8064   58.231   11.529   57.231   8.4328   52.511   5.3233   52.343   3.9062 0.1685905 6.602701 
1 1 1   20   25   11 o   21.600   5.2913   9.4944   5.9024   2.4809   10.774   12.502   7.0554   19.361   8.0861   23.840   6.8270 -4.479313 10.58264 
1 1 1   20   25   12 o   99.163   2.5391  208.867   10.002  189.432   16.072  221.153   12.779   95.165   4.0948  103.161   3.0033 -7.995972 5.078129 
1 1 1   20   25   13 o   79.190   2.8024  132.011   8.7243  127.861   14.630  134.301   10.868   78.051   4.5446   80.329   3.2803 -2.277931 5.604812 
1 1 1   20   25   14 o   59.040   3.4515   72.649   8.3458   80.276   12.757   66.943   11.034   61.684   5.0145   56.396   4.7440 5.288479 6.902913 
1 1 1   20   25   15 o   25.469   6.2834   13.376   8.1000   12.334   11.065   14.580   11.890   24.660   8.7167   26.277   9.0523 -1.617651 12.56684 
1 1 1   20   25   16 o   64.081   4.5343   89.706   10.170   85.377   20.505   91.118   11.712   62.322   7.9773   65.840   4.3129 -3.518429 9.068539 
1 1 1   20   25   17 o   27.329   5.2233   17.508   7.5599  -3.8928   12.682   29.304   9.4157   18.244   8.1718   36.414   6.5081 -18.17060 10.44669 
1 1 1   20   25   18 o   33.681   5.5011   26.073   7.4380   24.226   11.410   27.438   9.8084   32.398   8.4508   34.964   7.0450 -2.565773 11.00222 
1 1 1   20   25   19 o   89.271   2.9690  168.043   10.833  140.230   15.076  197.730   15.576   81.492   4.4854   97.049   3.8912 -15.55696 5.938065 
1 1 1   20   25   20 o   52.200   3.8954   58.198   8.3385   59.164   12.516   57.427   11.181   52.494   5.7808   51.906   5.2229 0.5873642 7.790823 
1 1 1   20   25   21 o   20.529   5.6520   6.6526   7.0043   2.8329   10.780   9.4429   9.2140   19.201   8.0588   21.858   7.9269 -2.656116 11.30402 
1 1 1   20   25   22 o   57.528   3.6959   70.609   8.7286   74.962   13.121   67.153   11.691   59.040   5.3881   56.016   5.0602 3.024071 7.391745 
1 1 1   20   25   23 o   42.951   5.4939   40.470   9.3746   32.445   12.001   53.032   15.015   37.258   8.0452   48.644   7.4839 -11.38594 10.98788 
1 1 1   20   25   24 o   75.463   3.7293  121.572   11.514  113.233   15.168  132.910   17.686   72.570   5.0676   78.357   5.4726 -5.787193 7.458547 
1 1 1   20   25   25 o   66.516   3.5329   95.252   9.6586   98.345   14.354   92.692   13.057   67.400   5.1634   65.633   4.8234 1.767258 7.065862 
1 1 1   20   25   26 o   78.902   5.0560  148.380   12.943  126.373   27.592  154.590   14.656   72.626   9.2113   85.179   4.1718 -12.55309 10.11193 
1 1 1   20   25   27 o   41.807   6.4358   44.837   9.8893   37.384   19.040   47.590   11.573   37.236   11.361   46.377   6.0502 -9.141186 12.87163 
1 1 1   20   25   28 o   66.444   3.6953   96.893   10.017   93.742   15.150   99.339   13.352   65.172   5.6361   67.716   4.7807 -2.543465 7.390586 
1 1 1   20   25   29 o   38.244   5.7175   34.697   8.6380   43.002   13.643   29.141   11.160   41.988   8.1723   34.500   7.9984 7.488079 11.43509 
1 1 1   20   25   30 o   62.271   4.0602   88.987   10.067   70.673   15.102  103.634   13.505   55.582   6.5875   68.959   4.7483 -13.37665 8.120422 
1 1 1   20   25   31 o   35.731   6.3089   33.286   9.2156   32.467   14.147   33.889   12.146   34.760   9.5664   36.701   8.2275 -1.940903 12.61775 
1 1 1   20   25   32 o   46.414   6.6761   53.446   12.377   39.491   15.584   77.286   20.369   37.885   9.8734   54.943   8.9888 -17.05839 13.35222 
1 1 1   20   26    0 o   55.775   4.7081   67.943   14.740   67.943   14.740   67.943   14.740   55.775   6.6582   55.775   6.6582 0.000000 0.000000 
1 1 1   20   26    1 o   56.920   3.6573   68.754   8.2395   66.612   13.601   69.995   10.356   56.032   5.8854   57.808   4.3435 -1.775414 7.314638 
1 1 1   20   26    2 o   47.590   5.2979   49.426   10.003   61.014   14.587   39.138   13.744   53.425   6.6200   41.755   8.2733 11.66970 10.59578 
1 1 1   20   26    3 o   44.262   5.3442   50.228   8.1741   27.448   14.428   60.996   9.9197   34.586   9.7140   53.938   4.4590 -19.35159 10.68849 
1 1 1   20   26    4 o   46.261   3.8453   47.719   6.8536   36.726   11.084   54.523   8.7205   41.472   6.4800   51.051   4.1417 -9.578976 7.690527 
1 1 1   20   26    5 o  171.908   2.5001  616.768   17.701  589.142   25.298  643.265   24.775  168.072   3.6495  175.744   3.4180 -7.671509 5.000137 
1 1 1   20   26    6 o   70.796   2.8316  106.529   7.9470   97.963   12.885  111.787   10.096   68.315   4.5730   73.277   3.3406 -4.961868 5.663156 
1 1 1   20   26    7 o   79.316   2.6604  129.390   8.3380  137.964   14.157  124.836   10.317   81.174   4.2286   77.459   3.2294 3.714989 5.320722 
1 1 1   20   26    8 o   26.248   5.3402   14.778   5.8070   16.761   10.232   13.836   7.0528   27.504   8.3147   24.993   6.7036 2.510185 10.68042 
1 1 1   20   26    9 o   57.045   3.1363   64.154   7.0702   82.941   12.349   54.992   8.6233   62.813   4.7667   51.278   4.0774 11.53565 6.272667 
1 1 1   20   26   10 o   79.325   2.8458  136.219   8.9418  110.616   13.900  154.293   11.679   72.558   4.6449   86.092   3.2891 -13.53363 5.691505 
1 1 1   20   26   11 o   91.942   2.6557  177.279   9.8324  173.435   15.602  179.811   12.663   90.978   4.1580   92.906   3.3048 -1.928368 5.311368 
1 1 1   20   26   12 f  118.524   2.4806  294.677   11.837  286.547   18.765  300.050   15.255  116.995   3.8888  120.054   3.0808 -3.058624 4.961255 
1 1 1   20   26   13 o   79.927   2.8188  133.171   8.9048  136.513   14.971  131.341   11.078   80.518   4.5080   79.336   3.3854 1.182426 5.637632 
1 1 1   20   26   14 o   20.730   5.7330   3.8443   7.8922   13.041   10.834  -6.5553   11.521   24.991   8.6391   16.469   7.5390 8.521507 11.46609 
1 1 1   20   26   15 o   53.775   4.4385   61.603   9.7987   56.102   13.122   68.537   14.732   51.104   6.2257   56.447   6.3278 -5.343216 8.877001 
1 1 1   20   26   16 o   19.217   5.8987  -0.9318   8.6664   4.0171   13.233  -4.6486   11.468   21.459   8.9619   16.975   7.6723 4.484583 11.79744 
1 1 1   20   26   17 o   96.707   3.1218  199.316   12.236  185.253   18.736  209.774   16.156   93.470   4.8601   99.944   3.9194 -6.474396 6.243567 
1 1 1   20   26   18 o   33.704   5.3410   28.411   7.9903   8.8448   12.470   42.041   10.408   23.137   9.0342   44.271   5.6999 -21.13450 10.68202 
1 1 1   20   26   19 o   52.447   3.8522   59.435   8.2264   55.859   12.428   62.224   10.975   50.847   5.9260   54.048   4.9233 -3.201523 7.704317 
1 1 1   20   26   20 o   36.421   5.2635   31.056   7.7154   22.147   11.350   38.709   10.520   30.631   8.6202   42.211   6.0424 -11.58029 10.52703 
1 1 1   20   26   21 o   82.739   3.0249  146.210   10.212  123.141   14.516  168.817   14.370   76.035   4.6288   89.443   3.8953 -13.40765 6.049719 
1 1 1   20   26   22 o   32.572   5.4905   25.795   7.9749   11.760   11.970   36.998   10.694   24.087   8.9831   41.056   6.3155 -16.96872 10.98091 
1 1 1   20   26   23 o   45.583   4.4898   46.233   8.3163   43.922   12.672   47.981   11.022   44.277   6.9390   46.889   5.6993 -2.611572 8.979533 
1 1 1   20   26   24 o   20.871   6.8064  -1.2177   10.607   1.5487   11.428 -18.4284   28.505   18.751   8.0950   22.990   10.944 -4.239479 13.61275 
1 1 1   20   26   25 o   20.597   6.0943   4.5976   8.6685   2.5562   11.750   7.0354   12.841   19.350   8.2785   21.843   8.9459 -2.493027 12.18861 
1 1 1   20   26   26 o   39.921   5.5079   37.502   8.6186   39.982   13.545   35.814   11.172   40.658   8.3564   39.183   7.1775 1.474747 11.01574 
1 1 1   20   26   27 f   44.603   6.3067   49.920   10.222   47.008   19.170   51.077   12.083   41.472   11.019   47.734   6.1375 -6.261719 12.61343 
1 1 1   20   26   28 o   42.336   5.4663   44.326   9.0124   33.281   13.614   52.942   12.024   36.067   9.1404   48.605   5.9981 -12.53790 10.93268 
1 1 1   20   26   29 o   55.464   4.1583   69.147   9.4259   69.250   14.287   69.067   12.543   55.180   6.2775   55.747   5.4553 -0.5670471 8.316673 
1 1 1   20   26   30 o   21.211   6.0730   8.4608   8.2504   6.7504   12.648   9.7275   10.885   20.847   8.7383   21.575   8.4362 -0.7281876 12.14608 
1 1 1   20   26   31 f   33.180   6.4383   29.707   9.0910   27.190   13.985   31.549   11.964   31.332   9.7670   35.027   8.3914 -3.695621 12.87670 
1 1 1   20   27    0 o  114.118   2.4989  270.756   16.597  270.756   16.597  270.756   16.597  114.118   3.5340  114.118   3.5340 0.000000 0.000000 
1 1 1   20   27    1 o   83.141   3.4231  145.725   11.708  151.693   16.216  139.228   16.921   84.994   4.6259   81.288   5.0469 3.705490 6.846138 
1 1 1   20   27    2 o   54.702   4.3520   63.425   9.7792   55.983   13.397   71.913   14.308   51.229   6.3404   58.174   5.9631 -6.944904 8.704004 
1 1 1   20   27    3 o   47.552   3.8231   48.635   7.3382   42.604   11.136   53.264   9.7561   44.758   6.0324   50.347   4.6983 -5.588570 7.646132 
1 1 1   20   27    4 o   57.328   3.0988   67.865   7.0808   72.919   11.796   65.018   8.8532   58.863   4.8588   55.792   3.8473 3.070637 6.197587 
1 1 1   20   27    5 o   39.731   3.9649   31.880   6.2348   39.159   10.795   28.236   7.6374   42.873   6.1049   36.589   5.0609 6.283550 7.929865 
1 1 1   20   27    6 o   17.772   5.0004   3.8987   5.5528  -2.1611   9.9217   6.6624   6.7005   16.665   7.3596   18.880   6.7713 -2.214687 10.00074 
1 1 1   20   27    7 o   47.928   4.0982   54.980   6.8268   35.828   11.688   64.896   8.4104   40.116   7.3346   55.739   3.6584 -15.62321 8.196338 
1 1 1   20   27    8 f   81.364   2.6952  140.849   8.5697  130.832   14.379  146.367   10.672   78.881   4.4196   83.847   3.0861 -4.966316 5.390442 
1 1 1   20   27    9 o   15.171   4.9260  -2.9748   5.6506  -9.4879   13.347  -1.5527   6.2370   17.125   7.9375   13.217   5.8360 3.908201 9.852077 
1 1 1   20   27   10 o   93.835   3.1132  190.186   10.765  173.733   19.952  196.942   12.786   90.457   5.3478   97.214   3.1888 -6.757347 6.226369 
1 1 1   20   27   11 o   32.945   4.9763   27.088   6.3170   15.388   11.129   32.649   7.6727   26.556   8.7570   39.334   4.7295 -12.77810 9.952536 
1 1 1   20   27   12 o  110.476   2.4445  251.700   10.759  267.301   17.907  242.887   13.459  112.955   3.8437  107.997   3.0215 4.958374 4.889094 
1 1 1   20   27   13 f   73.555   2.8130  112.481   8.1471  117.307   13.866  109.936   10.068   74.562   4.5088   72.547   3.3649 2.015610 5.626003 
1 1 1   20   27   14 o  103.166   3.0424  220.803   12.814  201.035   16.728  248.871   19.933   97.743   4.1494  108.589   4.4506 -10.84573 6.084876 
1 1 1   20   27   15 o   72.776   3.9401  124.305   10.493   84.199   17.710  145.999   13.025   62.130   6.9113   83.422   3.7856 -21.29159 7.880196 
1 1 1   20   27   16 o   43.779   4.3050   40.122   7.6482   49.188   12.209   34.266   9.8120   47.686   6.2076   39.872   5.9665 7.814079 8.610099 
1 1 1   20   27   17 o   64.755   3.4751   90.902   9.0727   80.188   13.843   98.970   12.012   61.089   5.4940   68.420   4.2568 -7.330776 6.950131 
1 1 1   20   27   18 o   21.107   5.6311   6.9478   7.4746  -5.0783   12.351   13.897   9.3890   17.359   7.8922   24.854   8.0344 -7.495092 11.26222 
1 1 1   20   27   19 o   27.579   5.7710   18.388   7.3514   10.606   12.039   23.016   9.2834   23.567   8.9606   31.591   7.2750 -8.024807 11.54201 
1 1 1   20   27   20 o   28.627   5.4413   16.256   7.4495   34.168   11.685   3.9905   9.6692   38.411   7.6447   18.843   7.7453 19.56765 10.88259 
1 1 1   20   27   21 o   52.593   4.1401   63.030   8.5381   45.593   12.786   77.063   11.470   45.181   6.8615   60.004   4.6347 -14.82290 8.280125 
1 1 1   20   27   22 o   23.699   6.0358   12.281   7.5551   10.239   11.678   13.751   9.9080   22.899   8.7969   24.498   8.2666 -1.599072 12.07156 
1 1 1   20   27   23 o   37.214   5.4750   34.535   8.1587   22.069   12.625   43.473   10.691   29.938   9.2715   44.491   5.8260 -14.55280 10.95005 
1 1 1   20   27   24 f   37.711   6.6305   34.456   10.093   29.432   12.866   42.494   16.275   34.451   8.9677   40.971   9.7689 -6.519432 13.26094 
1 1 1   20   27   25 o   40.618   6.6729   41.451   11.214   28.266   15.194   57.229   16.620   32.818   10.172   48.418   8.6394 -15.59969 13.34584 
1 1 1   20   27   26 f   83.102   3.3174  150.008   11.358  143.267   16.142  156.618   15.984   81.133   4.8237   85.071   4.5556 -3.937813 6.634876 
1 1 1   20   27   27 o   54.914   5.5263   72.593   11.174   69.404   19.600   74.128   13.600   52.164   9.4584   57.664   5.7183 -5.499954 11.05261 
1 1 1   20   27   28 o   83.063   3.7526  152.846   12.654  151.124   16.493  155.311   19.729   83.017   4.8168   83.108   5.7557 -0.9055328E-01 7.505286 
1 1 1   20   27   29 o   48.104   5.8876   59.095   10.940   65.045   14.241   50.528   17.089   52.953   6.5204   43.255   9.8050 9.697811 11.77512 
1 1 1   20   27   30 o   21.258   6.3400   6.1065   10.142   13.479   12.864  -6.0010   16.485   23.837   9.2123   18.680   8.7131 5.157211 12.68008 
1 1 1   20   28    0 o   16.495   6.8212   7.3196   10.957   7.3196   10.957   7.3196   10.957   16.495   9.6466   16.495   9.6466 0.000000 0.000000 
1 1 1   20   28    1 o   83.893   3.3951  149.064   11.701  155.371   16.082  141.970   17.056   85.888   4.5399   81.898   5.0493 3.990105 6.790144 
1 1 1   20   28    2 o   64.604   3.8795   89.385   10.255   98.679   14.220   79.312   14.804   68.278   5.0496   60.929   5.8910 7.348396 7.759043 
1 1 1   20   28    3 o  127.172   2.8020  341.093   14.573  359.768   19.733  318.691   21.612  131.181   3.6473  123.163   4.2546 8.017548 5.603903 
1 1 1   20   28    4 o   85.750   2.7258  153.721   9.5861  156.270   14.389  151.687   12.854   86.324   4.0414   85.176   3.6589 1.147606 5.451680 
1 1 1   20   28    5 o   94.472   2.5329  188.982   9.5902  175.068   15.170  198.245   12.377   91.374   4.0253   97.570   3.0757 -6.195923 5.065845 
1 1 1   20   28    6 o   89.246   2.5484  163.943   9.1361  177.445   14.940  155.877   11.547   92.021   3.9363   86.470   3.2377 5.551445 5.096757 
1 1 1   20   28    7 o  140.979   2.3272  416.534   13.158  405.820   21.089  423.364   16.837  139.293   3.6708  142.665   2.8614 -3.372314 4.654323 
1 1 1   20   28    8 o   58.853   3.0915   71.101   7.1876   79.193   12.314   66.919   8.8521   61.183   4.8797   56.524   3.7971 4.659069 6.183006 
1 1 1   20   28    9 o   67.188   3.0305   96.527   7.9952   89.820   13.277  100.343   10.015   65.101   4.9446   69.275   3.5050 -4.173622 6.060923 
1 1 1   20   28   10 o   39.716   4.6460   39.394   6.4562   23.627   11.161   47.323   7.9150   31.979   8.3658   47.452   4.0441 -15.47333 9.292017 
1 1 1   20   28   11 o   45.715   3.8063   44.756   6.5390   44.137   11.957   45.021   7.8105   45.166   6.4185   46.264   4.0933 -1.097775 7.612650 
1 1 1   20   28   12 o   32.457   5.0171   25.313   6.0765   18.796   11.431   27.881   7.1742   28.647   8.8138   36.267   4.7962 -7.620176 10.03426 
1 1 1   20   28   13 o  100.351   2.5607  212.255   10.120  207.124   16.935  215.105   12.621   99.152   4.1411  101.551   3.0133 -2.399338 5.121413 
1 1 1   20   28   14 o   49.785   5.3739   64.624   8.6319   38.855   16.304   74.661   10.175   40.092   9.9153   59.477   4.1478 -19.38525 10.74788 
1 1 1   20   28   15 o   79.689   3.6189  141.104   10.854  121.981   19.043  150.306   13.209   74.879   6.1660   84.500   3.7901 -9.621315 7.237726 
1 1 1   20   28   16 o   69.926   3.2802  104.062   9.3279  104.291   14.436  103.897   12.222   69.808   5.0141   70.044   4.2305 -0.2361679 6.560347 
1 1 1   20   28   17 o   54.250   3.9244   62.641   8.6625   69.428   13.643   58.056   11.213   56.536   5.8509   51.963   5.2318 4.572933 7.848863 
1 1 1   20   28   18 o   48.818   5.3862   57.014   9.1038   48.195   17.080   60.514   10.760   44.501   9.5884   53.135   4.9097 -8.633900 10.77233 
1 1 1   20   28   19 o   29.439   6.6957   20.143   8.3161   21.680   17.446   19.691   9.4600   30.017   10.904   28.861   7.7733 1.156071 13.39142 
1 1 1   20   28   20 o   47.147   4.7128   49.070   8.7215   51.920   14.913   47.588   10.752   47.626   7.5921   46.668   5.5860 0.9572906 9.425630 
1 1 1   20   28   21 o   25.292   5.8117   15.133   7.5982   4.8759   12.479   21.177   9.5787   20.746   8.6866   29.839   7.7232 -9.093653 11.62349 
1 1 1   20   28   22 o   54.988   4.5402   72.269   9.1474   44.848   13.650   94.624   12.324   43.562   7.8874   66.413   4.4993 -22.85073 9.080477 
1 1 1   20   28   23 o   51.789   4.8903   60.216   10.361   54.757   13.634   67.679   15.941   49.182   6.7211   54.395   7.1055 -5.212231 9.780654 
1 1 1   20   28   24 o   44.426   5.2370   48.492   8.8604   35.585   13.577   58.068   11.694   37.599   8.8940   51.254   5.5319 -13.65435 10.47404 
1 1 1   20   28   25 o   48.198   4.5860   53.077   8.9588   50.803   13.771   54.745   11.796   46.834   7.1292   49.563   5.7706 -2.729004 9.171995 
1 1 1   20   28   26 o   16.455   5.3746  -7.5658   8.7341 -15.1985   12.030   0.9410   12.701   14.057   6.7985   18.853   8.3262 -4.796201 10.74917 
1 1 1   20   28   27 o   43.429   6.1381   46.375   9.7265   51.036   18.478   44.588   11.440   42.779   10.541   44.080   6.2923 -1.300716 12.27629 
1 1 1   20   28   28 o   22.462   5.5588   9.9238   7.8840  -6.9787   12.397   21.402   10.216   16.054   7.5105   28.870   8.1970 -12.81608 11.11754 
1 1 1   20   29    1 f   74.087   3.1722  115.446   9.5249  117.768   14.981  113.871   12.340   74.560   4.8716   73.614   4.0644 0.9466095 6.344449 
1 1 1   20   29    2 o  158.371   2.7371  526.802   17.768  532.074   23.911  520.302   26.550  159.414   3.6367  157.327   4.0917 2.087570 5.474233 
1 1 1   20   29    3 o   71.199   3.5117  108.036   10.154  110.652   13.352  104.449   15.635   72.414   4.4706   69.984   5.4167 2.429855 7.023329 
1 1 1   20   29    4 o   57.728   3.8868   71.397   8.9663   72.170   11.405   70.145   14.509   58.394   4.7353   57.063   6.1650 1.331192 7.773681 
1 1 1   20   29    5 o   24.213   5.3447   11.732   5.6410   17.455   10.027   9.0819   6.8230   27.685   8.1999   20.742   6.8574 6.943861 10.68937 
1 1 1   20   29    6 o   48.413   3.5738   49.989   6.7070   49.252   11.603   50.360   8.2192   47.893   5.8740   48.934   4.0724 -1.041321 7.147617 
1 1 1   20   29    7 o   25.182   5.2759   14.487   5.6491   11.895   10.510   15.540   6.6991   24.025   8.4950   26.338   6.2591 -2.312984 10.55189 
1 1 1   20   29    8 o   91.468   2.6130  180.550   9.4322  155.216   15.109  196.728   12.074   85.804   4.2693   97.132   3.0138 -11.32829 5.225946 
1 1 1   20   29    9 o   23.286   5.4092   11.392   5.6566   12.608   10.345   10.873   6.7561   24.375   8.4411   22.196   6.7666 2.179474 10.81846 
1 1 1   20   29   10 o   26.376   4.9342   17.162   5.8335   6.4817   10.755   21.614   6.9438   20.964   8.3268   31.788   5.2963 -10.82314 9.868418 
1 1 1   20   29   11 o   19.813   5.0457   7.7186   5.5737  -2.4723   10.979   11.257   6.4695   17.194   7.6594   22.432   6.5705 -5.238304 10.09145 
1 1 1   20   29   12 o   47.596   3.9061   52.167   6.7667   40.728   12.116   57.353   8.1575   43.000   6.8315   52.192   3.7896 -9.192146 7.812215 
1 1 1   20   29   13 o   29.093   5.5701   19.820   6.5997   18.661   11.648   20.368   8.0092   28.262   8.9295   29.924   6.6609 -1.661972 11.14012 
1 1 1   20   29   14 o   43.034   5.2807   41.108   7.0805   43.557   16.430   40.550   7.8466   42.361   9.6228   43.707   4.3528 -1.346092 10.56145 
1 1 1   20   29   15 o   26.961   5.8645   15.196   7.0319   24.140   11.951   10.461   8.6966   31.734   8.8157   22.189   7.7363 9.544950 11.72891 
1 1 1   20   29   16 o   83.602   3.0826  152.021   10.357  129.691   15.747  169.045   13.749   77.719   4.9124   89.485   3.7252 -11.76661 6.165116 
1 1 1   20   29   17 o   67.572   3.4749   99.702   9.4345   91.480   14.728  105.424   12.286   64.804   5.5103   70.339   4.2351 -5.535416 6.949746 
1 1 1   20   29   18 o   51.480   4.3215   61.389   8.4991   49.037   14.037   68.538   10.679   46.435   7.3293   56.526   4.5806 -10.09120 8.642935 
1 1 1   20   29   19 o   43.735   4.8785   45.632   8.0820   33.070   12.373   54.978   10.673   37.097   8.2951   50.374   5.1372 -13.27711 9.757074 
1 1 1   20   29   20 o   18.850   5.1914   1.7159   7.2462 -16.6281   11.645   13.307   9.2567   13.673   6.6312   24.027   7.9894 -10.35385 10.38281 
1 1 1   20   29   21 o   27.749   6.2533   19.210   8.0795   15.674   13.456   21.204   10.104   25.984   9.5555   29.513   8.0689 -3.529160 12.50658 
1 1 1   20   29   22 o   58.802   4.2506   79.569   9.7439   68.586   15.875   86.208   12.342   54.587   7.0513   63.017   4.7486 -8.430553 8.501155 
1 1 1   20   29   23 o   47.369   5.3023   52.136   9.8884   39.072   13.240   68.617   14.871   39.834   8.3265   54.903   6.5671 -15.06888 10.60457 
1 1 1   20   29   24 o   33.022   5.4571   31.352   8.6738   4.7414   15.058   44.565   10.611   21.412   9.2678   44.632   5.7642 -23.22004 10.91414 
1 1 1   20   29   25 o   22.234   5.6691   9.4309   7.8988  -4.7969   12.174   19.774   10.380   16.605   7.6555   27.864   8.3635 -11.25947 11.33825 
1 1 1   20   29   26 o   34.258   6.1140   31.002   8.7801   24.665   12.879   36.504   12.001   30.229   9.3648   38.287   7.8630 -8.058178 12.22809 
1 1 1   20   29   27 o   22.660   6.5182   10.628   9.5436   11.002   12.918   10.178   14.160   22.665   9.0847   22.654   9.3496 0.1046181E-01 13.03636 
1 1 1   20   30    0 o   29.239   7.3583   24.271   11.439   24.271   11.439   24.271   11.439   29.239   10.406   29.239   10.406 0.000000 0.000000 
1 1 1   20   30    1 o   19.785   5.5174   3.3154   6.8758   12.008   10.867  -2.4880   8.8792   24.137   8.6269   15.434   6.8808 8.703209 11.03485 
1 1 1   20   30    2 o   74.299   3.4484  121.642   10.054  135.201   12.897  100.636   16.052   80.175   3.9001   68.423   5.6880 11.75250 6.896726 
1 1 1   20   30    3 o   56.985   4.0289   70.369   9.1007   71.888   11.486   67.807   14.918   58.164   4.7878   55.807   6.4812 2.356640 8.057875 
1 1 1   20   30    4 o   47.648   5.0278   54.285   8.7006   62.800   10.908   39.390   14.426   54.318   4.8689   40.978   8.7983 13.33923 10.05568 
1 1 1   20   30    5 o   89.229   2.7869  167.576   10.252  161.775   14.257  173.785   14.752   87.630   3.9448   90.828   3.9379 -3.197784 5.573856 
1 1 1   20   30    6 o  114.321   2.4959  274.326   11.766  271.294   16.735  277.289   16.546  113.674   3.5695  114.968   3.4894 -1.294418 4.991710 
1 1 1   20   30    7 o   54.850   3.3834   67.474   6.9893   54.796   12.011   73.965   8.5943   50.340   5.7850   59.360   3.5104 -9.020710 6.766706 
1 1 1   20   30    8 o   81.262   2.7015  137.021   8.7779  147.626   14.512  130.903   11.023   83.518   4.2129   79.006   3.3828 4.512619 5.402965 
1 1 1   20   30    9 o   28.127   5.0810   13.811   5.8113   31.919   11.169   7.0893   6.8050   37.240   7.5304   19.014   6.8235 18.22608 10.16204 
1 1 1   20   30   10 o   98.482   2.5755  204.587   9.9898  202.358   16.766  205.814   12.439   97.766   4.1581   99.198   3.0403 -1.431953 5.150978 
1 1 1   20   30   11 o   28.279   5.3057   19.338   5.9504   15.141   11.620   20.830   6.9276   25.977   8.9491   30.581   5.7021 -4.604435 10.61132 
1 1 1   20   30   12 o   65.230   3.1552   93.771   7.8086   81.727   13.557   99.750   9.5522   61.541   5.3413   68.919   3.3605 -7.377441 6.310483 
1 1 1   20   30   13 o   34.398   5.1900   25.706   6.7550   33.177   12.133   22.350   8.1317   37.487   8.0850   31.308   6.5097 6.179678 10.38000 
1 1 1   20   30   14 o   67.645   3.7161   98.232   8.4862  100.749   18.312   97.544   9.5766   67.242   6.6027   68.048   3.4122 -0.8055496 7.432262 
1 1 1   20   30   15 o   27.375   5.9270   17.989   7.1882   16.710   12.127   18.682   8.9250   26.651   9.1444   28.099   7.5429 -1.448324 11.85395 
1 1 1   20   30   16 o   91.665   2.8466  178.420   10.707  180.762   16.013  176.527   14.398   92.075   4.2165   91.255   3.8255 0.8199158 5.693289 
1 1 1   20   30   17 o   39.719   5.2265   37.176   8.0408   33.525   13.004   39.437   10.231   37.100   8.6567   42.338   5.8590 -5.238213 10.45306 
1 1 1   20   30   18 o   61.510   3.7733   84.856   9.1816   72.384   14.494   93.217   11.866   57.065   6.1581   65.956   4.3621 -8.891273 7.546517 
1 1 1   20   30   19 o   40.063   5.2162   37.634   8.1058   37.028   13.285   37.994   10.231   38.817   8.5307   41.308   6.0049 -2.490696 10.43231 
1 1 1   20   30   20 o   75.739   3.3530  126.266   10.290  103.312   14.843  147.502   14.277   68.590   5.2469   82.887   4.1763 -14.29712 6.706097 
1 1 1   20   30   21 o   81.294   3.1756  145.449   10.430  123.325   15.518  163.678   14.085   75.092   5.0104   87.497   3.9031 -12.40491 6.351262 
1 1 1   20   30   22 o   14.885   4.8548  -6.4709   7.2892 -20.3523   12.642   0.4425   8.9215   13.581   6.6564   16.188   7.0687 -2.606584 9.709516 
1 1 1   20   30   23 o   45.894   6.4814   56.014   11.692   44.444   18.287   64.013   15.206   39.551   10.873   52.238   7.0576 -12.68660 12.96278 
1 1 1   20   30   24 o   44.966   5.7886   49.623   10.350   36.815   13.908   65.522   15.496   37.361   9.1079   52.570   7.1468 -15.20824 11.57719 
1 1 1   20   30   25 o   25.552   6.6093   15.976   9.7493   6.4444   14.206   24.462   13.404   21.231   9.0932   29.873   9.5939 -8.642111 13.21852 
1 1 1   20   31    0 o   58.836   4.1402   75.274   13.886   75.274   13.886   75.274   13.886   58.836   5.8551   58.836   5.8551 0.000000 0.000000 
1 1 1   20   31    1 o   56.306   3.7150   67.538   8.5089   71.764   13.326   64.629   11.056   57.621   5.6074   54.990   4.8747 2.630348 7.430023 
1 1 1   20   31    2 o   30.460   5.8652   23.119   7.9590   29.254   10.071   12.911   12.990   35.803   7.0708   25.118   9.3598 10.68493 11.73038 
1 1 1   20   31    3 o   48.454   4.4197   50.408   8.5488   47.749   10.704   55.093   14.206   47.025   5.5187   49.883   6.9050 -2.857563 8.839445 
1 1 1   20   31    4 f   45.451   4.7011   44.922   8.6371   42.570   11.052   48.614   13.844   44.188   6.0641   46.713   7.1854 -2.525352 9.402296 
1 1 1   20   31    5 o   59.816   3.3625   76.456   8.2650   84.798   11.803   68.430   11.578   63.113   4.5341   56.519   4.9666 6.594162 6.724936 
1 1 1   20   31    6 o   27.702   5.3624   16.550   6.7797   28.044   10.302   7.7684   9.0047   34.845   7.3967   20.559   7.7658 14.28616 10.72471 
1 1 1   20   31    7 o   34.103   5.1947   27.021   7.0281   25.863   10.774   27.879   9.2724   33.152   7.9766   35.054   6.6568 -1.902695 10.38940 
1 1 1   20   31    8 o   85.791   2.7789  157.329   9.5444  148.423   15.207  163.117   12.260   83.482   4.4166   88.100   3.3740 -4.617859 5.557857 
1 1 1   20   31    9 o   74.248   2.9113  119.271   8.3322  110.376   14.318  123.826   10.246   71.706   4.8413   76.790   3.2350 -5.083977 5.822699 
1 1 1   20   31   10 o   68.710   3.1190  104.479   8.0581   91.184   14.208  110.784   9.7839   64.834   5.3133   72.585   3.2681 -7.751183 6.237947 
1 1 1   20   31   11 o   22.718   5.6287   10.046   5.7761   14.900   11.792   8.5135   6.6253   25.545   9.0019   19.892   6.7596 5.653046 11.25734 
1 1 1   20   31   12 o   78.796   2.8974  133.467   8.7065  128.471   15.425  135.802   10.547   77.216   4.8433   80.375   3.1816 -3.159050 5.794877 
1 1 1   20   31   13 o   17.996   5.4602   3.0355   6.2988 -11.4359   16.505   5.5025   6.8146   18.296   8.5934   17.696   6.7386 0.5997162 10.92039 
1 1 1   20   31   14 o   34.919   5.1586   29.026   6.2544   26.401   12.925   29.828   7.1469   32.583   9.2092   37.254   4.6513 -4.671246 10.31719 
1 1 1   20   31   15 o   44.612   4.8933   49.107   7.9837   32.381   12.656   60.164   10.290   36.398   8.5718   52.827   4.7226 -16.42902 9.786670 
1 1 1   20   31   16 o   63.126   3.6653   89.146   9.2606   71.374   13.794  103.730   12.495   56.741   5.8942   69.512   4.3584 -12.77074 7.330547 
1 1 1   20   31   17 o   30.543   5.0118   24.357   7.4439   3.5099   11.771   38.249   9.6091   19.497   8.3121   41.590   5.6019 -22.09259 10.02358 
1 1 1   20   31   18 o   59.636   3.6876   76.566   8.9082   86.314   14.282   70.359   11.397   62.444   5.5455   56.829   4.8624 5.614922 7.375288 
1 1 1   20   31   19 o   78.368   3.3641  135.702   10.663  118.779   16.018  149.170   14.289   73.427   5.2890   83.309   4.1587 -9.882103 6.728157 
1 1 1   20   31   20 o   53.028   4.7789   64.025   10.384   56.677   13.802   73.609   15.763   49.574   6.7504   56.482   6.7665 -6.907906 9.557886 
1 1 1   20   31   21 o   14.008   4.8101 -18.1267   8.8035  -9.1677   12.574 -26.7396   12.329   15.726   7.4216   12.290   6.1210 3.435920 9.620114 
1 1 1   20   31   22 o   38.295   8.3715   41.857   13.025   38.540   14.730   53.742   27.883   37.915   9.4526   38.675   13.819 -0.7595406 16.74292 
1 1 1   20   31   23 o   49.527   6.3054   60.947   12.409   75.246   20.111   52.156   15.769   54.141   9.0061   44.914   8.8274 9.226963 12.61084 
1 1 1   20   32    0 o   55.322   4.3023   67.376   13.455   67.376   13.455   67.376   13.455   55.322   6.0844   55.322   6.0844 0.000000 0.000000 
1 1 1   20   32    1 o   26.420   5.5451   16.140   6.7386   22.126   9.6337   10.405   9.4294   30.598   7.6532   22.242   8.0263 8.356054 11.09019 
1 1 1   20   32    2 o   65.502   3.8757   96.891   9.8810  107.197   12.567   80.203   15.991   70.902   4.2974   60.102   6.4510 10.80036 7.751354 
1 1 1   20   32    3 o   32.847   6.0792   25.807   8.1441   24.578   10.299   27.858   13.304   32.161   7.8364   33.533   9.2963 -1.371731 12.15850 
1 1 1   20   32    4 o   17.545   5.3274  -6.1602   7.2756 -15.4391   9.0473   10.825   12.241   11.653   5.6944   23.436   9.0056 -11.78288 10.65489 
1 1 1   20   32    5 o   61.598   3.4003   81.690   8.6373   79.997   12.207   83.387   12.223   60.933   4.8574   62.264   4.7595 -1.330902 6.800554 
1 1 1   20   32    6 o   58.930   3.4038   75.161   8.2185   70.463   12.074   79.215   11.218   57.035   5.1329   60.826   4.4717 -3.791164 6.807559 
1 1 1   20   32    7 o   51.431   3.8132   58.590   7.9218   49.490   11.761   66.149   10.718   47.376   6.0188   55.485   4.6835 -8.109081 7.626339 
1 1 1   20   32    8 f  106.139   3.4431  246.754   14.457  258.741   18.350  227.140   23.473  110.314   4.0330  101.963   5.5816 8.350449 6.886168 
1 1 1   20   32    9 o   85.066   2.8215  154.750   9.8314  140.487   14.273  167.627   13.562   81.132   4.2653   88.999   3.6945 -7.866852 5.642922 
1 1 1   20   32   10 o   77.724   2.8726  129.993   8.5994  124.419   14.937  132.757   10.517   76.009   4.7648   79.440   3.2099 -3.431282 5.745105 
1 1 1   20   32   11 o   16.267   5.0442   0.1240   5.2534   2.8208   11.806  -0.5417   5.8662   19.437   8.3065   13.097   5.7252 6.340311 10.08841 
1 1 1   20   32   12 o   35.761   5.1630   32.619   6.3758   24.074   12.946   35.355   7.3258   30.923   9.3534   40.599   4.3750 -9.676264 10.32601 
1 1 1   20   32   13 o   31.386   6.2656   23.366   7.1713   25.870   17.009   22.825   7.9086   31.305   10.825   31.467   6.3133 -0.1614017 12.53118 
1 1 1   20   32   14 o   35.156   5.1856   35.019   7.7883   9.7034   12.958   49.337   9.7451   22.741   9.1044   47.571   4.9668 -24.83031 10.37110 
1 1 1   20   32   15 o   41.474   5.0590   41.843   7.9607   33.795   12.808   46.908   10.162   36.797   8.5950   46.151   5.3385 -9.353786 10.11797 
1 1 1   20   32   16 o   39.024   6.2099   38.818   9.6379   41.281   12.471   35.166   15.188   41.548   7.5557   36.501   9.8570 5.046310 12.41974 
1 1 1   20   32   17 f   38.607   6.3371   37.947   9.9955   29.799   13.824   46.872   14.469   33.653   9.5286   43.562   8.3573 -9.908398 12.67430 
1 1 1   20   32   18 o   69.517   4.1343  109.136   11.810  116.612   16.492  101.268   16.920   72.274   5.5327   66.760   6.1450 5.514328 8.268687 
1 1 1   20   32   19 o   30.664   6.3563   23.583   9.9572   6.8854   13.900   41.180   14.270   21.425   9.0797   39.902   8.8976 -18.47673 12.71256 
1 1 1   20   32   20 o   42.061   6.2779   46.834   10.836   31.350   15.510   61.601   15.146   33.258   10.272   50.864   7.2198 -17.60597 12.55574 
1 1 1   20   32   21 o   33.744   6.8650   31.406   10.078   29.736   14.162   33.121   14.345   32.765   9.7541   34.723   9.6627 -1.957695 13.72992 
1 1 1   20   33    0 o   81.934   3.3686  142.859   15.974  142.859   15.974  142.859   15.974   81.934   4.7639   81.934   4.7639 0.000000 0.000000 
1 1 1   20   33    1 o   33.835   5.5156   25.664   7.6064   16.856   9.7503   39.358   12.158   26.607   8.1326   41.063   7.4531 -14.45627 11.03125 
1 1 1   20   33    2 o   22.723   6.1363   9.9062   7.6719   8.8236   9.4332   12.021   13.185   21.168   7.9588   24.277   9.3422 -3.108620 12.27269 
1 1 1   20   33    3 o   46.186   5.1800   50.343   8.9964   53.494   11.243   44.734   15.000   49.471   5.5103   42.901   8.7731 6.569328 10.36002 
1 1 1   20   33    4 o   38.917   5.6045   33.370   8.7094   24.319   10.948   48.971   14.373   31.655   8.2880   46.179   7.5465 -14.52340 11.20898 
1 1 1   20   33    5 o   76.377   3.0369  124.595   9.5542  116.124   13.251  133.766   13.788   73.633   4.3634   79.121   4.2252 -5.487312 6.073789 
1 1 1   20   33    6 o   36.190   5.0476   30.715   7.3063   26.848   10.936   33.832   9.8192   33.346   8.0443   39.033   6.0992 -5.687366 10.09515 
1 1 1   20   33    7 f   52.670   3.8136   61.318   8.1884   53.579   11.916   68.243   11.271   49.207   5.8715   56.134   4.8682 -6.927128 7.627215 
1 1 1   20   33    8 o   65.169   3.1865   90.951   8.5398   98.620   12.677   84.581   11.555   67.647   4.5438   62.692   4.4687 4.955639 6.373040 
1 1 1   20   33    9 o   38.344   5.0284   36.068   7.4235   26.194   11.606   42.904   9.6572   32.454   8.5510   44.233   5.2935 -11.77871 10.05688 
1 1 1   20   33   10 o   65.156   3.2766   92.460   8.7157   87.351   13.050   96.573   11.710   63.266   5.0014   67.046   4.2346 -3.780117 6.553276 
1 1 1   20   33   11 o   25.379   5.3883   15.424   5.7196   14.628   11.130   15.710   6.6674   24.824   8.7457   25.934   6.2965 -1.109648 10.77652 
1 1 1   20   33   12 o   75.082   4.0029  133.030   10.798  106.411   19.730  144.412   12.901   67.899   7.0453   82.266   3.8023 -14.36693 8.005834 
1 1 1   20   33   13 o   27.965   6.3159   20.376   8.4883   13.510   14.331   24.087   10.535   24.759   9.6803   31.171   8.1150 -6.412209 12.63177 
1 1 1   20   33   14 o   85.613   3.6162  160.462   12.737  148.737   17.307  174.314   18.812   82.230   5.1031   88.996   5.1250 -6.766052 7.232347 
1 1 1   20   33   15 f   31.052   6.8784   25.954   9.8081   26.977   13.579   24.838   14.182   31.764   9.5730   30.339   9.8796 1.424511 13.75679 
1 1 1   20   33   16 o   52.950   5.1758   65.674   11.196   54.920   14.988   79.250   16.841   47.844   7.5954   58.057   7.0332 -10.21290 10.35157 
1 1 1   20   33   17 o   36.616   6.7507   36.295   10.307   37.600   14.267   34.870   14.906   37.615   9.2586   35.617   9.8268 1.998436 13.50139 
1 1 1   20   33   18 o   41.656   6.4988   46.019   11.417   28.706   15.776   65.058   16.543   31.634   10.426   51.678   7.7616 -20.04408 12.99753 
1 1 1   20   34    0 o   17.180   6.6402   9.7643   9.4900   9.7643   9.4900   9.7643   9.4900   17.180   9.3906   17.180   9.3906 0.000000 0.000000 
1 1 1   20   34    1 o   24.983   5.9593   15.020   7.4839   18.461   9.9041   10.440   11.426   27.419   8.1559   22.547   8.6910 4.871632 11.91852 
1 1 1   20   34    2 o   92.947   3.1648  188.094   11.698  193.005   14.851  180.065   18.988   95.154   3.7842   90.739   5.0738 4.415916 6.329555 
1 1 1   20   34    3 f   36.797   5.8918   35.046   8.6987   40.009   10.833   26.040   14.594   42.156   6.2308   31.438   10.002 10.71749 11.78370 
1 1 1   20   34    4 o   44.269   5.2720   46.880   8.8915   48.923   11.174   43.354   14.680   46.883   5.7787   41.655   8.8195 5.228191 10.54406 
1 1 1   20   34    5 o   23.380   5.8381   12.648   7.0519   10.764   10.679   14.104   9.3909   22.447   8.4622   24.314   8.0453 -1.867748 11.67626 
1 1 1   20   34    6 o   63.096   3.3061   86.455   8.5789   85.595   12.572   87.206   11.736   62.673   4.8634   63.519   4.4798 -0.8458061 6.612199 
1 1 1   20   34    7 o   30.249   5.6943   22.184   7.2286   26.943   10.961   18.521   9.6158   33.049   8.1037   27.450   8.0020 5.598869 11.38869 
1 1 1   20   34    8 o   33.640   5.5690   30.548   7.8807   16.372   13.477   37.914   9.7145   26.019   9.5640   41.262   5.7083 -15.24256 11.13797 
1 1 1   20   34    9 o   65.901   4.0378  100.235   9.9783   87.260   17.510  106.476   12.143   61.476   6.9057   70.326   4.1864 -8.849781 8.075583 
1 1 1   20   34   10 o   62.109   4.0270   87.128   9.6028   83.298   16.654   89.035   11.753   60.134   6.7150   64.083   4.4468 -3.949791 8.053930 
1 1 1   20   34   11 o   68.187   4.2194  114.744   10.420   77.139   17.532  135.283   12.957   57.039   7.4522   79.335   3.9597 -22.29566 8.438880 
1 1 1   20   34   12 o   20.855   6.5608   3.5564   9.1202   4.7599   21.731   3.2991   10.048   23.615   10.628   18.094   7.6959 5.521006 13.12166 
1 1 1   20   34   13 o   45.478   5.9738   52.793   10.747   37.980   15.278   67.302   15.120   37.338   9.7978   53.618   6.8373 -16.27999 11.94768 
1 1 1   20   34   14 o   39.225   6.5410   40.908   10.457   35.636   14.754   46.231   14.824   36.118   9.6994   42.333   8.7783 -6.215145 13.08194 
1 1 1   20   34   15 o   24.020   6.9192   12.765   10.967   5.1784   18.845   16.651   13.486   22.516   10.032   25.524   9.5318 -3.007143 13.83841 
1 1 1   20   35    0 o   23.524   7.1874   17.933   10.154   17.933   10.154   17.933   10.154   23.524   10.164   23.524   10.164 0.000000 0.000000 
1 1 1   20   35    1 o   20.761   5.8700   7.6032   7.5299   5.6503   9.8625   10.332   11.659   19.199   7.8489   22.324   8.7305 -3.124840 11.74000 
1 1 1   20   35    2 o   25.472   6.3887   15.741   8.1510   15.148   10.070   16.870   13.882   24.850   8.3340   26.094   9.6854 -1.244780 12.77740 
1 1 1   20   35    3 o   30.385   5.8144   21.188   9.7379   44.446   13.663  -2.8239   13.883   42.448   8.0996   18.322   8.3442 24.12638 11.62881 
1 1 1   20   35    4 o   69.098   4.2564  107.188   12.055  124.996   17.878   92.343   16.324   74.521   5.8167   63.675   6.2156 10.84625 8.512836 
1 1 1   20   35    5 o   35.821   5.9307   33.386   8.4916   27.906   14.680   36.142   10.410   31.921   10.016   39.721   6.3542 -7.799995 11.86145 
1 1 1   20   35    6 o   17.085   5.4220  -0.7215   7.5210  -1.4613   13.202  -0.3660   9.1512   18.245   8.2407   15.926   7.0488 2.319764 10.84407 
1 1 1   20   35    7 o   42.042   5.5544   45.388   8.8066   35.898   14.609   50.806   11.038   36.543   9.5768   47.540   5.6292 -10.99716 11.10871 
1 1 1   20   35    8 o   35.907   5.7565   33.488   8.1420   28.116   14.104   36.172   9.9712   32.004   9.7811   39.809   6.0729 -7.805386 11.51307 
1 1 1   20   35    9 o   40.075   5.5863   38.699   8.4541   42.413   15.085   36.998   10.208   39.979   9.3203   40.172   6.1609 -0.1930962 11.17251 
1 1 1   20   35   10 o   57.612   6.0472   84.033   13.143   80.649   22.010   85.908   16.385   54.441   10.177   60.784   6.5356 -6.342812 12.09443 
1 1 1   20   35   11 o   20.478   8.8985   4.5892   13.991   0.0000   0.0000   4.5892   13.991  ?   ?    20.478   8.8985      ?      ? 
1 1 1   20   35   12 o   30.874   8.5075   29.212   15.297   27.632   19.232   31.934   25.240   30.388   11.376   31.361   12.653 -0.9733887 17.01503 
1 1 1   20   36    0 o   14.065   6.4147   2.4823   12.213   2.4823   12.213   2.4823   12.213   14.065   9.0718   14.065   9.0718 0.000000 0.000000 
1 1 1   20   36    1 o   43.215   5.9153   47.386   10.259   57.051   14.535   37.792   14.482   48.922   7.2037   37.508   9.3844 11.41463 11.83050 
1 1 1   20   36    2 o   37.653   7.2452   47.002   13.406   55.628   15.201   16.826   28.431   47.843   7.7037   27.463   12.273 20.38038 14.49049 
1 1 1   20   36    3 o   28.833   7.4687   24.686   12.519   30.258   13.986   2.2302   28.076   33.173   9.6448   24.492   11.406 8.681225 14.93742 
1 1 1   20   36    4 o   44.050   7.9913   65.978   16.556   78.946   19.810   35.942   30.148   55.960   8.5830   32.140   13.482 23.81945 15.98255 
1 1 1   20   36    5 o   17.325   6.1237 -26.5941   13.150 -27.5877   14.860 -23.0069   28.235   13.851   6.8683   20.798   10.140 -6.947271 12.24744 
1 1 1   20   36    6 o   23.070   6.6206   4.9923   11.013   24.960   16.509 -11.0205   14.784   29.522   10.624   16.619   7.9027 12.90321 13.24125 
1 1 1   21    0    1 o  166.077   2.1505  569.659   20.816  569.659   20.816  569.659   20.816  166.077   3.0412  166.077   3.0412 0.000000 0.000000 
1 1 1   21    0    2 o   36.365   4.5273   29.730   8.7138   29.730   8.7138   29.730   8.7138   36.365   6.4026   36.365   6.4026 0.000000 0.000000 
1 1 1   21    0    3 o  147.577   2.4350  450.166   20.935  450.166   20.935  450.166   20.935  147.577   3.4437  147.577   3.4437 0.000000 0.000000 
1 1 1   21    0    4 o   22.945   6.4189   15.010   8.2712   15.010   8.2712   15.010   8.2712   22.945   9.0777   22.945   9.0777 0.000000 0.000000 
1 1 1   21    0    5 o  689.560   4.8347  9836.55  194.412  9836.55  194.412  9836.55  194.412  689.560   6.8372  689.560   6.8372 0.000000 0.000000 
1 1 1   21    0    6 o  106.793   2.2102  235.938   13.741  235.938   13.741  235.938   13.741  106.793   3.1257  106.793   3.1257 0.000000 0.000000 
1 1 1   21    0    7 o   86.690   2.3780  155.792   11.983  155.792   11.983  155.792   11.983   86.690   3.3629   86.690   3.3629 0.000000 0.000000 
1 1 1   21    0    8 o   48.796   4.0562   51.204   11.127   51.204   11.127   51.204   11.127   48.796   5.7363   48.796   5.7363 0.000000 0.000000 
1 1 1   21    0    9 o   13.754   6.3767  -1.9681   12.784  -1.9681   12.784  -1.9681   12.784   13.754   9.0180   13.754   9.0180 0.000000 0.000000 
1 1 1   21    0   10 o  201.056   3.1946  836.032   37.422  836.032   37.422  836.032   37.422  201.056   4.5179  201.056   4.5179 0.000000 0.000000 
1 1 1   21    0   11 o   75.020   2.9974  117.318   13.021  117.318   13.021  117.318   13.021   75.020   4.2390   75.020   4.2390 0.000000 0.000000 
1 1 1   21    0   12 f   84.910   2.4299  149.540   11.990  149.540   11.990  149.540   11.990   84.910   3.4365   84.910   3.4365 0.000000 0.000000 
1 1 1   21    0   13 o  140.412   2.1388  407.424   17.498  407.424   17.498  407.424   17.498  140.412   3.0247  140.412   3.0247 0.000000 0.000000 
1 1 1   21    0   14 o  196.822   2.2230  800.104   25.506  800.104   25.506  800.104   25.506  196.822   3.1437  196.822   3.1437 0.000000 0.000000 
1 1 1   21    0   15 o  123.128   2.1638  313.459   15.519  313.459   15.519  313.459   15.519  123.128   3.0601  123.128   3.0601 0.000000 0.000000 
1 1 1   21    0   16 f  196.539   2.6354  798.349   30.188  798.349   30.188  798.349   30.188  196.539   3.7271  196.539   3.7271 0.000000 0.000000 
1 1 1   21    0   17 o   66.766   3.4082   93.533   13.114   93.533   13.114   93.533   13.114   66.766   4.8200   66.766   4.8200 0.000000 0.000000 
1 1 1   21    0   18 o  259.666   2.6054  1393.02   39.443  1393.02   39.443  1393.02   39.443  259.666   3.6846  259.666   3.6846 0.000000 0.000000 
1 1 1   21    0   19 o   55.876   3.9501   66.474   12.579   66.474   12.579   66.474   12.579   55.876   5.5863   55.876   5.5863 0.000000 0.000000 
1 1 1   21    0   20 o   96.340   3.5964  193.492   20.081  193.492   20.081  193.492   20.081   96.340   5.0861   96.340   5.0861 0.000000 0.000000 
1 1 1   21    0   21 o  203.778   2.8919  859.007   34.342  859.007   34.342  859.007   34.342  203.778   4.0898  203.778   4.0898 0.000000 0.000000 
1 1 1   21    0   22 o   52.197   4.3310   58.716   12.711   58.716   12.711   58.716   12.711   52.197   6.1249   52.197   6.1249 0.000000 0.000000 
1 1 1   21    0   23 o  226.680   2.5879  1062.50   34.197  1062.50   34.197  1062.50   34.197  226.680   3.6598  226.680   3.6598 0.000000 0.000000 
1 1 1   21    0   24 o   16.447   6.8873   6.3456   11.424   6.3456   11.424   6.3456   11.424   16.447   9.7402   16.447   9.7402 0.000000 0.000000 
1 1 1   21    0   25 o   77.954   3.4152  127.304   15.392  127.304   15.392  127.304   15.392   77.954   4.8298   77.954   4.8298 0.000000 0.000000 
1 1 1   21    0   26 o   48.984   5.3861   53.486   14.281   53.486   14.281   53.486   14.281   48.984   7.6170   48.984   7.6170 0.000000 0.000000 
1 1 1   21    0   27 o   14.316   6.2979   2.9715   10.614   2.9715   10.614   2.9715   10.614   14.316   8.9065   14.316   8.9065 0.000000 0.000000 
1 1 1   21    0   28 o   99.180   2.9646  204.981   17.081  204.981   17.081  204.981   17.081   99.180   4.1926   99.180   4.1926 0.000000 0.000000 
1 1 1   21    0   29 o  143.471   3.4717  429.047   28.976  429.047   28.976  429.047   28.976  143.471   4.9097  143.471   4.9097 0.000000 0.000000 
1 1 1   21    0   30 o   71.285   3.4956  107.266   14.374  107.266   14.374  107.266   14.374   71.285   4.9435   71.285   4.9435 0.000000 0.000000 
1 1 1   21    0   31 o   17.211   8.3940 -17.8695   28.139 -17.8695   28.139 -17.8695   28.139   17.211   11.871   17.211   11.871 0.000000 0.000000 
1 1 1   21    0   32 o   20.881   7.9955   13.638   13.637   13.638   13.637   13.638   13.637   20.881   11.307   20.881   11.307 0.000000 0.000000 
1 1 1   21    0   33 o   18.864   7.3152   10.945   11.562   10.945   11.562   10.945   11.562   18.864   10.345   18.864   10.345 0.000000 0.000000 
1 1 1   21    0   34 o   72.355   3.6180  111.002   15.094  111.002   15.094  111.002   15.094   72.355   5.1167   72.355   5.1167 0.000000 0.000000 
1 1 1   21    0   36 o   18.676   7.2737   10.915   11.487   10.915   11.487   10.915   11.487   18.676   10.287   18.676   10.287 0.000000 0.000000 
1 1 1   21    0   37 o   16.141   6.8227   6.6960   11.404   6.6960   11.404   6.6960   11.404   16.141   9.6488   16.141   9.6488 0.000000 0.000000 
1 1 1   21    0   38 o   11.253   5.4406  -6.0459   11.249  -6.0459   11.249  -6.0459   11.249   11.253   7.6942   11.253   7.6942 0.000000 0.000000 
1 1 1   21    0   39 o   21.840   9.5286   13.660   23.796   13.660   23.796   13.660   23.796   21.840   13.476   21.840   13.476 0.000000 0.000000 
1 1 1   21    0   40 o   20.375   9.2764   7.5254   25.386   7.5254   25.386   7.5254   25.386   20.375   13.119   20.375   13.119 0.000000 0.000000 
1 1 1   21    0   41 f   76.231   6.8002  136.902   28.929  136.902   28.929  136.902   28.929   76.231   9.6169   76.231   9.6169 0.000000 0.000000 
1 1 1   21    0   42 f   27.956   11.503   33.387   30.923   33.387   30.923   33.387   30.923   27.956   16.268   27.956   16.268 0.000000 0.000000 
1 1 1   21    1    0 o  234.228   2.3239  1132.74   31.735  1132.74   31.735  1132.74   31.735  234.228   3.2864  234.228   3.2864 0.000000 0.000000 
1 1 1   21    1    1 o  193.406   2.1991  771.643   17.535  750.633   24.386  794.135   25.232  190.682   3.1007  196.129   3.1192 -5.446365 4.398137 
1 1 1   21    1    2 o  195.827   2.2014  791.692   17.780  790.729   25.122  792.659   25.168  195.707   3.1123  195.946   3.1142 -0.2385864 4.402799 
1 1 1   21    1    3 o  226.553   2.3002  1059.62   21.491  1049.48   30.170  1070.07   30.621  225.453   3.2446  227.652   3.2612 -2.198822 4.600307 
1 1 1   21    1    4 o  217.902   2.2739  980.249   20.434  990.670   29.113  970.128   28.689  219.043   3.2225  216.762   3.2090 2.281799 4.547715 
1 1 1   21    1    5 o   74.817   2.5095  115.634   7.7423  114.198   11.010  117.038   10.889   74.356   3.5902   75.278   3.5072 -0.9218826 5.018981 
1 1 1   21    1    6 o  212.652   2.2551  933.760   19.778  933.168   27.988  934.351   27.953  212.584   3.1921  212.719   3.1861 -0.1352692 4.510104 
1 1 1   21    1    7 o  417.929   3.2234  3611.37   55.556  3635.98   79.287  3587.64   77.868  419.320   4.5845  416.537   4.5325 2.783569 6.446818 
1 1 1   21    1    8 o  172.615   2.3501  611.982   16.484  634.569   25.820  596.443   21.416  175.269   3.5718  169.961   3.0552 5.308548 4.700171 
1 1 1   21    1    9 o  153.919   2.8411  488.783   17.634  493.519   28.121  485.714   22.639  154.499   4.4130  153.340   3.5796 1.159164 5.682277 
1 1 1   21    1   10 o  135.174   3.0958  377.741   17.259  382.478   24.574  373.130   24.244  136.010   4.3807  134.338   4.3756 1.672058 6.191678 
1 1 1   21    1   11 o   63.788   3.0057   84.023   7.8760   82.992   10.641   85.273   11.713   63.363   4.0716   64.214   4.4226 -0.8511124 6.011444 
1 1 1   21    1   12 o  191.568   2.2022  757.849   17.399  752.942   24.471  762.867   24.744  190.941   3.1073  192.194   3.1215 -1.252975 4.404438 
1 1 1   21    1   13 o  160.211   2.1606  529.905   14.275  521.412   19.957  538.801   20.425  158.898   3.0452  161.524   3.0660 -2.626312 4.321298 
1 1 1   21    1   14 o   95.935   2.3342  190.062   9.2334  184.005   12.947  196.331   13.171   94.379   3.3262   97.491   3.2757 -3.112343 4.668338 
1 1 1   21    1   15 o  193.511   2.2309  773.368   17.804  765.378   24.991  781.602   25.370  192.497   3.1478  194.525   3.1621 -2.028244 4.461771 
1 1 1   21    1   16 o   36.367   4.3222   27.956   6.2108   36.158   9.0611   20.688   8.5296   41.779   5.2585   30.955   6.8611 10.82332 8.644423 
1 1 1   21    1   17 o  251.135   2.5631  1298.81   25.738  1322.55   42.074  1284.62   32.535  252.896   4.0337  249.374   3.1633 3.521469 5.126116 
1 1 1   21    1   18 o  121.635   2.9505  309.780   14.612  338.949   19.793  274.844   21.662  128.041   3.7480  115.229   4.5579 12.81202 5.900990 
1 1 1   21    1   19 o  182.537   2.4319  688.499   18.306  672.434   25.703  705.037   26.079  180.375   3.4549  184.699   3.4234 -4.324707 4.863791 
1 1 1   21    1   20 o   78.285   4.0719  127.125   13.141  122.059   18.310  132.508   18.872   76.675   5.7898   79.895   5.7270 -3.220261 8.143768 
1 1 1   21    1   21 o  101.850   3.9199  215.391   15.591  215.536   26.757  215.317   19.184  101.762   6.3752  101.939   4.5629 -0.1772614 7.839816 
1 1 1   21    1   22 o  123.452   2.7635  315.400   13.922  316.258   21.306  314.760   18.391  123.564   4.1806  123.340   3.6153 0.2240753 5.527005 
1 1 1   21    1   23 o   96.519   2.9398  193.026   11.699  194.532   16.794  191.607   16.306   96.880   4.2031   96.159   4.1115 0.7208252 5.879623 
1 1 1   21    1   24 o  168.476   2.6266  587.907   18.213  589.024   24.972  586.636   26.622  168.671   3.5896  168.282   3.8356 0.3893738 5.253259 
1 1 1   21    1   25 o  103.778   3.2995  221.657   13.782  234.358   22.315  213.823   17.525  106.073   5.1006  101.484   4.1868 4.589005 6.598919 
1 1 1   21    1   26 o  151.071   3.0466  472.891   18.673  465.619   24.227  483.533   29.307  149.751   3.9225  152.391   4.6628 -2.640106 6.093260 
1 1 1   21    1   27 o  122.734   3.7498  313.024   18.906  339.575   28.332  291.711   25.384  127.364   5.3934  118.105   5.2110 9.258415 7.499531 
1 1 1   21    1   28 o   84.316   3.4443  151.360   11.690  164.148   15.384  133.889   17.982   88.756   4.2025   79.876   5.4582 8.879662 6.888615 
1 1 1   21    1   29 o   26.482   5.8421   11.456   8.0786   26.896   12.315  -0.2065   10.703   34.679   8.6415   18.285   7.8640 16.39355 11.68410 
1 1 1   21    1   30 o  140.690   2.8287  412.552   16.399  396.215   22.608  430.694   23.824  137.765   3.9788  143.615   4.0220 -5.850128 5.657489 
1 1 1   21    1   31 o   49.478   6.1198   55.773   10.864   57.662   12.900   51.164   20.149   52.106   6.0028   46.851   10.667 5.255013 12.23959 
1 1 1   21    1   32 o   36.770   7.6533   26.545   10.981   44.149   22.714   21.177   12.544   42.881   12.239   30.660   9.1919 12.22092 15.30663 
1 1 1   21    1   33 o   67.339   3.6760   96.014   10.184   88.066   14.360  104.057   14.446   64.465   5.4008   70.213   4.9883 -5.747520 7.351971 
1 1 1   21    1   34 o   32.904   6.1014   25.120   8.7176   16.080   12.559   33.527   12.111   27.313   9.3064   38.495   7.8929 -11.18147 12.20276 
1 1 1   21    1   35 o   61.836   4.3126   81.582   10.897   87.130   16.783   77.538   14.328   63.506   6.4073   60.166   5.7740 3.339870 8.625134 
1 1 1   21    1   36 o   46.109   6.9037   57.711   12.295   29.781   21.924   70.525   14.850   35.144   12.282   57.073   6.3087 -21.92869 13.80735 
1 1 1   21    1   37 o   29.890   5.9481   18.907   8.6617   35.443   12.900   5.3312   11.688   38.940   8.2867   20.840   8.5351 18.09928 11.89612 
1 1 1   21    1   38 o   24.958   6.2269   12.419   8.3946   20.418   12.214   5.2581   11.557   29.284   9.1276   20.632   8.4726 8.652164 12.45385 
1 1 1   21    1   39 o   18.343   6.1217 -15.8414   9.5177 -22.0481   10.790   5.9218   20.205   11.997   5.9316   24.688   10.710 -12.69027 12.24333 
1 1 1   21    1   40 o   39.972   9.1710   45.958   17.321   43.601   24.718   48.233   24.280   38.903   13.057   41.041   12.882 -2.138412 18.34192 
1 1 1   21    1   41 o   36.110   8.5239   29.937   18.764   71.504   27.137  -8.1415   25.973   49.043   13.147   23.178   10.852 25.86488 17.04777 
1 1 1   21    1   42 o   30.145   12.867   22.552   28.266   0.0000   0.0000   22.552   28.266  ?   ?    30.145   12.867      ?      ? 
1 1 1   21    2    0 o  299.628   2.6072  1853.67   45.551  1853.67   45.551  1853.67   45.551  299.628   3.6872  299.628   3.6872 0.000000 0.000000 
1 1 1   21    2    2 o  184.117   2.1804  699.790   16.557  704.441   23.558  695.250   23.275  184.721   3.0921  183.513   3.0751 1.207901 4.360880 
1 1 1   21    2    3 o  303.345   2.6234  1900.41   32.818  1916.79   46.863  1884.64   45.972  304.625   3.7299  302.065   3.6900 2.560455 5.246768 
1 1 1   21    2    4 o  175.511   2.1576  635.942   15.618  638.305   22.201  633.626   21.976  175.833   3.0613  175.189   3.0414 0.6443024 4.315262 
1 1 1   21    2    5 o  218.239   2.2714  983.430   20.445  988.461   29.043  978.487   28.785  218.792   3.2184  217.686   3.2060 1.105560 4.542771 
1 1 1   21    2    6 o  171.176   2.1538  604.973   15.206  606.274   21.518  603.675   21.491  171.359   3.0445  170.992   3.0473 0.3678894 4.307552 
1 1 1   21    2    7 o  359.632   2.9055  2672.61   43.089  2697.66   61.635  2648.67   60.263  361.274   4.1365  357.989   4.0814 3.284760 5.811064 
1 1 1   21    2    8 o  150.401   2.6769  472.321   15.591  452.772   26.923  482.186   19.124  147.984   4.4110  152.818   3.0342 -4.834244 5.353809 
1 1 1   21    2    9 o  145.674   2.8090  434.796   16.464  455.229   26.642  422.173   20.941  148.389   4.3531  142.960   3.5515 5.429108 5.618084 
1 1 1   21    2   10 o   78.811   3.6594  128.553   11.893  131.482   16.886  125.671   16.754   79.704   5.1367   77.918   5.2132 1.785408 7.318733 
1 1 1   21    2   11 o  226.144   2.5015  1056.97   23.096  1059.50   30.587  1053.63   35.229  226.488   3.2743  225.800   3.7828 0.6871796 5.003065 
1 1 1   21    2   12 o   91.587   2.3444  173.290   8.8542  174.549   12.424  171.991   12.622   91.927   3.2767   91.247   3.3539 0.6797409 4.688884 
1 1 1   21    2   13 o   89.238   2.3542  164.378   8.6617  170.038   12.441  159.055   12.066   90.728   3.3248   87.748   3.3340 2.979439 4.708445 
1 1 1   21    2   14 o   90.024   2.3991  167.303   8.8943  180.544   12.764  154.804   12.401   93.487   3.3103   86.560   3.4735 6.927605 4.798238 
1 1 1   21    2   15 o  110.902   2.2441  254.049   10.264  255.817   14.539  252.292   14.494  111.287   3.1675  110.517   3.1797 0.7700958 4.488132 
1 1 1   21    2   16 o  136.957   2.6030  387.691   14.703  383.266   20.796  392.113   20.791  136.174   3.7027  137.740   3.6597 -1.566116 5.206061 
1 1 1   21    2   17 o  303.836   2.7932  1901.45   33.799  1937.05   55.807  1880.83   42.475  305.971   4.4223  301.700   3.4134 4.270325 5.586406 
1 1 1   21    2   18 o  302.905   2.7597  1896.96   34.472  1917.65   49.292  1877.14   48.226  304.517   3.9246  301.293   3.8809 3.224121 5.519420 
1 1 1   21    2   19 o  103.498   2.7233  221.514   11.624  226.041   16.482  217.035   16.395  104.552   3.8222  102.444   3.8803 2.108276 5.446692 
1 1 1   21    2   20 o   49.960   5.5279   49.131   10.554   44.700   12.500   60.135   19.697   46.354   6.5379   53.565   8.9155 -7.210907 11.05577 
1 1 1   21    2   21 f  113.732   3.0941  267.670   14.023  268.929   23.039  266.929   17.674  113.880   4.9051  113.584   3.7727 0.2959824 6.188151 
1 1 1   21    2   22 o   75.672   3.4350  119.816   10.628  106.051   15.421  132.269   14.668   71.460   5.2322   79.883   4.4519 -8.423279 6.869924 
1 1 1   21    2   23 o  136.912   2.6406  387.757   14.903  405.171   21.425  371.434   20.744  139.891   3.7134  133.934   3.7552 5.956528 5.281173 
1 1 1   21    2   24 o   89.244   3.3077  165.270   12.004  164.794   15.705  165.938   18.616   89.140   4.2716   89.348   5.0516 -0.2081070 6.615487 
1 1 1   21    2   25 o  105.671   5.6897  233.210   24.797   0.0000   0.0000  233.210   24.797  ?   ?   105.671   5.6897      ?      ? 
1 1 1   21    2   26 o   74.138   3.7512  114.361   11.383  111.515   15.107  118.099   17.312   73.125   5.0091   75.151   5.5852 -2.025948 7.502363 
1 1 1   21    2   27 o  160.080   3.0431  538.383   19.838  570.060   26.542  498.294   29.859  165.605   3.8860  154.555   4.6842 11.05035 6.086251 
1 1 1   21    2   28 f   59.743   3.8357   75.372   9.3727   64.976   13.349   85.482   13.163   55.575   5.8236   63.912   4.9937 -8.336426 7.671440 
1 1 1   21    2   29 o   59.596   3.7979   74.917   9.2855   68.102   13.375   81.257   12.901   56.901   5.6991   62.290   5.0217 -5.389378 7.595831 
1 1 1   21    2   30 o   53.219   4.2525   59.708   9.2939   68.048   13.693   52.584   12.655   56.682   5.8571   49.756   6.1668 6.926208 8.505035 
1 1 1   21    2   31 o   23.133   6.7643  -1.2645   9.7861  -7.9860   11.401   17.546   19.073   16.034   7.3979   30.233   11.327 -14.19969 13.52863 
1 1 1   21    2   32 f   26.244   7.2150   6.1176   9.6760   24.251   20.988   1.2231   10.904   33.585   11.991   18.903   8.0280 14.68235 14.42995 
1 1 1   21    2   33 o   32.158   7.8166   16.410   10.014   38.422   24.570   12.025   10.966   39.837   13.005   24.479   8.6751 15.35852 15.63325 
1 1 1   21    2   34 o   96.519   3.1130  195.959   12.391  191.533   17.440  200.472   17.608   95.405   4.4320   97.632   4.3726 -2.226959 6.225968 
1 1 1   21    2   35 o   26.703   5.9111   8.1244   8.8937   33.010   14.218  -7.8727   11.399   37.494   9.2508   15.911   7.3610 21.58320 11.82213 
1 1 1   21    2   36 o   33.543   6.4974   26.819   9.2511   28.908   12.131   23.915   14.301   35.243   8.4542   31.843   9.8687 3.399326 12.99483 
1 1 1   21    2   37 o   52.969   4.5142   61.293   9.8153   53.845   13.632   69.311   14.144   49.488   6.6789   56.451   6.0748 -6.962521 9.028337 
1 1 1   21    2   38 o   51.841   4.6741   59.335   9.9291   51.220   13.830   67.968   14.264   47.980   6.9885   55.701   6.2089 -7.721169 9.348289 
1 1 1   21    2   39 o   33.288   8.1860   21.415   12.016   13.626   13.582   49.461   25.772   25.256   9.5382   41.320   13.307 -16.06354 16.37198 
1 1 1   21    2   40 f   22.498   7.2962  -4.6904   15.238  -5.2214   20.305  -4.0056   23.056   21.741   9.9729   23.255   10.653 -1.514572 14.59242 
1 1 1   21    2   41 o   33.895   9.2230   33.655   18.184   32.743   26.298   34.492   25.171   33.555   13.115   34.234   12.971 -0.6788597 18.44596 
1 1 1   21    2   42 o   41.506   14.797   60.608   31.949   0.0000   0.0000   60.608   31.949  ?   ?    41.506   14.797      ?      ? 
1 1 1   21    3    0 o   52.232   3.1485   57.542   9.4320   57.542   9.4320   57.542   9.4320   52.232   4.4527   52.232   4.4527 0.000000 0.000000 
1 1 1   21    3    1 o  306.995   2.6436  1946.59   33.470  1959.25   47.668  1934.28   47.007  307.978   3.7527  306.013   3.7244 1.965210 5.287127 
1 1 1   21    3    2 o  194.002   2.1979  777.040   17.587  776.758   24.877  777.323   24.865  193.966   3.1096  194.037   3.1070 -0.7064819E-01 4.395821 
1 1 1   21    3    3 o   71.400   2.6154  105.367   7.6933  111.332   10.899   99.443   10.861   73.418   3.5993   69.381   3.7955 4.036598 5.230705 
1 1 1   21    3    4 o  268.296   2.4660  1486.66   27.288  1481.18   38.499  1492.19   38.685  267.799   3.4855  268.792   3.4895 -0.9932861 4.932087 
1 1 1   21    3    5 o  115.503   2.1628  275.425   10.303  279.481   14.639  271.444   14.503  116.346   3.0506  114.660   3.0667 1.685760 4.325581 
1 1 1   21    3    6 f  172.079   2.1483  611.381   15.247  611.732   21.602  611.032   21.524  172.127   3.0428  172.029   3.0336 0.9786987E-01 4.296629 
1 1 1   21    3    7 f  389.412   3.0689  3133.06   49.257  3185.06   71.184  3085.29   68.229  392.497   4.3973  386.327   4.2820 6.170380 6.137715 
1 1 1   21    3    8 o  164.385   2.6592  554.203   16.839  569.732   29.900  546.990   20.378  166.005   4.3669  162.764   3.0355 3.241272 5.318337 
1 1 1   21    3    9 o  214.509   2.9630  952.795   25.684  942.829   40.502  959.499   33.217  213.518   4.5991  215.500   3.7371 -1.982788 5.926080 
1 1 1   21    3   10 o   57.588   3.2055   68.100   7.5495   65.058   9.9572   72.213   11.578   56.094   4.3038   59.082   4.7515 -2.987347 6.410905 
1 1 1   21    3   11 o  114.038   2.3599  267.417   11.010  259.615   14.572  277.793   16.805  112.119   3.1513  115.957   3.5138 -3.838120 4.719869 
1 1 1   21    3   12 o  107.484   2.4117  239.573   10.576  245.295   14.061  232.117   16.049  108.982   3.1282  105.985   3.6716 2.997307 4.823473 
1 1 1   21    3   13 o  237.861   2.3613  1168.70   23.165  1175.10   32.913  1162.42   32.609  238.506   3.3458  237.217   3.3329 1.288300 4.722616 
1 1 1   21    3   14 o  168.824   2.1795  588.594   15.175  593.416   21.596  583.891   21.328  169.506   3.0891  168.141   3.0754 1.364761 4.358966 
1 1 1   21    3   15 o  121.844   2.2080  306.633   11.095  302.188   15.641  311.134   15.742  120.955   3.1353  122.734   3.1097 -1.779015 4.415953 
1 1 1   21    3   16 o  331.645   2.9163  2269.87   38.633  2293.41   63.198  2255.82   48.816  332.901   4.6028  330.389   3.5824 2.512451 5.832568 
1 1 1   21    3   17 o  191.694   2.4024  760.536   18.568  753.437   29.482  765.203   23.905  190.910   3.7443  192.477   3.0112 -1.567245 4.804862 
1 1 1   21    3   18 o  212.669   2.7197  935.146   23.854  942.386   33.948  928.085   33.525  213.480   3.8556  211.857   3.8368 1.623184 5.439322 
1 1 1   21    3   19 o  149.243   2.5729  460.152   15.793  456.217   21.498  464.765   23.276  148.564   3.5085  149.923   3.7643 -1.359055 5.145828 
1 1 1   21    3   20 o   27.872   8.6595   6.7568   10.135   8.5143   10.381 -29.0706   46.868   22.707   8.3858   33.036   15.153 -10.32887 17.31890 
1 1 1   21    3   21 o  171.926   3.5329  611.354   25.051   0.0000   0.0000  611.354   25.051  ?   ?   171.926   3.5329      ?      ? 
1 1 1   21    3   22 o  169.937   2.6999  598.386   18.760  593.543   28.403  602.133   24.985  169.283   4.0681  170.592   3.5510 -1.308807 5.399887 
1 1 1   21    3   23 o  186.557   3.3463  723.597   25.700  768.027   36.147  678.181   36.546  192.402   4.5551  180.712   4.9033 11.69008 6.692594 
1 1 1   21    3   24 o  116.655   2.8101  282.047   13.520  281.048   18.998  283.071   19.243  116.449   3.9556  116.862   3.9925 -0.4130020 5.620184 
1 1 1   21    3   25 o   27.975   6.2031   16.575   8.5029   6.8091   13.367   23.213   11.020   23.460   9.2940   32.490   8.2180 -9.029982 12.40621 
1 1 1   21    3   26 o  153.420   2.6600  486.523   16.786  515.294   24.889  462.517   22.734  157.545   3.8303  149.295   3.6921 8.250519 5.319999 
1 1 1   21    3   27 o  112.207   4.4311  279.731   16.460  291.008   18.654  240.068   34.985  118.327   3.8222  106.086   7.9956 12.24113 8.862267 
1 1 1   21    3   28 o  164.607   3.0108  565.451   20.160  568.858   26.464  560.741   31.119  165.347   3.8806  163.866   4.6044 1.480499 6.021594 
1 1 1   21    3   29 o   39.447   6.5257   31.392   9.7644   46.396   18.186   25.315   11.574   45.234   10.012   33.660   8.3719 11.57475 13.05131 
1 1 1   21    3   30 o   45.947   4.5296   45.013   8.5645   48.546   12.142   41.515   12.082   47.798   6.1592   44.096   6.6432 3.702328 9.059118 
1 1 1   21    3   31 o   42.553   7.0433   39.754   10.662   38.694   12.063   43.536   22.793   42.480   6.8848   42.625   12.290 -0.1455765 14.08668 
1 1 1   21    3   32 o   70.261   4.4386  102.719   11.977  112.180   21.618   98.528   14.387   72.153   7.2644   68.369   5.1022 3.784683 8.877132 
1 1 1   21    3   33 o   61.344   4.1578   80.461   10.486   76.391   15.182   84.174   14.499   59.758   6.1597   62.930   5.5863 -3.171825 8.315611 
1 1 1   21    3   34 o   35.877   6.2761   29.051   9.1224   34.390   14.381   25.457   11.800   38.482   9.1878   33.271   8.5524 5.211079 12.55225 
1 1 1   21    3   35 o   51.076   4.5630   57.163   9.4527   46.896   13.604   66.749   13.145   46.323   7.1202   55.830   5.7084 -9.507229 9.125969 
1 1 1   21    3   36 o   25.903   6.4511   13.909   8.6947   9.6778   12.009   18.570   12.605   23.290   8.9270   28.516   9.3154 -5.226444 12.90225 
1 1 1   21    3   37 o   23.502   6.2288   10.761   8.1812   9.3126   11.879   12.069   11.284   22.863   8.8479   24.140   8.7697 -1.276737 12.45760 
1 1 1   21    3   38 o   29.742   6.1436   20.672   8.5513   11.180   12.055   30.285   12.132   23.778   8.9845   35.706   8.3817 -11.92838 12.28720 
1 1 1   21    3   39 f   35.279   7.9176   32.114   11.721   32.183   13.143   31.844   25.906   36.246   8.8651   34.312   13.121 1.934074 15.83514 
1 1 1   21    3   40 o   31.744   8.7774   25.225   16.365   24.089   20.822   27.061   26.466   30.983   11.784   32.505   13.012 -1.521709 17.55488 
1 1 1   21    3   41 o   37.092   9.6181   43.270   19.469   49.224   27.046   36.867   28.048   39.428   13.649   34.755   13.555 4.672985 19.23626 
1 1 1   21    3   42 o   26.684   8.9707  -2.8546   25.498 -30.4507   52.575   5.6321   29.156   27.004   13.302   26.364   12.040 0.6398220 17.94144 
1 1 1   21    4    0 o  146.085   2.1381  440.906   18.201  440.906   18.201  440.906   18.201  146.085   3.0238  146.085   3.0238 0.000000 0.000000 
1 1 1   21    4    1 o   69.097   2.6335   98.656   7.5027   96.186   10.643  101.097   10.578   68.235   3.7816   69.959   3.6661 -1.724060 5.266984 
1 1 1   21    4    2 o  228.490   2.3080  1078.05   21.750  1078.16   30.742  1077.94   30.777  228.501   3.2620  228.477   3.2661 0.2397156E-01 4.616006 
1 1 1   21    4    3 o   88.170   2.3325  160.560   8.4793  155.557   11.974  165.593   12.010   86.790   3.3449   89.550   3.2516 -2.759422 4.664910 
1 1 1   21    4    4 o  295.208   2.5853  1800.25   31.478  1802.66   44.571  1797.85   44.461  295.405   3.6582  295.011   3.6541 0.3937683 5.170602 
1 1 1   21    4    5 o  169.036   2.1484  589.918   14.978  585.506   21.071  594.423   21.293  168.398   3.0338  169.675   3.0427 -1.276901 4.296755 
1 1 1   21    4    6 o  125.206   2.1482  323.639   11.092  326.263   15.827  321.105   15.550  125.704   3.0528  124.708   3.0232 0.9961472 4.296399 
1 1 1   21    4    7 o  329.750   2.9778  2246.26   40.035  2256.48   61.508  2238.75   52.734  330.343   4.5144  329.157   3.8844 1.186096 5.955518 
1 1 1   21    4    8 o   50.614   3.8839   49.652   7.5743   62.623   13.981   44.264   9.0111   54.967   6.1672   46.261   4.7228 8.706406 7.767810 
1 1 1   21    4    9 o  226.065   3.0200  1052.20   27.445  1075.77   44.281  1037.50   34.972  228.051   4.7078  224.078   3.7840 3.972977 6.040082 
1 1 1   21    4   10 o  113.534   2.3856  265.545   11.023  261.972   14.416  270.576   17.105  112.631   3.1032  114.437   3.6240 -1.805794 4.771101 
1 1 1   21    4   11 o  265.603   2.6584  1458.82   28.852  1464.95   38.333  1450.81   43.823  266.285   3.4903  264.921   4.0107 1.364716 5.316705 
1 1 1   21    4   12 o   75.564   2.7209  118.367   8.4051  120.827   11.233  115.238   12.670   76.471   3.5614   74.658   4.1146 1.813515 5.441877 
1 1 1   21    4   13 o  241.531   2.3713  1205.01   23.620  1195.80   33.163  1214.50   33.650  240.596   3.3420  242.467   3.3649 -1.870926 4.742517 
1 1 1   21    4   14 o  148.267   2.1752  453.711   13.297  469.354   19.084  438.949   18.538  150.749   3.0693  145.784   3.0831 4.965652 4.350383 
1 1 1   21    4   15 o  129.667   2.1867  347.258   11.692  356.065   16.602  338.590   16.470  131.299   3.0657  128.034   3.1189 3.265869 4.373370 
1 1 1   21    4   16 o  114.732   2.5769  270.216   12.107  286.861   18.460  257.653   16.038  117.800   3.7995  111.664   3.4823 6.136742 5.153892 
1 1 1   21    4   17 o  187.819   2.7161  729.201   19.920  729.886   34.209  728.850   24.503  187.807   4.4163  187.831   3.1629 -0.2420044E-01 5.432127 
1 1 1   21    4   18 o  117.052   2.8201  283.403   13.589  282.954   19.830  283.800   18.657  116.954   4.1110  117.150   3.8614 -0.1959610 5.640120 
1 1 1   21    4   19 o  246.626   3.3551  1271.01   33.127  1309.28   42.417  1211.17   53.042  251.565   4.0882  241.686   5.3211 9.878220 6.710250 
1 1 1   21    4   20 o  143.093   3.2119  418.148   17.165  410.246   20.253  438.300   32.342  140.858   3.4861  145.327   5.3957 -4.469467 6.423875 
1 1 1   21    4   21 o  218.166   2.7911  986.220   24.726  979.547   38.430  990.933   32.299  217.463   4.2846  218.870   3.5780 -1.406158 5.582150 
1 1 1   21    4   22 o  148.267   3.1642  454.709   19.316  494.206   28.024  418.960   26.661  154.399   4.4007  142.134   4.5479 12.26448 6.328471 
1 1 1   21    4   23 o  137.374   2.8986  390.859   16.064  392.251   25.544  389.948   20.660  137.506   4.5040  137.242   3.6499 0.2644501 5.797234 
1 1 1   21    4   24 o   27.067   6.1876   14.499   9.0085  -2.0687   14.969   23.906   11.280   21.100   9.1866   33.033   8.2918 -11.93241 12.37528 
1 1 1   21    4   25 o  128.856   3.2018  345.638   16.138  344.427   27.569  346.270   19.905  128.509   5.2014  129.203   3.7353 -0.6943665 6.403620 
1 1 1   21    4   26 o   48.495   4.3614   49.407   8.7051   48.806   12.684   49.942   11.969   48.186   6.3821   48.804   5.9461 -0.6185760 8.722829 
1 1 1   21    4   27 o   97.498   3.1561  198.227   12.547  198.386   16.555  198.011   19.234   97.625   4.1114   97.371   4.7894 0.2538071 6.312106 
1 1 1   21    4   28 o   72.367   3.4351  110.081   10.196   99.143   14.641  120.382   14.208   68.794   5.1599   75.940   4.5361 -7.146019 6.870278 
1 1 1   21    4   29 o  109.515   2.7982  249.887   12.639  247.469   17.808  252.342   17.940  108.980   3.9619  110.050   3.9525 -1.070328 5.596375 
1 1 1   21    4   30 o   46.265   6.0029   45.002   10.230   41.597   12.058   53.750   19.327   44.137   6.6235   48.393   10.013 -4.255585 12.00584 
1 1 1   21    4   31 o   36.933   5.8734   31.302   8.7872   37.667   12.107   24.217   12.774   41.251   7.3872   32.616   9.1332 8.634357 11.74670 
1 1 1   21    4   32 o   26.902   7.0587   10.054   9.2660   23.686   18.995   5.7975   10.615   32.938   11.436   20.865   8.2771 12.07280 14.11739 
1 1 1   21    4   33 f   71.396   3.6250  107.337   10.640  115.100   15.843  100.958   14.361   73.704   5.2118   69.088   5.0399 4.616531 7.250075 
1 1 1   21    4   34 o   76.483   3.7477  125.309   11.688  114.797   17.406  133.942   15.773   73.338   5.7543   79.627   4.8028 -6.289047 7.495323 
1 1 1   21    4   35 o   81.213   3.4699  139.973   11.611  138.474   16.739  141.363   16.120   80.738   5.0267   81.688   4.7847 -0.9501190 6.939815 
1 1 1   21    4   36 o   47.043   5.1507   49.937   9.5047   37.790   13.358   62.394   13.527   40.401   8.2942   53.684   6.1093 -13.28375 10.30136 
1 1 1   21    4   37 o   25.610   6.2569   13.343   8.5726   5.1036   12.021   21.869   12.228   20.901   8.6189   30.319   9.0726 -9.418131 12.51385 
1 1 1   21    4   38 o   26.458   7.1166   14.934   10.560   18.314   12.241   5.0996   20.881   27.885   9.1834   25.032   10.874 2.852997 14.23311 
1 1 1   21    4   39 o   24.255   7.4152   2.5324   11.003  -1.9307   12.281   20.698   24.776   18.060   8.0689   30.449   12.443 -12.38873 14.83044 
1 1 1   21    4   40 o   54.661   8.1049   79.249   17.388   79.117   22.445   79.447   27.497   56.044   10.081   53.278   12.694 2.765442 16.20981 
1 1 1   21    4   41 f   25.768   8.7783 -10.1379   23.161  -9.7812   49.802 -10.2364   26.162   28.767   13.894   22.770   10.733 5.997019 17.55656 
1 1 1   21    4   42 o   32.304   10.341   23.639   25.749   57.495   51.763   12.508   29.681   36.816   16.499   27.791   12.471 9.024813 20.68196 
1 1 1   21    4   43 o   29.828   12.804   25.708   28.276   0.0000   0.0000   25.708   28.276  ?   ?    29.828   12.804      ?      ? 
1 1 1   21    5    0 o  166.931   2.1487  575.564   20.906  575.564   20.906  575.564   20.906  166.931   3.0387  166.931   3.0387 0.000000 0.000000 
1 1 1   21    5    1 f  120.420   2.1640  299.383   10.748  302.441   15.266  296.377   15.134  121.030   3.0581  119.810   3.0627 1.219818 4.328046 
1 1 1   21    5    2 o  159.999   2.1368  528.436   14.099  520.280   19.771  536.876   20.111  158.744   3.0198  161.255   3.0239 -2.511673 4.273509 
1 1 1   21    5    3 f   63.993   2.6988   84.721   7.1115   89.953   10.029   79.430   10.085   65.987   3.6850   61.999   3.9441 3.987785 5.397690 
1 1 1   21    5    4 o   96.148   2.2745  190.904   9.0194  191.716   12.737  190.087   12.774   96.354   3.2050   95.943   3.2281 0.4110870 4.548914 
1 1 1   21    5    5 o  212.153   2.2551  929.296   19.731  918.721   27.691  940.201   28.120  210.928   3.1831  213.378   3.1952 -2.450439 4.510145 
1 1 1   21    5    6 o  118.229   2.3414  288.126   11.266  292.014   17.462  285.354   14.745  118.897   3.5609  117.560   3.0410 1.337166 4.682704 
1 1 1   21    5    7 o  112.950   2.7825  269.975   12.080  245.604   20.853  282.282   14.819  108.976   4.6396  116.924   3.0729 -7.947723 5.564935 
1 1 1   21    5    8 o   42.892   5.0435   42.844   7.6655   29.944   13.576   48.881   9.2876   37.169   8.9606   48.615   4.6320 -11.44601 10.08700 
1 1 1   21    5    9 o  169.495   2.5412  593.396   17.762  578.716   24.921  608.551   25.322  167.364   3.6103  171.627   3.5773 -4.262787 5.082401 
1 1 1   21    5   10 o  236.987   2.5513  1161.55   24.685  1168.43   32.719  1152.47   37.607  237.835   3.3355  236.139   3.8614 1.695114 5.102526 
1 1 1   21    5   11 o  213.173   2.4576  939.350   21.397  942.572   28.378  935.104   32.574  213.624   3.2209  212.721   3.7128 0.9026031 4.915139 
1 1 1   21    5   12 o  119.560   2.3650  294.881   11.560  292.249   15.335  298.346   17.595  118.956   3.1256  120.164   3.5501 -1.208527 4.729950 
1 1 1   21    5   13 o  126.354   2.4714  329.957   12.874  333.349   18.013  326.415   18.408  127.022   3.4382  125.686   3.5510 1.335739 4.942737 
1 1 1   21    5   14 o  201.460   2.4024  839.489   19.828  830.115   29.725  847.003   26.615  200.423   3.5959  202.496   3.1867 -2.073975 4.804771 
1 1 1   21    5   15 o  105.616   2.2640  230.016   9.8454  211.970   13.641  249.640   14.225  101.295   3.2650  109.936   3.1372 -8.640366 4.527925 
1 1 1   21    5   16 o  236.112   2.5079  1149.33   23.714  1163.76   38.562  1140.56   30.072  237.241   3.9409  234.983   3.1029 2.258270 5.015858 
1 1 1   21    5   17 o  254.503   2.8424  1329.53   29.708  1233.10   39.818  1450.61   44.616  244.184   3.9536  264.822   4.0848 -20.63760 5.684787 
1 1 1   21    5   18 o  170.951   2.5339  604.803   17.818  593.855   26.042  614.439   24.432  169.478   3.7256  172.423   3.4355 -2.945435 5.067852 
1 1 1   21    5   19 o   52.329   5.4338   54.758   10.556   51.894   12.321   62.662   20.468   49.985   5.9762   54.673   9.0769 -4.687988 10.86765 
1 1 1   21    5   20 o   47.883   4.7408   49.173   8.9178   37.950   12.712   60.048   12.513   41.997   7.6197   53.768   5.6426 -11.77091 9.481538 
1 1 1   21    5   21 o   34.115   6.7389   25.140   9.3993   24.310   16.856   25.514   11.323   34.010   10.741   34.220   8.1411 -0.2094154 13.47780 
1 1 1   21    5   22 f   23.529   6.0610   9.1189   7.8366   4.4458   11.238   13.543   10.934   21.027   8.4573   26.031   8.6844 -5.004051 12.12208 
1 1 1   21    5   23 o   48.365   4.5181   49.113   8.9348   46.300   13.310   51.420   12.054   47.052   6.8585   49.677   5.8834 -2.624741 9.036189 
1 1 1   21    5   24 o   46.000   5.5815   50.477   9.6100   24.108   14.369   71.815   12.926   33.293   9.8039   58.708   5.3383 -25.41437 11.16306 
1 1 1   21    5   25 o  125.044   2.7725  323.490   14.269  341.201   21.031  308.381   19.424  128.193   3.9776  121.895   3.8635 6.298004 5.545071 
1 1 1   21    5   26 o  117.409   2.7830  286.861   13.444  279.754   19.567  293.215   18.502  115.994   4.0900  118.824   3.7753 -2.829880 5.566020 
1 1 1   21    5   27 o   56.327   4.2654   67.484   9.7502   71.427   12.938   62.301   14.834   58.370   5.3741   54.284   6.6254 4.085899 8.530882 
1 1 1   21    5   28 o   82.753   3.1612  142.688   10.778  133.938   14.962  152.129   15.541   80.107   4.5284   85.400   4.4121 -5.292847 6.322432 
1 1 1   21    5   29 o   46.616   4.6221   46.330   8.8501   42.043   12.604   50.500   12.430   44.407   6.8818   48.825   6.1723 -4.418659 9.244261 
1 1 1   21    5   30 o   87.218   4.1720  159.448   13.320  157.268   15.560  165.427   25.769   86.662   4.3533   87.773   7.1183 -1.110962 8.343925 
1 1 1   21    5   31 o   31.031   6.1535   21.791   8.1944   21.326   11.652   22.246   11.526   30.721   8.7654   31.341   8.6388 -0.6193810 12.30694 
1 1 1   21    5   32 o   25.609   6.5100   12.383   9.7584  -8.7181   18.680   20.302   11.444   21.203   9.6653   30.015   8.7238 -8.811996 13.02008 
1 1 1   21    5   33 o   49.146   4.8592   53.972   9.2553   39.255   13.215   68.141   12.967   41.702   7.9739   56.589   5.5555 -14.88688 9.718351 
1 1 1   21    5   34 o   68.884   4.2226  100.210   11.675  107.848   19.092   95.648   14.755   70.692   6.5480   67.077   5.3333 3.614822 8.445168 
1 1 1   21    5   35 o   35.649   5.6714   29.572   8.4601   19.036   12.282   39.085   11.670   28.880   9.1740   42.417   6.6706 -13.53787 11.34280 
1 1 1   21    5   36 o   29.637   6.0385   20.035   8.7001   7.1513   12.591   31.805   12.035   22.254   8.9517   37.020   8.1068 -14.76639 12.07692 
1 1 1   21    5   37 o   61.193   4.3554   80.805   10.919   69.504   14.659   94.889   16.364   56.359   6.3062   66.027   6.0091 -9.667736 8.710818 
1 1 1   21    5   38 o   51.073   7.4108   67.206   12.898   69.369   14.687   59.915   26.969   56.067   6.3513   46.079   13.392 9.988003 14.82160 
1 1 1   21    5   39 o   37.243   7.1311   40.185   12.086   47.493   13.673   14.080   25.843   45.754   7.2458   28.733   12.284 17.02076 14.26216 
1 1 1   21    5   40 o   22.083   7.1705 -11.3691   15.428 -29.1791   20.893   9.9907   22.880   17.685   8.6442   26.480   11.443 -8.795454 14.34095 
1 1 1   21    5   41 o   31.922   9.9859   25.961   24.126   15.651   54.044   28.527   26.962   31.908   15.155   31.936   13.008 -0.2827072E-01 19.97170 
1 1 1   21    5   42 o   25.475   8.6383  -8.3705   24.891 -35.9418   49.826   0.7987   28.734   25.804   12.756   25.146   11.652 0.6581249 17.27652 
1 1 1   21    5   43 o   36.922   13.931   49.949   28.956   0.0000   0.0000   49.949   28.956  ?   ?    36.922   13.931      ?      ? 
1 1 1   21    6    0 o   53.606   3.0688   60.488   9.4507   60.488   9.4507   60.488   9.4507   53.606   4.3400   53.606   4.3400 0.000000 0.000000 
1 1 1   21    6    1 o  110.997   2.1946  254.395   10.047  256.092   14.215  252.702   14.201  111.367   3.0948  110.627   3.1125 0.7405167 4.389266 
1 1 1   21    6    2 o  160.084   2.1377  529.012   14.113  521.456   19.783  536.842   20.139  158.921   3.0181  161.247   3.0281 -2.326920 4.275338 
1 1 1   21    6    3 o  224.725   2.2951  1042.89   21.273  1039.81   30.021  1046.00   30.148  224.392   3.2437  225.059   3.2478 -0.6666718 4.590244 
1 1 1   21    6    4 o  123.635   2.1541  315.517   10.981  326.226   15.665  305.171   15.397  125.699   3.0216  121.572   3.0708 4.126427 4.308105 
1 1 1   21    6    5 o  120.314   2.1692  298.913   10.762  290.799   15.193  307.085   15.247  118.673   3.1039  121.954   3.0312 -3.281273 4.338482 
1 1 1   21    6    6 o  218.521   2.4586  984.594   21.890  997.423   33.784  975.310   28.739  219.720   3.7280  217.323   3.2063 2.396896 4.917118 
1 1 1   21    6    7 o  205.551   2.5988  872.826   22.030  879.357   31.428  866.517   30.889  206.305   3.6935  204.797   3.6569 1.507965 5.197584 
1 1 1   21    6    8 o   72.304   3.3004  106.603   9.0320  112.024   16.645  104.341   10.753   73.546   5.4874   71.063   3.6686 2.482788 6.600760 
1 1 1   21    6    9 o  187.316   2.8431  727.270   21.590  714.427   33.640  736.265   28.153  185.863   4.3883  188.769   3.6160 -2.905258 5.686145 
1 1 1   21    6   10 o  131.307   2.3520  354.367   12.568  345.626   16.390  366.838   19.578  129.368   3.0718  133.246   3.5625 -3.878052 4.703965 
1 1 1   21    6   11 o  179.598   2.3734  669.026   17.448  691.015   23.510  642.065   26.033  182.918   3.1163  176.279   3.5806 6.639236 4.746740 
1 1 1   21    6   12 o   86.330   2.5437  152.933   9.0002  145.104   11.957  163.169   13.671   83.805   3.4592   88.855   3.7304 -5.050209 5.087464 
1 1 1   21    6   13 o  124.738   2.3584  321.263   11.985  320.282   15.753  322.611   18.467  124.529   3.0671  124.947   3.5836 -0.4175797 4.716854 
1 1 1   21    6   14 o   25.129   5.2430   13.104   6.0418   7.9521   8.6147   18.092   8.4758   21.326   7.6748   28.932   7.1453 -7.605354 10.48609 
1 1 1   21    6   15 o  100.941   2.5411  210.788   10.323  209.596   16.490  211.557   13.239  100.683   3.9711  101.201   3.1717 -0.5179443 5.082266 
1 1 1   21    6   16 o  124.931   2.4128  323.491   12.045  318.604   19.559  326.477   15.288  124.136   3.8203  125.726   2.9481 -1.589676 4.825541 
1 1 1   21    6   17 o  130.473   2.8017  345.048   13.426  367.525   26.102  336.962   15.655  133.222   4.7503  127.724   2.9719 5.498772 5.603376 
1 1 1   21    6   18 o  182.400   2.5679  688.601   19.289  670.889   27.837  704.961   26.753  180.126   3.7469  184.674   3.5124 -4.547256 5.135803 
1 1 1   21    6   19 o  109.089   3.4726  241.638   14.151  235.086   16.668  258.552   26.780  106.607   3.7908  111.572   5.8195 -4.964767 6.945210 
1 1 1   21    6   20 o  135.793   2.5554  381.354   14.309  392.173   20.389  370.854   20.087  137.693   3.5902  133.893   3.6374 3.800339 5.110801 
1 1 1   21    6   21 o   91.336   3.5501  178.843   12.742  152.246   20.572  195.397   16.230   85.541   5.8309   97.131   4.0514 -11.58956 7.100225 
1 1 1   21    6   22 f  166.025   3.3334  575.050   22.699  533.956   33.101  611.530   31.187  160.329   5.0056  171.720   4.4033 -11.39186 6.666774 
1 1 1   21    6   23 o  131.845   3.2700  365.964   16.599  346.395   28.866  375.632   20.289  129.009   5.4250  134.681   3.6526 -5.671783 6.539997 
1 1 1   21    6   24 f   85.851   3.0932  153.133   10.948  147.215   15.400  159.180   15.567   84.165   4.4363   87.537   4.3117 -3.372131 6.186346 
1 1 1   21    6   25 o  114.231   3.6013  271.997   16.960  281.435   24.376  263.141   23.613  116.151   5.0884  112.310   5.0975 3.840897 7.202519 
1 1 1   21    6   26 o  151.421   2.7538  476.095   17.180  446.102   23.926  508.022   24.685  146.482   3.9602  156.359   3.8278 -9.877396 5.507698 
1 1 1   21    6   27 o  148.664   3.0982  465.992   18.676  493.671   24.728  429.241   28.494  154.035   3.8923  143.293   4.8213 10.74168 6.196379 
1 1 1   21    6   28 o  132.214   2.9017  358.588   15.540  336.587   19.918  392.813   24.843  127.206   3.7964  137.222   4.3895 -10.01604 5.803479 
1 1 1   21    6   29 o   86.828   4.0064  170.150   13.143  194.464   16.452  127.271   21.848   96.478   4.1345   77.179   6.8636 19.29857 8.012733 
1 1 1   21    6   30 o   18.916   6.1464  -6.4334   9.0254  -6.7737   10.221  -5.2287   19.231   15.345   7.0526   22.488   10.069 -7.142252 12.29290 
1 1 1   21    6   31 o   25.257   6.0217   12.776   7.8314   5.9929   11.328   18.985   10.838   21.413   8.5330   29.101   8.4989 -7.688311 12.04338 
1 1 1   21    6   32 o   56.523   4.0461   68.400   9.3425   59.316   13.440   76.893   12.995   52.726   6.1804   60.321   5.2235 -7.595028 8.092126 
1 1 1   21    6   33 o   31.171   6.2085   23.080   9.2603   7.8403   14.614   33.304   11.970   23.953   9.6408   38.389   7.8256 -14.43622 12.41708 
1 1 1   21    6   34 f   78.873   3.5551  131.908   11.502  132.378   17.189  131.528   15.478   78.887   5.2829   78.860   4.7588 0.2629852E-01 7.110204 
1 1 1   21    6   35 o   80.852   3.3615  138.693   11.194  133.840   16.059  143.279   15.613   79.406   4.9034   82.299   4.5996 -2.893089 6.723085 
1 1 1   21    6   36 o   96.773   3.1937  197.947   12.698  207.974   18.969  189.805   17.094   98.902   4.6502   94.644   4.3790 4.257538 6.387483 
1 1 1   21    6   37 o   63.570   4.1857   86.451   10.883   75.571   14.352  101.174   16.695   58.951   5.9029   68.190   5.9362 -9.238873 8.371497 
1 1 1   21    6   38 o   23.994   7.3152   4.8125   10.416   2.7352   11.505   14.250   24.523   19.345   8.2317   28.644   12.095 -9.298538 14.63038 
1 1 1   21    6   39 o   24.103   7.1278   8.9225   10.734   10.287   12.205   4.2673   22.546   23.118   8.9626   25.087   11.086 -1.968807 14.25564 
1 1 1   21    6   40 o   28.029   8.2890   15.641   16.233   20.622   21.449   8.9646   24.834   29.414   11.735   26.644   11.710 2.770264 16.57810 
1 1 1   21    6   41 o   44.157   10.453   66.408   22.350   72.500   33.065   61.283   30.328   45.663   15.096   42.652   14.463 3.010788 20.90571 
1 1 1   21    6   42 o   39.863   11.287   62.951   26.405   82.352   54.381   56.967   30.204   39.772   17.407   39.955   14.372 -0.1827927 22.57337 
1 1 1   21    6   43 o   16.655   8.3642 -52.8997   25.317   0.0000   0.0000 -52.8997   25.317  ?   ?    16.655   8.3642      ?      ? 
1 1 1   21    7    0 o   29.329   5.8156   21.498   8.6108   21.498   8.6108   21.498   8.6108   29.329   8.2245   29.329   8.2245 0.000000 0.000000 
1 1 1   21    7    1 o  143.382   2.1298  424.440   12.594  420.825   17.727  428.125   17.897  142.766   3.0105  143.998   3.0134 -1.232727 4.259558 
1 1 1   21    7    2 o  240.593   2.5498  1196.24   25.038  1199.08   33.131  1192.45   38.235  240.956   3.3337  240.229   3.8590 0.7270050 5.099508 
1 1 1   21    7    3 o  188.232   2.3651  731.754   18.166  731.722   24.007  731.797   27.788  188.248   3.0920  188.217   3.5796 0.3089905E-01 4.730136 
1 1 1   21    7    4 o  225.760   2.4777  1051.09   22.825  1064.34   35.024  1041.31   30.093  226.969   3.7414  224.552   3.2493 2.417007 4.955411 
1 1 1   21    7    5 o  154.232   2.5875  491.645   15.576  490.814   26.759  492.071   19.155  154.088   4.2106  154.376   3.0085 -0.2877197 5.174905 
1 1 1   21    7    6 o  129.713   2.3284  347.731   12.319  345.952   18.854  349.057   16.273  129.409   3.5324  130.018   3.0345 -0.6088867 4.656852 
1 1 1   21    7    7 o  224.037   2.8396  1041.26   24.722  1026.19   42.708  1048.85   30.317  222.725   4.6491  225.349   3.2619 -2.624268 5.679277 
1 1 1   21    7    8 o   25.027   5.5741   12.823   6.3409   12.747   10.053   12.873   8.1711   25.292   8.3221   24.762   7.4178 0.5304222 11.14814 
1 1 1   21    7    9 o  342.447   3.2719  2426.14   46.211  2431.00   65.622  2421.35   65.087  342.784   4.6415  342.110   4.6128 0.6742554 6.543808 
1 1 1   21    7   10 o   68.289   2.8981   98.491   7.9632  108.862   10.543   84.717   12.150   72.588   3.5216   63.991   4.6037 8.596371 5.796173 
1 1 1   21    7   11 o  217.508   2.4816  975.306   21.945  964.774   28.639  990.286   34.154  216.122   3.2129  218.893   3.7831 -2.771484 4.963296 
1 1 1   21    7   12 o  150.168   2.4936  465.642   15.439  452.562   21.501  479.564   22.183  147.993   3.5225  152.344   3.5304 -4.350342 4.987134 
1 1 1   21    7   13 o  139.075   2.8507  389.315   15.763  439.045   26.684  362.660   19.535  145.676   4.4411  132.474   3.5754 13.20262 5.701492 
1 1 1   21    7   14 o  201.539   2.4651  834.036   20.091  813.420   25.829  865.623   31.971  198.442   3.1558  204.636   3.7879 -6.194672 4.930238 
1 1 1   21    7   15 o  155.859   2.3405  503.483   14.745  493.796   23.176  510.070   19.113  154.565   3.6354  157.153   2.9487 -2.587387 4.680942 
1 1 1   21    7   16 o  123.464   2.4089  315.837   11.994  311.044   19.001  319.012   15.464  122.656   3.7560  124.273   3.0170 -1.617302 4.817725 
1 1 1   21    7   17 o   22.405   5.5250   6.4880   6.6472   16.771   10.693   0.0117   8.4860   28.205   8.4939   16.606   7.0681 11.59851 11.05002 
1 1 1   21    7   18 o   65.033   3.3103   87.766   8.7202   86.703   13.642   88.501   11.339   64.671   5.1145   65.394   4.2042 -0.7225494 6.620643 
1 1 1   21    7   19 o  103.305   3.1016  220.046   12.828  217.011   16.237  225.086   20.923  102.413   3.8441  104.197   4.8686 -1.783958 6.203245 
1 1 1   21    7   20 o   57.963   3.7654   69.618   8.9909   72.934   13.117   66.678   12.348   59.259   5.3666   56.667   5.2833 2.592548 7.530865 
1 1 1   21    7   21 o  116.960   4.0515  307.927   16.502  240.130   31.882  332.737   19.286  107.136   7.2150  126.784   3.6883 -19.64750 8.103086 
1 1 1   21    7   22 o   22.341   6.5654   2.5441   9.3109   6.0364   16.749   0.9822   11.201   25.289   10.271   19.392   8.1806 5.897537 13.13071 
1 1 1   21    7   23 o  106.796   3.4777  236.940   14.541  237.919   24.843  236.430   17.933  106.824   5.6385  106.768   4.0725 0.5651855E-01 6.955386 
1 1 1   21    7   24 o   45.422   4.8104   42.902   8.9599   48.100   13.581   38.895   11.923   47.821   6.8857   43.023   6.7192 4.798405 9.620832 
1 1 1   21    7   25 o  163.574   2.5380  554.484   17.111  572.704   24.770  537.855   23.664  166.134   3.6150  161.014   3.5634 5.119858 5.076035 
1 1 1   21    7   26 o   80.493   3.1817  135.082   10.557  135.837   15.194  134.378   14.680   80.697   4.5650   80.289   4.4331 0.4085388 6.363312 
1 1 1   21    7   27 o  128.725   2.6999  344.528   14.306  347.053   20.931  342.314   19.599  129.135   3.9299  128.315   3.7033 0.8192139 5.399827 
1 1 1   21    7   28 o  105.926   3.1162  232.055   13.448  220.856   17.521  248.111   20.979  102.925   4.1274  108.926   4.6698 -6.001160 6.232335 
1 1 1   21    7   29 o   49.149   4.4343   51.558   8.9554   54.460   12.400   48.394   12.947   50.678   5.9326   47.619   6.5922 3.058990 8.868643 
1 1 1   21    7   30 o  101.562   3.7753  206.626   14.404  192.031   16.898  245.417   27.548   95.765   4.2783  107.359   6.2215 -11.59427 7.550529 
1 1 1   21    7   31 o   18.369   5.3678  -0.9257   7.3776 -11.5451   10.632   8.9352   10.245   14.344   6.7860   22.394   8.3189 -8.050786 10.73564 
1 1 1   21    7   32 o   76.989   3.4067  125.197   10.798  120.374   15.540  129.698   15.014   75.491   4.9910   78.487   4.6381 -2.995949 6.813368 
1 1 1   21    7   33 o   37.449   8.1531   34.298   11.724   21.733   32.607   36.163   12.564   34.887   14.268   40.011   7.8940 -5.123814 16.30620 
1 1 1   21    7   34 o   36.290   6.0746   29.983   8.8861   35.032   13.701   26.316   11.675   38.852   8.7594   33.728   8.4189 5.123772 12.14925 
1 1 1   21    7   35 o   87.121   3.2341  160.651   11.621  160.725   16.494  160.578   16.374   87.133   4.5897   87.108   4.5576 0.2418518E-01 6.468159 
1 1 1   21    7   36 o   29.039   5.8072   18.766   8.6658   1.9430   12.686   33.483   11.866   20.026   8.5857   38.052   7.8218 -18.02520 11.61446 
1 1 1   21    7   37 o   29.401   6.1393   20.207   8.8394   31.057   12.105   7.8115   12.939   36.266   8.2753   22.536   9.0710 13.73008 12.27860 
1 1 1   21    7   38 o   27.254   7.6959   12.391   10.741   9.3707   11.952   25.075   24.492   22.581   8.8370   31.928   12.602 -9.346783 15.39176 
1 1 1   21    7   39 o   27.122   7.4591   16.114   10.988   18.080   12.245   7.9906   24.897   27.452   9.1905   26.793   11.751 0.6591854 14.91828 
1 1 1   21    7   40 o   27.628   8.1292   8.6658   12.170   2.3377   13.433   37.645   28.746   20.037   8.7131   35.219   13.726 -15.18164 16.25836 
1 1 1   21    7   41 o   33.243   9.5861   33.059   21.116   23.904   30.991   40.993   28.849   30.810   13.316   35.677   13.794 -4.866879 19.17213 
1 1 1   21    7   42 o   32.124   10.259   27.183   24.285   61.665   53.261   18.132   27.287   36.094   16.402   28.154   12.326 7.939442 20.51717 
1 1 1   21    7   43 o   34.268   13.848   43.430   30.286   0.0000   0.0000   43.430   30.286  ?   ?    34.268   13.848      ?      ? 
1 1 1   21    8    0 o  146.238   2.4415  442.109   20.799  442.109   20.799  442.109   20.799  146.238   3.4527  146.238   3.4527 0.000000 0.000000 
1 1 1   21    8    1 o   55.979   2.9628   64.773   6.8403   65.329   9.7056   64.224   9.6421   56.217   4.1859   55.740   4.1941 0.4774742 5.925565 
1 1 1   21    8    2 o  130.648   2.3198  352.846   12.346  350.363   18.975  354.670   16.259  130.234   3.5326  131.062   3.0077 -0.8286285 4.639613 
1 1 1   21    8    3 o  175.493   2.1654  635.935   15.673  629.247   22.126  642.670   22.204  174.566   3.0731  176.420   3.0516 -1.853714 4.330805 
1 1 1   21    8    4 o  144.106   2.2966  430.745   13.531  413.593   20.302  444.453   18.149  141.498   3.4788  146.714   2.9993 -5.215759 4.593194 
1 1 1   21    8    5 o   40.669   3.9860   33.946   6.5972   36.165   10.330   32.416   8.5735   41.769   5.9962   39.569   5.2534 2.200409 7.971940 
1 1 1   21    8    6 f  122.505   2.3237  310.358   11.610  307.405   17.752  312.564   15.347  121.980   3.5286  123.030   3.0244 -1.049324 4.647392 
1 1 1   21    8    7 f  135.141   2.3474  375.924   12.873  384.524   20.195  370.037   16.708  136.419   3.5892  133.862   3.0262 2.557129 4.694708 
1 1 1   21    8    8 o   80.523   3.2860  131.899   10.655  144.273   17.343  124.396   13.504   83.483   5.0369   77.563   4.2214 5.919983 6.571910 
1 1 1   21    8    9 o  328.423   2.9807  2230.60   39.969  2232.10   52.920  2228.61   60.983  328.614   3.9045  328.231   4.5047 0.3829956 5.961315 
1 1 1   21    8   10 o  172.022   2.3613  611.377   16.567  611.806   21.866  610.799   25.385  172.115   3.0803  171.930   3.5798 0.1858673 4.722613 
1 1 1   21    8   11 o  219.945   2.6536  999.835   24.070  1020.94   34.150  979.000   33.930  222.255   3.7254  217.635   3.7800 4.620193 5.307245 
1 1 1   21    8   12 o  245.736   2.3948  1245.65   24.244  1208.19   33.339  1287.70   35.320  241.827   3.3426  249.645   3.4303 -7.819016 4.789567 
1 1 1   21    8   13 o  201.026   2.4405  835.808   20.023  840.634   26.512  829.401   30.548  201.731   3.1864  200.321   3.6974 1.410309 4.880937 
1 1 1   21    8   14 o  199.523   2.5245  823.749   20.714  808.595   30.324  837.007   28.363  197.782   3.7173  201.264   3.4168 -3.481476 5.049017 
1 1 1   21    8   15 o  166.979   2.3360  578.008   15.780  566.210   24.731  586.110   20.494  165.504   3.6229  168.454   2.9498 -2.950104 4.671921 
1 1 1   21    8   16 o  143.108   2.3493  423.461   13.596  421.887   21.426  424.523   17.592  142.857   3.6365  143.360   2.9752 -0.5034485 4.698511 
1 1 1   21    8   17 o  150.679   2.3579  469.629   14.325  467.247   22.769  471.190   18.429  150.328   3.6724  151.030   2.9585 -0.7020874 4.715843 
1 1 1   21    8   18 o   32.341   5.8817   22.722   7.8930   23.524   11.086   21.899   11.240   32.898   8.1995   31.783   8.4346 1.115021 11.76332 
1 1 1   21    8   19 o   77.283   3.1938  123.618   10.170  116.095   14.139  131.682   14.639   74.844   4.5802   79.721   4.4522 -4.877075 6.387505 
1 1 1   21    8   20 o  213.329   2.5206  941.662   22.177  938.943   31.401  944.368   31.326  213.020   3.5741  213.639   3.5552 -0.6182404 5.041137 
1 1 1   21    8   21 o  116.830   2.6702  282.710   12.862  279.611   18.368  285.691   18.017  116.194   3.8328  117.466   3.7188 -1.271278 5.340397 
1 1 1   21    8   22 o   98.014   3.3892  206.464   13.010  174.819   21.122  225.806   16.514   91.626   5.5892  104.401   3.8351 -12.77495 6.778447 
1 1 1   21    8   23 o  179.906   3.5488  679.768   23.976  659.726   43.870  688.304   28.630  177.630   5.9881  182.181   3.8103 -4.551041 7.097581 
1 1 1   21    8   24 o   79.014   3.3588  130.135   10.893  128.917   16.180  131.145   14.730   78.635   4.9889   79.393   4.4985 -0.7573395 6.717564 
1 1 1   21    8   25 o  132.108   2.6106  362.297   14.219  348.202   19.943  376.870   20.278  129.485   3.7342  134.731   3.6492 -5.246307 5.221200 
1 1 1   21    8   26 o   35.383   5.5315   28.127   8.1603   17.023   11.826   38.221   11.275   28.223   9.0057   42.543   6.4257 -14.31979 11.06309 
1 1 1   21    8   27 o   84.593   3.1627  148.949   11.019  156.514   16.107  142.293   15.108   86.599   4.5096   82.587   4.4355 4.011711 6.325338 
1 1 1   21    8   28 o  106.046   3.1124  236.007   13.464  241.298   17.891  229.098   20.445  107.539   4.0338  104.553   4.7410 2.985878 6.224864 
1 1 1   21    8   29 o   26.883   7.0821   3.4146   9.8891  -4.8133   11.255   31.277   20.711   16.916   7.6274   36.850   11.935 -19.93354 14.16421 
1 1 1   21    8   30 o   83.257   3.1945  145.435   10.969  147.479   15.552  143.411   15.473   83.845   4.4972   82.668   4.5381 1.177299 6.389032 
1 1 1   21    8   31 f   73.355   3.4359  113.325   10.384  110.563   14.911  115.925   14.471   72.447   4.9902   74.263   4.7245 -1.816833 6.871865 
1 1 1   21    8   32 o   68.976   3.5470  100.561   10.082  106.627   14.465   94.831   14.060   71.024   4.9378   66.928   5.0935 4.095985 7.094069 
1 1 1   21    8   33 o   65.758   5.8993   96.433   15.850  108.523   22.152   83.750   22.689   70.382   7.6310   61.133   8.9987 9.249134 11.79868 
1 1 1   21    8   34 o  120.103   3.4354  305.701   16.088  306.271   27.642  305.409   19.784  119.645   5.6015  120.561   3.9787 -0.9155197 6.870764 
1 1 1   21    8   35 o   30.450   6.2387   20.746   8.5566   30.383   12.917   13.211   11.422   35.910   8.7919   24.990   8.8538 10.91976 12.47748 
1 1 1   21    8   36 o   69.779   3.7737  103.772   10.797  113.687   16.392   96.175   14.349   72.621   5.4729   66.937   5.1973 5.684311 7.547485 
1 1 1   21    8   37 o   35.609   6.9821   35.558   11.675   44.726   13.678   10.953   22.408   43.886   7.8445   27.332   11.553 16.55363 13.96414 
1 1 1   21    8   38 o   25.182   7.5739   7.7380   11.020   5.8489   12.173   16.323   25.949   20.999   8.6676   29.364   12.423 -8.365767 15.14775 
1 1 1   21    8   39 o   37.841   8.1219   32.088   11.765   26.098   13.197   55.284   25.968   32.259   9.3658   43.423   13.272 -11.16392 16.24390 
1 1 1   21    8   40 o   31.247   8.5219   18.472   13.098   10.695   14.678   48.862   29.017   23.768   9.6284   38.726   14.064 -14.95800 17.04380 
1 1 1   21    8   41 o   39.254   9.9163   50.935   21.950   27.707   30.961   74.409   31.125   31.550   13.466   46.958   14.560 -15.40789 19.83259 
1 1 1   21    8   42 o   31.781   9.8268   33.181   26.311  -4.0714   53.385   45.133   30.239   28.255   13.812   35.306   13.982 -7.050926 19.65355 
1 1 1   21    8   43 o   27.441   9.1325   11.241   23.585   11.841   51.507   11.082   26.530   29.008   14.039   25.873   11.684 3.135298 18.26507 
1 1 1   21    9    0 o   44.101   3.5384   41.702   8.7994   41.702   8.7994   41.702   8.7994   44.101   5.0040   44.101   5.0040 0.000000 0.000000 
1 1 1   21    9    1 f  250.154   2.3903  1292.43   24.659  1281.06   34.564  1304.22   35.192  249.035   3.3651  251.273   3.3957 -2.237183 4.780672 
1 1 1   21    9    2 o   41.530   3.5810   35.793   6.0997   31.238   8.5741   40.461   8.6793   38.839   5.3525   44.221   4.7587 -5.382648 7.162020 
1 1 1   21    9    3 o   43.627   3.7320   39.420   6.6559   39.343   10.100   39.479   8.8494   43.577   5.6194   43.676   4.9125 -0.9870529E-01 7.463924 
1 1 1   21    9    4 o  150.786   2.5844  467.088   15.198  478.147   26.312  461.550   18.618  152.071   4.1952  149.502   3.0194 2.568512 5.168778 
1 1 1   21    9    5 o  168.855   2.8067  593.052   19.200  610.291   25.116  568.814   29.782  171.867   3.5432  165.844   4.3540 6.022659 5.613481 
1 1 1   21    9    6 o   59.573   3.1135   74.056   7.5593   68.373   11.339   78.603   10.142   57.481   4.7827   61.664   3.9877 -4.182610 6.227051 
1 1 1   21    9    7 o  163.760   2.3436  554.340   15.638  551.441   24.023  556.472   20.602  163.367   3.5652  164.153   3.0429 -0.7863922 4.687246 
1 1 1   21    9    8 o   91.268   2.7779  171.507   10.428  190.473   15.243  154.822   14.297   95.997   3.8499   86.540   4.0055 9.456993 5.555715 
1 1 1   21    9    9 o   93.860   2.5045  180.817   9.5731  174.737   12.488  189.482   14.909   91.972   3.2920   95.749   3.7752 -3.776428 5.008931 
1 1 1   21    9   10 o  128.065   2.3573  339.142   12.326  341.107   16.338  336.546   18.777  128.513   3.0824  127.618   3.5674 0.8950272 4.714650 
1 1 1   21    9   11 f  108.768   2.6459  244.236   11.848  224.291   16.468  265.639   17.059  104.164   3.8332  113.372   3.6483 -9.208206 5.291851 
1 1 1   21    9   12 o   76.436   2.5358  120.794   7.9895  118.809   11.440  122.684   11.163   75.819   3.6582   77.052   3.5126 -1.233322 5.071594 
1 1 1   21    9   13 o   73.131   2.8695  112.173   8.4883  120.343   11.225  101.259   12.973   76.309   3.5665   69.953   4.4964 6.355911 5.739077 
1 1 1   21    9   14 o  326.853   3.2030  2205.30   43.080  2129.26   58.595  2294.76   63.555  320.764   4.4291  332.943   4.6282 -12.17947 6.406003 
1 1 1   21    9   15 o  144.259   2.3526  431.384   13.755  422.617   21.436  437.521   17.934  142.981   3.6349  145.537   2.9877 -2.556610 4.705195 
1 1 1   21    9   16 o  141.264   2.3526  410.366   13.375  421.554   21.536  403.342   17.064  142.792   3.6568  139.735   2.9609 3.057266 4.705200 
1 1 1   21    9   17 o  101.872   2.5962  214.765   10.785  213.659   16.521  215.587   14.237  101.621   3.9418  102.123   3.3800 -0.5013733 5.192473 
1 1 1   21    9   18 o   70.966   4.2402  112.285   11.494  133.696   14.751   79.194   18.338   80.333   4.4520   61.599   7.2179 18.73455 8.480448 
1 1 1   21    9   19 o   82.650   3.0111  141.431   10.259  135.062   14.328  148.132   14.695   80.738   4.3028   84.563   4.2134 -3.824463 6.022191 
1 1 1   21    9   20 o   93.517   2.8584  180.804   11.013  170.895   15.194  191.772   15.986   90.822   4.0562   96.212   4.0285 -5.390556 5.716794 
1 1 1   21    9   21 f  176.044   2.6015  642.219   18.871  626.826   27.085  656.740   26.307  173.973   3.7746  178.114   3.5810 -4.140747 5.203010 
1 1 1   21    9   22 o   98.818   4.0899  186.623   13.886  235.844   30.915  174.183   15.542  106.007   7.0709   91.630   4.1125 14.37646 8.179877 
1 1 1   21    9   23 o  148.385   2.6166  455.285   15.985  433.866   21.818  480.106   23.486  144.639   3.6574  152.132   3.7431 -7.492279 5.233264 
1 1 1   21    9   24 o  155.872   2.7148  505.388   17.321  497.344   26.036  511.774   23.199  154.687   4.0809  157.056   3.5814 -2.369370 5.429595 
1 1 1   21    9   25 o   28.039   6.1840   16.852   8.0142   13.569   11.544   19.907   11.135   26.014   8.9221   30.063   8.5654 -4.049118 12.36808 
1 1 1   21    9   26 o   85.808   3.7398  157.954   12.567  167.119   15.778  142.051   20.783   89.536   4.2725   82.079   6.1392 7.456535 7.479634 
1 1 1   21    9   27 o   34.519   5.9257   26.618   8.3470   26.757   12.033   26.490   11.588   34.585   8.4970   34.453   8.2617 0.1325912 11.85135 
1 1 1   21    9   28 o   38.036   5.6055   32.421   8.5011   30.719   12.283   33.987   11.778   36.944   8.2675   39.127   7.5720 -2.182190 11.21100 
1 1 1   21    9   29 o   57.683   6.8966   92.773   12.316  107.691   14.157   46.360   24.971   71.583   4.7952   43.783   12.933 27.79979 13.79319 
1 1 1   21    9   30 o   86.048   3.1695  155.365   11.244  151.074   15.943  159.612   15.861   84.842   4.5562   87.255   4.4073 -2.413345 6.338990 
1 1 1   21    9   31 o   55.379   4.0530   65.282   9.2303   59.710   13.053   70.853   13.054   52.939   5.9784   57.818   5.4741 -4.878559 8.105926 
1 1 1   21    9   32 o   19.545   5.9208   0.4514   8.4861   4.1822   12.934  -2.3689   11.245   21.444   8.8996   17.645   7.8116 3.799074 11.84167 
1 1 1   21    9   33 o   53.213   6.1296   67.503   11.309   56.526   21.279   71.825   13.351   48.427   10.915   58.000   5.5811 -9.573002 12.25914 
1 1 1   21    9   34 o   27.035   6.3594   16.080   8.5424   10.616   12.519   20.841   11.686   24.072   9.1412   29.997   8.8433 -5.924870 12.71875 
1 1 1   21    9   35 o   43.579   5.3740   42.533   9.4081   49.330   13.983   36.910   12.717   47.199   7.1828   39.959   7.9955 7.240894 10.74807 
1 1 1   21    9   36 o   30.574   6.0315   21.757   8.6422   9.8265   12.246   33.594   12.198   23.229   8.9853   37.918   8.0487 -14.68894 12.06299 
1 1 1   21    9   37 o   58.928   6.7282   92.931   13.371  106.207   16.000   62.185   24.349   69.863   5.5528   47.993   12.257 21.87030 13.45636 
1 1 1   21    9   38 o   56.024   9.6237   93.007   15.238   93.558   15.960   87.329   51.254   65.199   5.9351   46.848   18.309 18.35054 19.24741 
1 1 1   21    9   39 o   25.597   7.6419   9.5451   11.235   7.6779   12.438   17.817   26.181   21.795   8.8513   29.398   12.460 -7.603247 15.28390 
1 1 1   21    9   40 o   29.925   8.0246   23.676   12.890   25.878   14.332   14.356   29.490   31.365   9.9044   28.486   12.629 2.878706 16.04920 
1 1 1   21    9   41 o   30.547   9.2800   25.223   21.039   27.352   30.189   23.212   29.337   31.094   13.285   30.001   12.961 1.093086 18.56004 
1 1 1   21    9   42 o   30.053   9.3978   26.014   24.508 -14.4090   51.747   37.704   27.827   26.961   13.264   33.145   13.317 -6.184938 18.79553 
1 1 1   21   10    0 o  122.978   2.5170  312.963   18.020  312.963   18.020  312.963   18.020  122.978   3.5595  122.978   3.5595 0.000000 0.000000 
1 1 1   21   10    1 o  100.441   2.6541  206.746   10.471  202.902   12.907  214.148   17.910   99.117   3.1574  101.764   4.2671 -2.646935 5.308190 
1 1 1   21   10    2 o   96.683   2.2639  193.112   9.0222  201.525   12.794  184.790   12.725   98.781   3.1403   94.585   3.2618 4.195869 4.527822 
1 1 1   21   10    3 o  179.637   2.3350  666.215   17.109  668.933   26.242  664.206   22.563  179.934   3.5361  179.341   3.0504 0.5936279 4.670025 
1 1 1   21   10    4 o  114.508   2.3264  270.746   10.875  271.538   16.621  270.154   14.380  114.642   3.5152  114.375   3.0484 0.2661819 4.652866 
1 1 1   21   10    5 o  149.567   2.2966  461.077   14.019  468.823   21.516  455.362   18.480  150.640   3.4630  148.495   3.0174 2.145782 4.593163 
1 1 1   21   10    6 o   88.987   2.6077  166.937   9.3498  144.633   14.247  183.810   12.392   83.637   4.1300   94.336   3.1848 -10.69949 5.215364 
1 1 1   21   10    7 o  111.578   2.4111  258.455   10.939  249.383   16.791  265.145   14.419  109.850   3.7060  113.306   3.0853 -3.455391 4.822195 
1 1 1   21   10    8 o  273.025   2.8977  1541.15   32.626  1553.81   46.559  1528.94   45.732  274.123   4.1181  271.928   4.0776 2.194794 5.795304 
1 1 1   21   10    9 o  216.124   2.4798  965.967   21.860  970.548   28.882  959.823   33.446  216.757   3.2307  215.491   3.7631 1.265884 4.959689 
1 1 1   21   10   10 o  178.201   2.7216  655.367   18.675  653.420   22.646  659.504   33.014  177.865   3.0870  178.537   4.4833 -0.6720276 5.443295 
1 1 1   21   10   11 o  133.293   2.7411  363.454   13.918  357.421   16.670  377.337   25.287  131.548   3.0724  135.038   4.5403 -3.490646 5.482144 
1 1 1   21   10   12 o  169.118   2.3891  593.411   16.496  572.625   24.932  609.596   22.000  166.447   3.6318  171.789   3.1050 -5.341354 4.778172 
1 1 1   21   10   13 o  137.386   2.4814  388.982   14.004  402.087   20.902  378.307   18.864  139.469   3.6337  135.304   3.3803 4.165497 4.962885 
1 1 1   21   10   14 o   62.887   3.2706   80.781   8.4155   96.494   12.694   68.460   11.241   68.277   4.5078   57.498   4.7400 10.77844 6.541201 
1 1 1   21   10   15 o  196.410   2.6315  795.057   21.283  748.871   29.130  847.941   31.171  190.313   3.7111  202.507   3.7320 -12.19458 5.263080 
1 1 1   21   10   16 o  171.777   2.3742  613.993   16.475  588.925   25.781  631.298   21.420  168.750   3.7041  174.804   2.9710 -6.053909 4.748413 
1 1 1   21   10   17 o   32.011   5.5831   22.150   7.1582   22.457   11.714   21.967   9.0429   32.177   8.6432   31.844   7.0695 0.3333530 11.16617 
1 1 1   21   10   18 o  162.804   2.5068  548.515   16.774  545.781   24.745  550.840   22.817  162.407   3.6942  163.202   3.3897 -0.7946472 5.013696 
1 1 1   21   10   19 f  164.685   2.4611  561.162   16.717  563.276   23.730  559.080   23.552  164.992   3.4872  164.378   3.4739 0.6136475 4.922258 
1 1 1   21   10   20 f   92.916   2.8709  178.843   11.000  174.566   15.404  183.293   15.713   91.782   4.0693   94.050   4.0507 -2.268181 5.741769 
1 1 1   21   10   21 o  144.386   2.5239  431.717   15.030  429.381   21.251  434.055   21.260  143.994   3.5783  144.778   3.5604 -0.7845001 5.047791 
1 1 1   21   10   22 o   66.717   5.7562   96.987   12.453   89.661   27.724   98.839   13.938   64.538   10.415   68.896   4.9050 -4.358116 11.51250 
1 1 1   21   10   23 o  147.646   2.9375  455.966   17.376  465.944   22.226  440.282   27.866  149.879   3.5955  145.412   4.6462 4.466705 5.874937 
1 1 1   21   10   24 o   33.982   5.8972   25.950   8.2179   22.071   12.378   29.007   10.989   31.630   9.0376   36.334   7.5784 -4.704126 11.79447 
1 1 1   21   10   25 o   26.020   5.9506   11.821   7.9706   23.697   12.000   2.4452   10.663   32.606   8.7434   19.434   8.0741 13.17288 11.90123 
1 1 1   21   10   26 o  153.700   2.6330  490.525   16.643  499.464   24.588  482.967   22.609  154.948   3.8474  152.452   3.5957 2.496597 5.266067 
1 1 1   21   10   27 o   46.359   4.9420   46.367   9.0100   60.079   13.241   34.545   12.295   53.278   6.0259   39.440   7.8346 13.83808 9.883930 
1 1 1   21   10   28 o   30.192   6.3457   20.475   8.6018   24.254   11.850   16.267   12.506   32.722   8.6494   27.662   9.2876 5.059172 12.69141 
1 1 1   21   10   29 o   21.320   6.5760   0.0206   10.541   8.2161   11.300 -54.9119   29.257   22.548   8.6556   20.093   9.9023 2.455265 13.15199 
1 1 1   21   10   30 o  113.083   3.3892  272.443   15.196  282.879   19.252  255.196   24.749  116.320   4.0129  109.845   5.4628 6.474655 6.778334 
1 1 1   21   10   31 o   86.869   4.0662  170.801   13.355  131.402   22.358  192.654   16.651   77.940   6.9551   95.798   4.2144 -17.85791 8.132310 
1 1 1   21   10   32 o   29.405   6.5489   19.189   8.7570   22.123   13.724   17.174   11.373   31.065   9.6742   27.744   8.8295 3.320871 13.09773 
1 1 1   21   10   33 o   68.437   4.5281   95.875   11.773  115.616   22.096   88.050   13.912   72.571   7.3824   64.304   5.2453 8.267006 9.056123 
1 1 1   21   10   34 o   77.385   3.4007  127.278   10.829  125.794   15.803  128.591   14.869   76.877   4.9841   77.894   4.6281 -1.016907 6.801495 
1 1 1   21   10   35 o   25.234   6.4045   12.714   8.5462   18.778   13.070   8.1855   11.295   28.458   9.4950   22.011   8.5973 6.446745 12.80891 
1 1 1   21   10   36 o   27.323   6.2813   17.257   8.4605   10.608   12.459   22.947   11.525   23.658   9.0869   30.988   8.6744 -7.329760 12.56254 
1 1 1   21   10   37 o   30.833   7.8501   21.900   11.294   20.113   12.834   28.035   23.783   28.752   9.3999   32.913   12.575 -4.160784 15.70019 
1 1 1   21   10   38 o   42.529   9.1023   50.068   13.429   50.422   13.913   45.250   51.353   47.156   7.1532   37.901   16.740 9.255062 18.20469 
1 1 1   21   10   39 o   34.739   8.6786   31.722   13.630   29.543   15.260   40.317   30.311   33.513   10.159   35.964   14.074 -2.451160 17.35718 
1 1 1   21   10   40 o   25.969   7.7989   12.679   13.007   13.821   14.590   8.2543   28.714   25.009   9.7701   26.929   12.159 -1.919991 15.59781 
1 1 1   21   10   41 o   25.434   8.1782  -1.4135   20.481 -33.8812   30.278   25.973   27.808   20.608   10.140   30.260   12.834 -9.651831 16.35648 
1 1 1   21   10   42 o   20.716   7.1468 -23.4153   19.822 -29.6862   30.629 -18.8959   26.002   20.865   10.254   20.566   9.9585 0.2991486 14.29360 
1 1 1   21   11    0 o  227.055   2.3060  1064.68   30.526  1064.68   30.526  1064.68   30.526  227.055   3.2612  227.055   3.2612 0.000000 0.000000 
1 1 1   21   11    1 o  136.919   2.1300  387.134   12.028  387.862   17.052  386.412   16.969  137.047   3.0168  136.791   3.0076 0.2557373 4.259944 
1 1 1   21   11    2 o   40.856   3.8911   33.711   6.4556   43.372   9.9902   26.785   8.4588   45.762   5.2930   35.949   5.7049 9.812634 7.782174 
1 1 1   21   11    3 o   82.141   2.5688  138.765   8.6098  143.829   13.280  135.093   11.308   83.417   3.8600   80.865   3.3905 2.551872 5.137635 
1 1 1   21   11    4 o   70.840   2.7854  105.423   7.9719   93.817   12.167  114.153   10.553   67.348   4.3801   74.332   3.4421 -6.983864 5.570743 
1 1 1   21   11    5 o  188.082   2.3598  732.510   18.173  715.818   27.227  745.921   24.406  186.124   3.5468  190.040   3.1137 -3.916611 4.719608 
1 1 1   21   11    6 o  186.563   2.5232  719.285   19.409  695.783   27.365  743.075   27.532  183.491   3.6159  189.635   3.5201 -6.143799 5.046318 
1 1 1   21   11    7 o  236.065   2.5497  1153.59   24.609  1136.39   37.197  1166.99   32.816  234.463   3.8465  237.668   3.3478 -3.204834 5.099349 
1 1 1   21   11    8 o  128.327   2.3475  341.195   12.300  347.532   16.367  332.970   18.646  129.717   3.0591  126.936   3.5615 2.781113 4.694907 
1 1 1   21   11    9 o   61.016   3.1601   78.095   7.8128   84.123   10.387   70.241   11.856   63.787   3.9481   58.245   4.9353 5.541889 6.320206 
1 1 1   21   11   10 o  178.014   2.3708  651.562   17.131  637.461   22.217  672.240   26.903  175.678   3.0662  180.351   3.6168 -4.673187 4.741635 
1 1 1   21   11   11 o  173.910   2.2041  624.775   15.809  625.001   22.249  624.545   22.467  173.943   3.1013  173.877   3.1328 0.6648254E-01 4.408260 
1 1 1   21   11   12 o  145.327   2.1515  435.881   12.890  451.784   18.550  421.030   17.926  147.888   3.0411  142.766   3.0443 5.122437 4.303070 
1 1 1   21   11   13 o   89.023   2.5833  160.602   9.2886  179.368   15.033  149.012   11.813   93.130   3.9137   84.915   3.3731 8.214859 5.166661 
1 1 1   21   11   14 o  254.262   2.8251  1336.85   29.618  1354.17   42.507  1320.50   41.291  255.855   4.0281  252.668   3.9623 3.187408 5.650220 
1 1 1   21   11   15 o   33.242   5.2788   19.320   8.4309   0.8351   10.916   46.648   13.273   19.150   8.0771   47.333   6.7988 -28.18276 10.55759 
1 1 1   21   11   16 o  168.805   2.6788  589.807   18.615  593.738   25.596  585.393   27.121  169.420   3.6631  168.190   3.9097 1.230545 5.357587 
1 1 1   21   11   17 o   47.253   4.4692   46.785   8.5941   37.741   12.048   56.155   12.263   42.533   6.8679   51.973   5.7207 -9.440403 8.938375 
1 1 1   21   11   18 o   30.478   5.8068   18.704   7.7108   29.753   12.005   10.943   10.061   36.958   8.0990   23.997   8.3235 12.96111 11.61355 
1 1 1   21   11   19 o   54.195   3.9859   61.315   8.8770   66.761   12.487   55.750   12.622   56.661   5.3433   51.730   5.9159 4.931602 7.971739 
1 1 1   21   11   20 o  148.418   2.6042  456.669   15.923  444.402   22.886  468.177   22.167  146.466   3.7885  150.370   3.5742 -3.904205 5.208457 
1 1 1   21   11   21 o  171.248   2.9970  610.504   20.800  600.514   32.445  617.474   27.101  169.942   4.6290  172.555   3.8079 -2.612564 5.993995 
1 1 1   21   11   22 o   58.511   4.8392   76.550   10.696   59.254   18.030   85.941   13.286   52.819   8.2765   64.203   5.0171 -11.38430 9.678408 
1 1 1   21   11   23 o  127.783   2.6898  339.689   14.152  320.581   20.170  358.213   19.860  124.206   3.9374  131.360   3.6656 -7.154518 5.379571 
1 1 1   21   11   24 o   72.586   4.0833  113.388   11.659  120.889   14.754  100.914   19.027   76.088   4.7015   69.084   6.6776 7.004051 8.166603 
1 1 1   21   11   25 o   65.057   3.7923   88.596   10.105   90.257   15.274   87.302   13.476   65.539   5.6503   64.576   5.0596 0.9627838 7.584600 
1 1 1   21   11   26 o   59.615   3.7990   74.897   9.3026   67.665   13.218   81.993   13.094   56.696   5.6527   62.534   5.0770 -5.837639 7.597948 
1 1 1   21   11   27 o   86.097   3.0790  154.770   10.915  162.367   16.014  148.178   14.917   88.048   4.4097   84.145   4.2982 3.902924 6.157917 
1 1 1   21   11   28 o   45.624   6.1318   38.557   10.400   28.264   12.042   68.771   20.631   35.338   8.3876   55.909   8.9468 -20.57047 12.26362 
1 1 1   21   11   29 o   75.644   3.7079  120.349   11.458  117.780   15.125  123.807   17.552   74.810   4.9021   76.478   5.5645 -1.668495 7.415848 
1 1 1   21   11   30 o   19.653   5.8067   2.6337   7.8491   3.4455   11.495   1.9247   10.743   20.263   8.3983   19.042   8.0212 1.221277 11.61340 
1 1 1   21   11   31 o   53.722   4.5420   62.346   9.8232   60.611   15.538   63.501   12.679   52.842   7.1293   54.603   5.6297 -1.761208 9.084075 
1 1 1   21   11   32 o   88.036   3.2672  163.813   11.845  153.587   16.745  174.056   16.759   85.218   4.7640   90.854   4.4724 -5.635315 6.534370 
1 1 1   21   11   33 o   31.685   6.6912   25.955   10.224   3.3920   20.907   33.047   11.721   25.269   10.929   38.102   7.7233 -12.83305 13.38237 
1 1 1   21   11   34 o   27.753   6.0050   16.451   8.5431   3.7314   12.178   28.775   11.988   20.479   8.5787   35.027   8.4050 -14.54814 12.00993 
1 1 1   21   11   35 o   62.140   4.2208   85.272   10.618   74.206   15.859   94.265   14.296   58.055   6.6231   66.225   5.2339 -8.170082 8.441517 
1 1 1   21   11   36 o   32.043   7.8672   19.938   11.261   13.365   12.854   41.638   23.355   25.104   9.3194   38.983   12.677 -13.87943 15.73431 
1 1 1   21   11   37 o   44.068   7.4900   49.446   12.604   49.457   14.746   49.417   24.282   46.415   7.7030   41.721   12.848 4.693939 14.98005 
1 1 1   21   11   38 o   25.929   8.5796   4.1526   11.912   3.9297   12.275   7.7624   49.394   20.142   8.5339   31.716   14.887 -11.57372 17.15930 
1 1 1   21   11   39 o   39.122   8.1273   45.301   13.411   47.593   15.001   36.177   29.930   43.933   8.5864   34.311   13.802 9.621689 16.25451 
1 1 1   21   11   40 o   22.985   7.1380   5.8252   12.628   11.797   14.057 -19.1455   28.745   23.848   9.5047   22.122   10.652 1.726048 14.27599 
1 1 1   21   11   41 o   26.120   8.4675   6.7594   20.563   19.586   30.928  -3.4018   27.528   28.646   12.801   23.594   11.087 5.051960 16.93497 
1 1 1   21   11   42 o   26.369   8.5145   6.7496   20.902   29.655   31.266 -11.7604   28.106   30.497   13.277   22.240   10.663 8.257307 17.02890 
1 1 1   21   12    0 o  226.540   2.3104  1059.90   30.514  1059.90   30.514  1059.90   30.514  226.540   3.2674  226.540   3.2674 0.000000 0.000000 
1 1 1   21   12    1 o  154.415   2.3036  493.178   14.532  487.937   22.066  497.193   19.311  153.671   3.4814  155.159   3.0176 -1.488037 4.607197 
1 1 1   21   12    2 o  113.445   2.3405  266.752   10.836  259.500   16.444  272.318   14.407  112.062   3.5579  114.828   3.0419 -2.765556 4.681000 
1 1 1   21   12    3 o  104.178   2.3889  224.606   10.161  221.503   15.455  226.969   13.485  103.529   3.6194  104.827   3.1190 -1.298141 4.777886 
1 1 1   21   12    4 o  126.284   2.3021  328.789   11.852  333.695   18.262  325.219   15.578  127.080   3.4842  125.488   3.0099 1.593025 4.604208 
1 1 1   21   12    5 o  187.814   2.1926  728.579   16.984  726.723   24.054  730.424   23.985  187.575   3.1091  188.053   3.0923 -0.4786987 4.385121 
1 1 1   21   12    6 o  101.080   2.4674  211.501   10.094  209.117   15.840  213.131   13.097  100.579   3.8185  101.580   3.1260 -1.000595 4.934821 
1 1 1   21   12    7 o  204.261   2.6026  862.340   21.926  861.049   31.067  863.620   30.949  204.107   3.6904  204.414   3.6709 -0.3069000 5.205232 
1 1 1   21   12    8 o  164.564   2.3434  560.786   15.738  568.707   20.882  550.372   23.945  165.935   3.0512  163.192   3.5575 2.742477 4.686745 
1 1 1   21   12    9 o   63.862   3.1726   84.354   8.3357   76.504   11.620   92.676   11.964   60.795   4.6343   66.929   4.3341 -6.133503 6.345198 
1 1 1   21   12   10 o  133.144   2.5041  366.485   13.746  369.942   19.230  362.872   19.656  133.791   3.4848  132.497   3.5969 1.293945 5.008182 
1 1 1   21   12   11 o  327.105   2.9684  2208.69   39.542  2182.91   51.815  2244.65   61.187  324.904   3.8667  329.306   4.5050 -4.401886 5.936802 
1 1 1   21   12   12 o   96.084   2.5930  191.309   10.068  188.617   15.859  193.127   13.030   95.492   4.0267   96.677   3.2679 -1.184723 5.185939 
1 1 1   21   12   13 o  173.271   2.3485  619.475   16.370  624.990   26.278  615.979   20.926  173.860   3.6647  172.683   2.9382 1.177200 4.697085 
1 1 1   21   12   14 o  143.528   2.4948  425.290   14.723  434.000   21.788  417.971   19.973  144.865   3.6466  142.191   3.4056 2.674911 4.989596 
1 1 1   21   12   15 o  150.124   2.5239  467.636   15.577  436.912   22.422  496.295   21.656  145.321   3.7409  154.927   3.3890 -9.605804 5.047751 
1 1 1   21   12   16 o  175.369   2.4679  634.084   17.664  650.124   27.157  622.322   23.256  177.250   3.7148  173.488   3.2501 3.761734 4.935889 
1 1 1   21   12   17 o  143.252   2.5677  425.096   15.119  419.927   22.247  429.533   20.610  142.419   3.7874  144.084   3.4682 -1.665298 5.135389 
1 1 1   21   12   18 o  127.232   2.4277  335.661   12.470  331.617   19.708  338.362   16.104  126.546   3.7760  127.918   3.0523 -1.372536 4.855368 
1 1 1   21   12   19 f   28.744   5.9078   17.320   7.7139   24.344   11.053   10.648   10.771   33.366   8.1105   24.121   8.5923 9.244221 11.81559 
1 1 1   21   12   20 o   26.446   6.0336   13.580   7.8747   20.988   11.338   6.6755   10.946   30.997   8.5777   21.895   8.4877 9.101370 12.06725 
1 1 1   21   12   21 f   56.981   5.0187   68.692   11.593   70.075   15.160   66.744   17.989   57.793   6.3600   56.168   7.7653 1.625202 10.03741 
1 1 1   21   12   22 o   70.428   4.6720  103.935   13.503   90.353   18.474  119.517   19.787   65.458   6.8427   75.398   6.3630 -9.939247 9.343979 
1 1 1   21   12   23 o   81.028   3.1027  137.749   10.284  119.078   14.672  155.782   14.419   75.529   4.7098   86.527   4.0404 -10.99766 6.205428 
1 1 1   21   12   24 o   98.122   2.8435  200.850   11.477  184.856   16.273  216.680   16.190   94.187   4.1891  102.056   3.8462 -7.868462 5.687011 
1 1 1   21   12   25 o   74.177   3.4508  115.521   10.469  111.796   15.710  118.497   14.041   73.022   5.2162   75.333   4.5192 -2.310677 6.901536 
1 1 1   21   12   26 o   62.675   3.6007   82.421   9.2964   87.153   13.546   78.208   12.782   64.369   5.1023   60.981   5.0820 3.388050 7.201335 
1 1 1   21   12   27 o   67.486   3.5767   95.486   9.8835  112.439   14.463   80.632   13.538   73.153   4.7935   61.819   5.3097 11.33447 7.153322 
1 1 1   21   12   28 o  102.566   3.8562  218.545   14.696  213.525   17.284  231.647   27.920  101.014   4.1485  104.119   6.5016 -3.104942 7.712409 
1 1 1   21   12   29 o   40.904   5.6560   38.145   9.1861   44.601   12.291   29.976   13.826   45.669   6.5253   36.138   9.2403 9.531178 11.31205 
1 1 1   21   12   30 o   73.512   3.4220  114.299   10.357  108.346   14.791  120.025   14.508   71.569   5.0109   75.455   4.6617 -3.886192 6.844025 
1 1 1   21   12   31 o   76.364   3.9138  128.984   11.813   98.460   17.909  152.493   15.717   67.636   6.4200   85.092   4.4784 -17.45635 7.827630 
1 1 1   21   12   32 o   63.341   3.7825   86.094   9.8099   78.874   14.333   92.458   13.456   60.674   5.7274   66.008   4.9424 -5.333996 7.565057 
1 1 1   21   12   33 o   75.818   3.5386  122.488   11.024  121.216   16.255  123.572   14.999   75.343   5.2311   76.294   4.7667 -0.9506912 7.077146 
1 1 1   21   12   34 f   68.005   3.8326  100.025   10.679   93.894   15.700  105.304   14.567   65.861   5.7796   70.149   5.0350 -4.288116 7.665159 
1 1 1   21   12   35 o   26.640   6.4570   16.087   8.5177   17.054   12.708   15.298   11.477   27.264   9.3606   26.015   8.8967 1.248434 12.91400 
1 1 1   21   12   36 o   30.884   7.2288   25.104   12.001   33.639   14.169   3.4451   22.572   36.830   9.3200   24.939   11.053 11.89115 14.45759 
1 1 1   21   12   37 o   34.156   7.4701   32.309   12.192   38.325   14.334   16.563   23.189   39.526   8.9947   28.787   11.929 10.73945 14.94017 
1 1 1   21   12   38 o   18.827   6.3377 -10.9044   11.630 -10.0663   13.412 -13.4438   23.347   16.393   7.7146   21.260   10.057 -4.866407 12.67536 
1 1 1   21   12   39 o   27.649   8.0263   17.170   13.191   18.339   14.699   12.334   29.898   27.215   9.9903   28.082   12.565 -0.8668938 16.05261 
1 1 1   21   12   40 f   17.451   8.0595  -5.2572   13.578  -5.2572   13.578   0.0000   0.0000   17.451   8.0595  ?   ?       ?      ? 
1 1 1   21   12   41 o   23.608   8.1044 -14.0084   23.718 -58.0091   50.709  -1.6870   26.834   23.671   11.881   23.545   11.026 0.1256924 16.20890 
1 1 1   21   13    0 o  240.872   2.7366  1198.88   38.426  1198.88   38.426  1198.88   38.426  240.872   3.8702  240.872   3.8702 0.000000 0.000000 
1 1 1   21   13    1 o   74.301   2.9400  114.305   8.9806  125.976   12.788  102.947   12.615   78.057   3.9720   70.546   4.3357 7.511841 5.880054 
1 1 1   21   13    2 o  258.413   2.6227  1381.44   27.702  1370.91   42.007  1389.54   36.850  257.501   3.9553  259.325   3.4453 -1.823273 5.245432 
1 1 1   21   13    3 o  149.516   2.2960  461.590   14.006  463.317   21.460  460.309   18.486  149.741   3.4748  149.291   3.0022 0.4493408 4.592097 
1 1 1   21   13    4 o  111.374   2.1829  255.997   10.023  265.664   14.403  246.919   13.957  113.412   3.0791  109.336   3.0950 4.075264 4.365724 
1 1 1   21   13    5 o  120.308   2.1575  298.944   10.705  299.546   15.221  298.354   15.059  120.427   3.0644  120.188   3.0380 0.2380600 4.315038 
1 1 1   21   13    6 o  123.311   2.3738  316.185   11.935  299.492   18.029  329.208   15.924  120.375   3.6313  126.247   3.0582 -5.872055 4.747554 
1 1 1   21   13    7 o  236.909   2.7295  1160.46   26.670  1163.03   37.816  1157.92   37.620  237.169   3.8659  236.649   3.8543 0.5202179 5.459024 
1 1 1   21   13    8 o   84.082   2.5755  144.716   8.8484  136.381   11.614  156.247   13.660   81.234   3.4665   86.930   3.8099 -5.695984 5.150908 
1 1 1   21   13    9 o   84.163   2.6198  145.051   8.9878  137.901   11.724  155.243   13.998   81.684   3.4799   86.642   3.9171 -4.958488 5.239609 
1 1 1   21   13   10 o  140.667   2.3546  409.122   13.480  410.308   17.699  407.484   20.802  140.933   3.0448  140.400   3.5923 0.5329742 4.709135 
1 1 1   21   13   11 o  162.958   2.3193  550.726   15.219  539.473   24.180  558.109   19.586  161.537   3.6293  164.379   2.8888 -2.841949 4.638694 
1 1 1   21   13   12 o  260.570   2.5819  1403.31   26.993  1406.93   43.571  1401.05   34.387  260.762   4.0512  260.379   3.2020 0.3822021 5.163821 
1 1 1   21   13   13 o   78.968   2.7876  127.237   8.8296  136.597   14.481  121.699   11.140   81.220   4.3230   76.716   3.5207 4.504074 5.575271 
1 1 1   21   13   14 o  166.144   2.4907  569.632   16.936  581.072   25.710  560.863   22.509  167.587   3.7196  164.702   3.3135 2.884781 4.981438 
1 1 1   21   13   15 o  133.658   2.9683  369.473   16.110  373.359   25.145  366.767   20.982  134.203   4.5429  133.114   3.8217 1.088547 5.936606 
1 1 1   21   13   16 o  179.096   2.8423  657.693   20.719  625.371   26.916  704.698   32.459  173.801   3.7548  184.390   4.2680 -10.58929 5.684616 
1 1 1   21   13   17 o  224.170   3.0404  1019.65   27.242  957.163   34.071  1130.40   45.360  214.974   3.8426  233.366   4.7127 -18.39211 6.080747 
1 1 1   21   13   18 o   64.174   3.2923   88.618   8.2895   74.000   13.340   97.813   10.580   59.629   5.4241   68.720   3.7329 -9.091709 6.584504 
1 1 1   21   13   19 o   26.974   6.1701   14.903   7.8524   17.413   11.452   12.675   10.788   28.613   8.8251   25.336   8.6255 3.277943 12.34020 
1 1 1   21   13   20 o   65.328   3.7997   86.909   10.099  103.173   15.963   76.056   13.040   70.278   5.5072   60.377   5.2367 9.901279 7.599460 
1 1 1   21   13   21 o   75.651   3.2380  119.187   10.098  114.117   14.192  124.386   14.371   74.010   4.6492   77.292   4.5081 -3.281761 6.476001 
1 1 1   21   13   22 o   55.176   4.6029   61.885   9.8712   71.227   17.616   57.609   11.918   57.926   7.3733   52.426   5.5119 5.500324 9.205763 
1 1 1   21   13   23 o   51.988   5.3691   62.058   10.043   49.054   17.514   68.428   12.259   46.829   9.3945   57.147   5.2010 -10.31815 10.73811 
1 1 1   21   13   24 o   80.784   3.7524  137.694   12.013  140.039   15.113  133.670   19.796   81.917   4.4731   79.650   6.0259 2.266922 7.504720 
1 1 1   21   13   25 o   26.880   6.3151   14.488   8.2649   20.353   12.545   9.9913   10.986   30.285   9.2182   23.476   8.6339 6.808624 12.63010 
1 1 1   21   13   26 o   29.954   5.9332   18.913   8.1164   30.532   12.116   9.4561   10.931   36.833   8.1880   23.075   8.5887 13.75737 11.86632 
1 1 1   21   13   27 o   32.905   6.2431   26.967   10.605   39.421   12.501  -5.0051   20.030   42.820   7.0785   22.991   10.286 19.82893 12.48630 
1 1 1   21   13   28 o   50.136   5.3084   53.124   10.514   50.283   12.974   58.560   17.946   48.519   6.4831   51.754   8.4075 -3.235115 10.61684 
1 1 1   21   13   29 o   28.454   5.9197   17.336   8.0931   27.894   11.527   7.0722   11.365   35.024   8.1354   21.884   8.6015 13.14017 11.83940 
1 1 1   21   13   30 o  102.975   3.2725  223.760   13.807  225.651   18.548  221.409   20.678  103.598   4.3410  102.352   4.8983 1.245811 6.545033 
1 1 1   21   13   31 o   17.843   5.4679  -2.5573   7.8882 -11.0940   11.347   5.4275   10.974   14.991   7.0671   20.695   8.3455 -5.703555 10.93581 
1 1 1   21   13   32 o   32.378   5.6097   24.295   8.4057   9.0222   12.306   37.654   11.509   23.156   8.9932   41.599   6.7081 -18.44237 11.21946 
1 1 1   21   13   33 o   71.351   3.5551  108.743   10.459  110.107   15.008  107.455   14.583   71.765   5.0706   70.937   4.9843 0.8271103 7.110131 
1 1 1   21   13   34 o   63.456   5.0162   87.122   11.685   94.936   22.620   84.277   13.648   64.324   8.5262   62.587   5.2870 1.737537 10.03233 
1 1 1   21   13   35 o   22.186   5.9092   6.3868   8.4641  -6.5445   12.271   18.123   11.690   16.711   7.6978   27.660   8.9676 -10.94913 11.81838 
1 1 1   21   13   36 o   42.730   7.4526   48.870   12.761   52.624   15.147   39.684   23.691   47.901   7.6666   37.559   12.782 10.34222 14.90523 
1 1 1   21   13   37 o   21.849   6.9232   1.2078   11.527   2.4698   13.250  -2.7201   23.377   20.136   8.7046   23.561   10.768 -3.425585 13.84644 
1 1 1   21   13   38 o   19.342   6.5584 -12.0996   12.115 -12.9822   13.743  -9.0222   25.663   15.886   7.5726   22.798   10.710 -6.911613 13.11684 
1 1 1   21   13   39 o   34.290   10.135   31.688   15.331   31.688   15.331   0.0000   0.0000   34.290   10.135  ?   ?       ?      ? 
1 1 1   21   13   40 o   26.827   7.0145   17.815   12.928   30.746   14.758 -24.8275   26.801   33.392   9.9611   20.261   9.8786 13.13133 14.02896 
1 1 1   21   13   41 o   44.306   9.0135   69.912   22.390   19.271   33.565  110.512   30.054   28.465   12.968   60.146   12.522 -31.68086 18.02707 
1 1 1   21   14    0 o  135.603   2.4657  380.355   19.474  380.355   19.474  380.355   19.474  135.603   3.4871  135.603   3.4871 0.000000 0.000000 
1 1 1   21   14    1 o  114.738   2.5283  272.105   11.963  270.592   17.012  273.585   16.826  114.420   3.6049  115.055   3.5458 -0.6352615 5.056520 
1 1 1   21   14    2 o  164.001   2.4768  555.306   16.745  538.841   23.229  573.116   24.159  161.474   3.4879  166.527   3.5175 -5.053421 4.953647 
1 1 1   21   14    3 o  104.480   2.4081  224.674   10.262  219.744   13.473  231.486   15.837  103.135   3.1673  105.826   3.6283 -2.690437 4.816267 
1 1 1   21   14    4 o   32.176   4.9990   21.636   6.3998   17.486   8.2930   27.746   10.063   28.439   7.0939   35.913   7.0454 -7.474270 9.998001 
1 1 1   21   14    5 o   80.283   2.9544  133.682   9.7180  114.901   13.624  153.137   13.866   74.512   4.4330   86.055   3.9068 -11.54279 5.908875 
1 1 1   21   14    6 o   61.294   3.3321   78.080   8.3917   72.855   12.124   82.885   11.627   59.305   4.9566   63.283   4.4547 -3.977966 6.664279 
1 1 1   21   14    7 f  154.051   2.5137  490.522   15.971  484.602   22.522  496.511   22.651  153.114   3.5663  154.987   3.5434 -1.872299 5.027398 
1 1 1   21   14    8 o   65.998   2.9439   90.429   7.9084   92.160   10.433   88.092   12.126   66.761   3.7889   65.235   4.5067 1.525909 5.887777 
1 1 1   21   14    9 o  115.322   2.3744  271.603   11.139  256.513   14.434  293.823   17.514  111.423   3.1408  119.220   3.5619 -7.796341 4.748869 
1 1 1   21   14   10 f  101.306   2.4997  213.157   10.303  218.534   13.598  205.910   15.787  102.835   3.2060   99.776   3.8362 3.058975 4.999443 
1 1 1   21   14   11 o  126.375   2.3511  328.263   11.957  338.569   19.275  321.817   15.244  127.947   3.6525  124.803   2.9615 3.144089 4.702246 
1 1 1   21   14   12 o  100.987   2.5287  213.937   10.213  197.832   16.253  224.445   13.128   97.762   4.0309  104.213   3.0543 -6.450874 5.057351 
1 1 1   21   14   13 o   80.205   2.7042  129.552   8.7160  148.742   14.376  118.397   10.960   84.753   4.1125   75.657   3.5124 9.095657 5.408301 
1 1 1   21   14   14 o   30.327   5.3316   17.703   6.7424   31.097   11.246   10.187   8.4244   37.921   7.4563   22.734   7.6229 15.18643 10.66319 
1 1 1   21   14   15 o  104.543   2.8281  226.410   12.194  226.236   17.176  226.588   17.315  104.504   3.9850  104.582   4.0141 -0.7785797E-01 5.656290 
1 1 1   21   14   16 o   76.183   3.3903  120.745   10.598  123.102   14.361  117.926   15.704   77.029   4.5201   75.336   5.0541 1.693245 6.780505 
1 1 1   21   14   17 o  135.186   2.5627  379.521   14.248  358.120   20.539  399.373   19.781  131.476   3.7876  138.896   3.4530 -7.420242 5.125339 
1 1 1   21   14   18 o   82.210   2.7731  140.515   9.1409  138.828   14.722  141.573   11.661   81.750   4.3662   82.670   3.4200 -0.9204102 5.546154 
1 1 1   21   14   19 o   36.358   5.3434   28.738   7.8897   22.970   11.244   34.333   11.074   32.295   8.3720   40.422   6.6421 -8.127087 10.68680 
1 1 1   21   14   20 o   96.457   3.1129  194.945   12.113  187.025   19.024  200.345   15.708   94.700   4.8707   98.214   3.8777 -3.514687 6.225791 
1 1 1   21   14   21 o  105.397   3.1054  230.235   13.353  239.554   20.621  223.508   17.522  107.154   4.6660  103.640   4.0991 3.514160 6.210779 
1 1 1   21   14   22 o   26.382   6.0187   13.905   9.1833 -12.9953   17.136   24.743   10.877   19.390   8.9898   33.373   8.0052 -13.98230 12.03744 
1 1 1   21   14   23 o   52.822   4.9276   55.237   10.314   74.626   17.894   45.590   12.622   59.220   7.3260   46.424   6.5920 12.79612 9.855192 
1 1 1   21   14   24 o   47.712   4.3907   47.975   8.6150   53.241   12.676   43.456   11.744   50.148   6.1286   45.275   6.2892 4.872986 8.781400 
1 1 1   21   14   25 o  129.145   2.7216  347.782   14.458  351.876   21.287  344.277   19.699  129.798   3.9763  128.492   3.7171 1.306961 5.443125 
1 1 1   21   14   26 o   16.838   5.3336  -3.7429   7.5953  -6.9041   11.958  -1.6052   9.8335   16.831   7.6959   16.845   7.3867 -0.1365471E-01 10.66726 
1 1 1   21   14   27 o   55.532   5.3852   62.899   11.377   57.300   13.442   77.034   21.360   51.846   6.2863   59.219   8.7454 -7.372498 10.77033 
1 1 1   21   14   28 o   32.229   6.0826   23.633   8.2131   24.346   12.186   23.039   11.117   32.629   8.8372   31.829   8.3605 0.7999363 12.16529 
1 1 1   21   14   29 o   69.829   3.4906  103.265   10.034   98.898   14.419  107.367   13.973   68.331   5.1161   71.326   4.7499 -2.995514 6.981173 
1 1 1   21   14   30 o   73.119   4.1240  114.151   12.321  135.899   17.915   94.631   16.973   79.888   5.4371   66.349   6.2023 13.53867 8.248032 
1 1 1   21   14   31 o   56.051   4.1623   67.546   9.6112   64.571   13.680   70.445   13.506   54.766   6.0562   57.336   5.7114 -2.570469 8.324546 
1 1 1   21   14   32 o   57.998   6.5240  102.382   12.424   31.333   21.664  137.206   15.167   35.560   12.221   80.437   4.5716 -44.87758 13.04796 
1 1 1   21   14   33 o   60.064   4.0696   78.149   10.076   80.553   14.195   75.707   14.304   61.054   5.6372   59.074   5.8709 1.979416 8.139157 
1 1 1   21   14   34 o   25.196   7.3367   6.0399   13.458 -11.0440   19.934   20.348   18.243   20.619   9.6055   29.772   11.092 -9.153015 14.67343 
1 1 1   21   14   35 o   44.366   7.8834   69.479   14.296   76.041   14.810 -20.2026   54.748   58.671   6.1202   30.062   14.531 28.60952 15.76684 
1 1 1   21   14   36 o   31.649   7.6463   26.490   12.143   30.520   14.173   15.368   23.546   34.829   9.5709   28.470   11.927 6.359089 15.29257 
1 1 1   21   14   37 o   27.361   7.6409   15.652   11.521   13.327   13.393   22.270   22.596   24.722   9.4389   29.999   12.018 -5.277386 15.28179 
1 1 1   21   14   38 o   23.229   7.2828   2.1938   12.166  -2.4844   14.125   15.636   23.943   18.745   8.4899   27.712   11.835 -8.966303 14.56562 
1 1 1   21   14   39 o   19.995   8.8038   2.2482   14.094   2.2482   14.094   0.0000   0.0000   19.995   8.8038  ?   ?       ?      ? 
1 1 1   21   14   40 o   33.460   8.3351   25.870   13.769   11.950   16.175   62.502   26.240   23.956   9.9481   42.965   13.376 -19.00971 16.67013 
1 1 1   21   15    0 o   63.898   3.1907   85.608   11.756   85.608   11.756   85.608   11.756   63.898   4.5124   63.898   4.5124 0.000000 0.000000 
1 1 1   21   15    1 o   35.832   4.8690   27.212   7.0436   30.569   10.070   23.997   9.8553   38.358   6.3654   33.305   7.3696 5.052853 9.738058 
1 1 1   21   15    2 o  189.739   2.3794  745.721   18.464  758.164   24.681  729.905   27.824  191.568   3.1238  187.910   3.5901 3.658234 4.758883 
1 1 1   21   15    3 o   89.924   2.7452  167.306   10.175  160.213   14.397  174.383   14.381   88.014   3.9660   91.835   3.7969 -3.820938 5.490477 
1 1 1   21   15    4 o  200.037   2.4106  825.909   19.637  820.341   25.761  833.634   30.340  199.266   3.1345  200.807   3.6632 -1.541077 4.821250 
1 1 1   21   15    5 o   97.890   2.6791  198.063   10.812  200.815   15.558  195.492   15.036   98.545   3.8278   97.235   3.7493 1.309288 5.358150 
1 1 1   21   15    6 o  234.449   2.7182  1136.27   26.275  1153.93   37.745  1119.67   36.599  236.210   3.8743  232.687   3.8136 3.522842 5.436311 
1 1 1   21   15    7 o  172.004   2.3535  610.841   16.505  607.437   21.728  615.484   25.377  171.466   3.0724  172.542   3.5660 -1.076187 4.707066 
1 1 1   21   15    8 o  130.748   2.3503  352.655   12.519  348.996   16.426  357.727   19.338  129.963   3.0643  131.533   3.5646 -1.570496 4.700692 
1 1 1   21   15    9 o  156.987   2.3404  510.474   14.997  516.812   19.900  502.144   22.815  158.145   3.0509  155.829   3.5499 2.316528 4.680801 
1 1 1   21   15   10 o   93.363   2.6842  181.380   10.276  166.619   14.941  194.629   14.155   89.718   4.0377   97.009   3.5379 -7.290405 5.368433 
1 1 1   21   15   11 o   58.525   3.2260   70.465   7.5650   73.182   12.354   68.835   9.5689   59.388   5.0436   57.662   4.0235 1.726624 6.451901 
1 1 1   21   15   12 o   69.679   3.1354  107.133   8.3848   79.095   13.509  124.703   10.694   61.708   5.3079   77.651   3.3391 -15.94355 6.270785 
1 1 1   21   15   13 o   88.924   2.6010  160.126   9.2730  178.478   15.330  149.536   11.645   92.824   4.0042   85.024   3.3207 7.800194 5.201991 
1 1 1   21   15   14 o   55.954   3.5578   67.526   7.8690   54.064   12.243   77.003   10.272   50.951   5.8259   60.958   4.0856 -10.00784 7.115658 
1 1 1   21   15   15 o   90.069   2.9124  167.943   10.809  178.457   15.567  158.157   15.020   92.793   4.0676   87.345   4.1692 5.447937 5.824727 
1 1 1   21   15   16 o   52.268   4.2304   57.013   9.1167   56.610   12.706   57.442   13.088   52.085   5.9148   52.452   6.0499 -0.3670464 8.460882 
1 1 1   21   15   17 o   89.624   2.6718  166.735   9.6357  165.934   15.398  167.251   12.353   89.391   4.1764   89.857   3.3332 -0.4668961 5.343513 
1 1 1   21   15   18 o  134.154   2.4104  376.886   12.997  354.815   20.520  391.671   16.795  130.757   3.8049  137.551   2.9603 -6.793915 4.820876 
1 1 1   21   15   19 o  100.182   3.0472  208.404   12.335  210.968   19.560  206.710   15.894  100.605   4.7138   99.759   3.8628 0.8462067 6.094366 
1 1 1   21   15   20 o  121.954   2.6802  308.632   13.434  314.569   19.928  303.687   18.188  122.992   3.9285  120.916   3.6469 2.076622 5.360357 
1 1 1   21   15   21 o   26.386   5.5137   11.715   7.7632   27.872   11.342  -2.5241   10.648   35.449   7.9533   17.323   7.6385 18.12652 11.02732 
1 1 1   21   15   22 o   50.492   4.9385   50.471   9.4619   63.600   17.963   45.429   11.132   54.512   7.9894   46.473   5.8075 8.039028 9.877083 
1 1 1   21   15   23 o   89.586   3.5646  172.145   12.339  157.275   21.062  179.916   15.226   86.279   5.9187   92.893   3.9741 -6.613373 7.129139 
1 1 1   21   15   24 o  118.383   2.6702  292.395   13.033  289.825   18.648  294.849   18.221  117.852   3.8365  118.913   3.7151 -1.060486 5.340466 
1 1 1   21   15   25 o   43.420   4.9538   40.544   8.5178   52.238   12.744   31.102   11.451   49.530   6.2383   37.311   7.6971 12.21986 9.907632 
1 1 1   21   15   26 o   68.294   4.1901  100.802   11.246   92.862   18.564  105.404   14.134   65.801   6.8402   70.787   4.8413 -4.985901 8.380144 
1 1 1   21   15   27 o   74.159   4.3316  117.581   13.091  119.776   17.344  114.674   19.957   75.166   5.5945   73.152   6.6145 2.013809 8.663106 
1 1 1   21   15   28 o   71.662   3.5536  108.725   10.496  106.593   15.019  110.760   14.675   70.935   5.1335   72.388   4.9153 -1.453018 7.107210 
1 1 1   21   15   29 o  101.252   3.0460  215.530   12.715  212.988   17.682  218.253   18.297  100.655   4.2591  101.848   4.3556 -1.192253 6.091922 
1 1 1   21   15   30 o   44.343   6.0145   44.890   10.575   49.318   15.665   41.183   14.334   46.391   8.5003   42.296   8.5114 4.094280 12.02907 
1 1 1   21   15   31 o   40.854   5.3950   37.033   8.8178   48.012   13.218   28.229   11.837   46.865   6.8384   34.844   8.3462 12.02113 10.78993 
1 1 1   21   15   32 o   49.235   4.8417   53.819   9.7470   58.666   13.420   48.407   14.181   51.853   6.2748   46.617   7.3754 5.236454 9.683428 
1 1 1   21   15   33 o   67.647   3.9786  100.059   10.922   92.442   16.581  105.898   14.517   65.014   6.1835   70.279   5.0083 -5.264267 7.957262 
1 1 1   21   15   34 o   57.159   6.3815   86.579   12.030   59.119   22.628   97.397   14.203   47.193   11.687   67.126   5.1301 -19.93246 12.76303 
1 1 1   21   15   35 o   37.858   7.2891   39.228   11.559   43.424   13.562   28.084   22.103   42.893   7.9591   32.824   12.214 10.06873 14.57810 
1 1 1   21   15   36 o   25.726   7.3960   12.630   11.333   12.706   13.180   12.417   22.203   24.487   9.3601   26.965   11.454 -2.477774 14.79198 
1 1 1   21   15   37 o   40.449   8.0037   44.745   13.466   42.017   16.729   49.765   22.695   39.837   10.152   41.061   12.376 -1.224834 16.00745 
1 1 1   21   15   38 o   24.944   8.1551  -3.8228   18.935   18.794   31.305 -16.8698   23.777   29.389   13.021   20.499   9.8224 8.890118 16.31024 
1 1 1   21   15   39 o   14.165   6.9341 -20.2637   13.593 -20.2637   13.593   0.0000   0.0000   14.165   6.9341  ?   ?       ?      ? 
1 1 1   21   15   40 o   21.333   6.9656   0.2770   12.577   0.9205   14.347  -1.8602   26.145   19.431   8.6984   23.235   10.882 -3.804131 13.93113 
1 1 1   21   16    0 o  201.449   2.5807  838.805   30.301  838.805   30.301  838.805   30.301  201.449   3.6497  201.449   3.6497 0.000000 0.000000 
1 1 1   21   16    1 o   65.091   3.1471   88.002   8.4118   97.093   11.864   78.811   11.928   68.497   4.1995   61.686   4.6885 6.811306 6.294247 
1 1 1   21   16    2 o   81.584   2.6155  136.089   8.7120  127.486   11.398  148.176   13.511   78.529   3.5192   84.639   3.8703 -6.110771 5.231051 
1 1 1   21   16    3 o  109.004   2.3934  244.861   10.627  241.029   13.920  250.215   16.452  108.003   3.1249  110.005   3.6261 -2.001289 4.786799 
1 1 1   21   16    4 o  150.689   2.3324  469.547   14.321  470.723   18.861  467.944   22.008  150.939   3.0297  150.440   3.5469 0.4992371 4.664772 
1 1 1   21   16    5 o   63.078   3.3486   82.379   8.6992   83.635   12.690   81.267   11.949   63.524   4.8434   62.632   4.6255 0.8919907 6.697262 
1 1 1   21   16    6 o  204.123   2.6151  861.500   22.012  843.792   30.757  880.091   31.516  201.975   3.6922  206.272   3.7044 -4.296585 5.230215 
1 1 1   21   16    7 o   27.822   5.4149   16.314   6.3649   14.054   8.3447   19.459   9.8422   25.679   7.4454   29.965   7.8644 -4.285942 10.82970 
1 1 1   21   16    8 o  203.745   2.4357  859.890   20.257  868.594   26.866  848.421   30.839  204.985   3.1777  202.506   3.6923 2.478989 4.871485 
1 1 1   21   16    9 o   54.964   3.5380   62.801   7.9670   61.621   11.914   63.756   10.715   54.475   5.3029   55.452   4.6849 -0.9774208 7.075952 
1 1 1   21   16   10 o   94.399   2.6675  184.320   10.366  186.442   15.176  182.464   14.192   94.898   3.8774   93.899   3.6644 0.9983292 5.334980 
1 1 1   21   16   11 f  237.816   2.5666  1173.12   24.957  1150.45   37.664  1190.86   33.321  235.703   3.8743  239.929   3.3672 -4.225464 5.133104 
1 1 1   21   16   12 o   49.790   3.5907   49.408   7.1330   59.785   12.078   43.850   8.8392   53.612   5.4622   45.968   4.6622 7.644009 7.181381 
1 1 1   21   16   13 o  197.164   2.3854  802.494   18.903  812.716   30.443  796.081   24.115  198.110   3.7258  196.218   2.9797 1.892441 4.770762 
1 1 1   21   16   14 f   70.938   3.1051  108.037   8.7541   86.668   13.441  123.779   11.536   64.565   5.0475   77.312   3.6179 -12.74735 6.210201 
1 1 1   21   16   15 o   49.313   3.6410   49.477   7.1791   55.313   11.958   46.188   8.9771   51.487   5.6309   47.139   4.6173 4.347744 7.281929 
1 1 1   21   16   16 o  109.980   2.9306  250.777   13.166  247.976   17.410  254.518   20.123  109.316   3.8613  110.644   4.4096 -1.328201 5.861258 
1 1 1   21   16   17 o   20.253   5.6217   5.3152   6.6721   5.4506   11.013   5.2367   8.3864   21.245   8.4299   19.261   7.4399 1.983644 11.24341 
1 1 1   21   16   18 o   70.003   2.9526  100.784   8.2521  106.471   13.649   97.508   10.360   71.473   4.6300   68.533   3.6652 2.939110 5.905143 
1 1 1   21   16   19 o  112.934   2.8956  269.483   13.216  241.767   20.197  290.236   17.477  107.657   4.5486  118.211   3.5846 -10.55442 5.791269 
1 1 1   21   16   20 o   42.196   4.8477   38.346   8.2232   36.664   11.962   39.853   11.323   40.945   7.3534   43.448   6.3188 -2.502682 9.695385 
1 1 1   21   16   21 o   30.938   5.8271   21.322   7.5690   19.972   11.160   22.471   10.300   30.060   8.5785   31.816   7.8885 -1.755358 11.65417 
1 1 1   21   16   22 o  105.624   2.7575  233.051   11.984  217.471   17.091  248.124   16.810  102.097   4.0587  109.152   3.7339 -7.055099 5.514996 
1 1 1   21   16   23 o   62.615   4.1768   79.482   10.225   94.675   18.130   72.396   12.381   66.596   6.6007   58.633   5.1198 7.962845 8.353514 
1 1 1   21   16   24 o   96.123   2.9285  192.735   11.585  176.087   15.967  211.243   16.835   91.725   4.2206  100.520   4.0607 -8.795097 5.856907 
1 1 1   21   16   25 o   21.831   5.8235   5.8304   7.5011   14.686   11.538  -0.6528   9.8723   26.397   8.9205   17.265   7.4884 9.131899 11.64700 
1 1 1   21   16   26 o   44.838   5.1153   44.947   8.9898   36.936   13.397   51.510   12.125   40.466   8.3050   49.209   5.9742 -8.742779 10.23056 
1 1 1   21   16   27 o   35.958   6.8487   26.656   10.065   18.685   12.186   43.765   17.853   28.846   9.1353   43.069   10.206 -14.22313 13.69745 
1 1 1   21   16   28 o   48.009   4.6384   49.289   9.1479   55.037   13.649   44.601   12.326   50.533   6.5489   45.485   6.5703 5.048729 9.276723 
1 1 1   21   16   29 o   55.167   4.8924   66.466   11.070   58.682   15.630   74.300   15.680   51.740   7.3243   58.594   6.4883 -6.854240 9.784853 
1 1 1   21   16   30 o   53.956   4.4871   62.769   9.9402   71.583   14.536   55.027   13.624   57.589   6.1198   50.324   6.5637 7.265079 8.974133 
1 1 1   21   16   31 o   31.678   6.4924   23.906   8.9744   23.437   12.618   24.386   12.767   31.382   9.1715   31.973   9.1917 -0.5916290 12.98476 
1 1 1   21   16   32 o   22.261   6.0935   8.7991   7.9235   8.2172   12.136   9.2314   10.461   22.384   8.8597   22.139   8.3683 0.2456188 12.18701 
1 1 1   21   16   33 o   25.791   6.2699   11.144   8.5073   26.990   14.138   2.1511   10.651   32.998   9.7269   18.583   7.9143 14.41496 12.53988 
1 1 1   21   16   34 o   24.286   7.8060   2.0128   10.957   12.312   33.290   0.7614   11.604   30.011   13.356   18.561   8.0845 11.45033 15.61195 
1 1 1   21   16   35 o   36.592   8.1704   34.664   15.218   15.252   21.017   56.056   22.063   27.719   11.409   45.465   11.698 -17.74648 16.34071 
1 1 1   21   16   36 o   32.287   7.4348   19.552   11.347   7.1319   13.360   51.710   21.497   21.802   9.0464   42.772   11.801 -20.96954 14.86968 
1 1 1   21   16   37 o   69.736   9.9019  124.226   28.480   0.0000   0.0000  124.226   28.480  ?   ?    69.736   9.9019      ?      ? 
1 1 1   21   16   38 o   29.367   8.1006   23.128   13.271   22.185   15.519   25.694   25.599   28.663   10.302   30.071   12.504 -1.407692 16.20119 
1 1 1   21   16   39 o   17.289   5.8780 -13.1310   11.701  -4.4203   13.193 -45.2356   25.329   17.253   7.9597   17.325   8.6515 -0.7213783E-01 11.75609 
1 1 1   21   17    0 o   70.078   3.0186  102.606   12.234  102.606   12.234  102.606   12.234   70.078   4.2690   70.078   4.2690 0.000000 0.000000 
1 1 1   21   17    1 o   22.835   5.5058   9.6888   6.1823   7.6188   8.1040   12.571   9.5621   20.750   7.4463   24.919   8.1122 -4.169277 11.01159 
1 1 1   21   17    2 o  113.861   2.9468  267.927   13.463  266.269   17.134  270.602   21.765  113.454   3.6617  114.269   4.6181 -0.8148880 5.893639 
1 1 1   21   17    3 o  185.765   2.5535  713.790   19.563  705.811   27.575  721.877   27.760  184.718   3.6194  186.811   3.6028 -2.093033 5.106921 
1 1 1   21   17    4 o  104.672   2.4340  225.693   10.392  220.807   13.649  232.434   16.030  103.350   3.2020  105.995   3.6667 -2.645920 4.868008 
1 1 1   21   17    5 o   35.995   5.0968   29.273   7.3763   15.722   10.781   41.198   10.114   27.457   8.5784   44.532   5.5066 -17.07551 10.19368 
1 1 1   21   17    6 o  176.957   2.5397  647.854   18.535  646.637   26.303  649.056   26.123  176.789   3.6074  177.124   3.5758 -0.3353577 5.079342 
1 1 1   21   17    7 o  133.361   2.3441  363.982   12.692  347.333   16.393  388.896   20.053  129.621   3.0663  137.101   3.5464 -7.479889 4.688182 
1 1 1   21   17    8 o  134.904   2.3537  377.331   12.931  382.266   17.052  370.653   19.837  135.978   3.0405  133.830   3.5938 2.148132 4.707486 
1 1 1   21   17    9 o  179.525   2.4664  667.326   18.211  661.417   26.704  672.463   24.900  178.757   3.6220  180.292   3.3486 -1.534973 4.932726 
1 1 1   21   17   10 o   60.833   3.3505   76.844   8.3777   76.470   12.352   77.162   11.401   60.679   4.9357   60.987   4.5323 -0.3079185 6.700968 
1 1 1   21   17   11 o   60.593   3.1547   75.295   7.6103   79.455   12.673   72.949   9.5174   61.844   4.9685   59.342   3.8886 2.501987 6.309303 
1 1 1   21   17   12 o   44.834   4.0389   42.909   7.0433   38.620   11.826   45.266   8.7678   42.971   6.6729   46.697   4.5524 -3.726112 8.077849 
1 1 1   21   17   13 o   41.636   4.2499   35.917   7.0662   37.422   11.643   35.039   8.8911   42.258   6.6800   41.015   5.2559 1.242886 8.499806 
1 1 1   21   17   14 o   92.031   2.6313  179.276   9.6514  160.077   15.317  191.918   12.429   87.784   4.2306   96.277   3.1301 -8.492775 5.262599 
1 1 1   21   17   15 o   23.369   5.8384   9.6496   7.0465   13.896   10.787   6.4887   9.3067   26.067   8.6224   20.672   7.8741 5.394636 11.67677 
1 1 1   21   17   16 o   29.719   5.9370   18.733   8.1010   9.4551   11.361   28.329   11.555   23.586   8.7604   35.852   8.0153 -12.26614 11.87390 
1 1 1   21   17   17 o   58.534   3.4653   71.944   8.2253   69.215   12.721   73.905   10.782   57.502   5.3640   59.565   4.3889 -2.062721 6.930682 
1 1 1   21   17   18 o   31.614   5.1940   26.656   6.9982   4.8090   13.462   34.745   8.1921   22.459   9.1746   40.769   4.8719 -18.31019 10.38792 
1 1 1   21   17   19 o  138.086   2.6043  395.610   14.770  404.683   22.028  388.199   19.907  139.477   3.8291  136.695   3.5310 2.781769 5.208663 
1 1 1   21   17   20 o  118.807   2.6504  293.487   12.984  289.788   18.119  297.391   18.615  118.045   3.7216  119.569   3.7747 -1.524117 5.300780 
1 1 1   21   17   21 o   52.883   3.8369   58.257   8.3049   64.234   12.739   53.838   10.952   55.179   5.5976   50.586   5.2493 4.593613 7.673882 
1 1 1   21   17   22 o   23.330   5.5321   7.0088   7.3722   21.441   11.078  -4.4622   9.8767   30.849   8.4554   15.812   7.1358 15.03713 11.06411 
1 1 1   21   17   23 o   40.822   6.1859   39.029   9.3652   32.595   17.541   41.593   11.076   37.411   10.780   44.232   6.0711 -6.820950 12.37173 
1 1 1   21   17   24 o   59.759   3.7674   77.011   9.0790   62.659   13.368   89.301   12.370   54.300   5.9688   65.218   4.5986 -10.91752 7.534842 
1 1 1   21   17   25 o   61.021   3.8510   79.186   9.6210   89.574   13.566   68.675   13.647   65.178   5.0465   56.865   5.8185 8.312740 7.702101 
1 1 1   21   17   26 o   36.254   7.3263   34.378   11.158   39.099   12.081   6.9590   29.114   42.524   6.8882   29.985   12.933 12.53904 14.65264 
1 1 1   21   17   27 o   25.550   6.1683   12.105   8.0126   21.226   12.594   5.9022   10.386   30.460   9.2279   20.640   8.1875 9.819641 12.33656 
1 1 1   21   17   28 o  105.536   2.9442  235.302   12.758  218.744   18.477  250.387   17.636  101.852   4.3984  109.220   3.9151 -7.368095 5.888455 
1 1 1   21   17   29 o   37.677   6.1534   32.734   9.2092   34.730   14.696   31.443   11.817   38.331   9.3739   37.023   7.9742 1.307079 12.30682 
1 1 1   21   17   30 o  114.208   3.0391  276.585   14.276  266.307   20.718  285.878   19.700  112.055   4.4827  116.360   4.1048 -4.304710 6.078182 
1 1 1   21   17   31 o   45.799   5.3641   47.162   9.6743   34.494   13.053   62.599   14.410   38.226   8.4994   53.371   6.5462 -15.14505 10.72811 
1 1 1   21   17   32 o   53.933   5.3724   61.427   10.939   77.393   20.861   55.372   12.847   57.646   8.7738   50.220   6.2024 7.426483 10.74471 
1 1 1   21   17   33 o   18.245   5.6302  -1.3326   8.0713   6.0562   12.424  -6.7284   10.617   21.223   8.7581   15.267   7.0775 5.955879 11.26034 
1 1 1   21   17   34 o   29.416   7.6645   13.050   14.539 -11.5180   19.895   41.212   21.301   20.192   9.4680   38.640   12.055 -18.44811 15.32890 
1 1 1   21   17   35 o   47.596   6.8374   56.396   12.195   55.483   14.635   58.468   22.055   49.123   7.2236   46.069   11.611 3.054302 13.67480 
1 1 1   21   17   36 o   21.675   6.8395   0.5797   11.366  -3.0886   13.562   9.2384   20.836   18.230   8.2811   25.120   10.887 -6.890505 13.67893 
1 1 1   21   17   37 o   28.410   7.9757   20.577   13.248   20.534   15.647   20.687   24.898   28.010   10.304   28.809   12.177 -0.7988224 15.95139 
1 1 1   21   17   38 o   51.971   7.5761   90.669   15.874  112.409   19.116   42.387   28.489   69.424   6.6762   34.518   13.602 34.90659 15.15223 
1 1 1   21   18    0 o  104.362   2.2283  225.514   13.536  225.514   13.536  225.514   13.536  104.362   3.1513  104.362   3.1513 0.000000 0.000000 
1 1 1   21   18    1 o  207.393   2.4221  889.047   20.484  885.076   26.987  894.443   31.462  206.894   3.1626  207.891   3.6693 -0.9970856 4.844140 
1 1 1   21   18    2 o   39.949   4.0234   32.808   6.5607   30.673   8.5754   35.821   10.188   38.416   5.4122   41.482   5.9548 -3.065578 8.046800 
1 1 1   21   18    3 o   82.895   2.6088  142.336   8.8211  142.950   11.657  141.512   13.494   83.128   3.3999   82.662   3.9578 0.4650040 5.217655 
1 1 1   21   18    4 o   62.275   3.2980   80.182   8.4553   87.020   12.353   74.155   11.598   64.768   4.6243   59.783   4.7036 4.984917 6.596066 
1 1 1   21   18    5 o   35.701   5.0671   26.703   7.3098   37.085   11.015   18.533   9.7716   42.169   6.3333   29.234   7.9115 12.93443 10.13422 
1 1 1   21   18    6 o  175.319   2.7945  623.526   19.710  580.957   24.892  695.071   32.270  167.530   3.6024  183.107   4.2730 -15.57751 5.588919 
1 1 1   21   18    7 o   34.282   4.7997   24.958   6.4779   22.519   8.4416   28.450   10.103   32.274   6.5652   36.290   7.0034 -4.016258 9.599454 
1 1 1   21   18    8 o   84.812   2.7943  148.068   9.7377  160.186   14.565  138.274   13.095   87.924   4.0164   81.701   3.8859 6.222153 5.588575 
1 1 1   21   18    9 o  187.214   2.4719  726.562   19.015  712.637   27.981  738.512   25.921  185.511   3.6570  188.916   3.3267 -3.404907 4.943703 
1 1 1   21   18   10 o   68.766   2.8952   96.200   8.0118  106.354   13.089   90.115   10.132   71.580   4.4334   65.952   3.7246 5.627724 5.790328 
1 1 1   21   18   11 o  224.719   2.4559  1037.97   22.002  1077.42   36.389  1015.23   27.623  227.937   3.8707  221.501   3.0237 6.435974 4.911751 
1 1 1   21   18   12 o   95.532   2.5252  190.994   9.6904  180.828   15.349  197.733   12.496   93.337   3.9871   97.727   3.1001 -4.390617 5.050491 
1 1 1   21   18   13 o  130.077   2.4448  350.888   12.985  349.653   19.791  351.822   17.207  129.828   3.6960  130.326   3.2011 -0.4979553 4.889578 
1 1 1   21   18   14 o   21.175   5.5585   5.7783   6.2650   12.791   10.996   2.4079   7.6233   25.408   8.7081   16.942   6.9105 8.465279 11.11695 
1 1 1   21   18   15 o   36.650   5.1887   29.586   7.5452   25.844   11.743   32.218   9.8470   34.140   8.3974   39.159   6.0969 -5.018333 10.37734 
1 1 1   21   18   16 o   72.765   3.0257  109.397   9.0141  117.536   13.774  103.301   11.921   75.083   4.4480   70.447   4.1030 4.636032 6.051355 
1 1 1   21   18   17 f   88.736   2.8231  164.940   10.228  155.664   15.341  172.362   13.723   86.409   4.3047   91.064   3.6536 -4.654793 5.646183 
1 1 1   21   18   18 o  105.068   3.0217  229.935   12.439  230.671   21.209  229.549   15.358  105.021   4.8964  105.115   3.5424 -0.9461975E-01 6.043495 
1 1 1   21   18   19 o   82.575   2.9217  142.239   9.9406  140.074   14.317  144.254   13.813   81.945   4.2360   83.205   4.0251 -1.259712 5.843400 
1 1 1   21   18   20 o   59.613   3.5771   74.761   8.7887   73.725   12.616   75.738   12.250   59.186   5.1681   60.039   4.9471 -0.8530617 7.154181 
1 1 1   21   18   21 o   21.885   5.7004   6.2514   7.1452   15.406   11.079  -0.2691   9.3498   26.775   8.7325   16.995   7.3296 9.779631 11.40085 
1 1 1   21   18   22 o   26.939   6.1042   15.320   7.5823   18.727   11.947   13.022   9.8119   29.047   9.0227   24.830   8.2240 4.216389 12.20838 
1 1 1   21   18   23 o   94.279   3.7579  189.915   14.422  168.577   21.359  207.795   19.552   89.138   5.8097   99.420   4.7681 -10.28259 7.515811 
1 1 1   21   18   24 o   40.566   5.4051   37.559   8.5903   29.947   13.252   43.076   11.282   36.165   8.9362   44.967   6.0829 -8.802143 10.81012 
1 1 1   21   18   25 o   31.003   6.2199   21.829   8.2868   24.267   12.464   19.897   11.094   32.439   8.9997   29.566   8.5881 2.872490 12.43989 
1 1 1   21   18   26 o   35.648   6.7653   29.202   9.9357   27.442   12.601   32.094   16.154   34.461   8.8266   36.835   10.255 -2.374828 13.53065 
1 1 1   21   18   27 o   16.496   5.2721  -7.8971   7.7015   2.4674   12.251 -14.6696   9.9030   20.186   8.5376   12.807   6.1877 7.379866 10.54414 
1 1 1   21   18   28 o   55.208   4.8185   67.541   10.453   62.215   17.202   70.658   13.161   52.955   7.8762   57.462   5.5532 -4.506718 9.637003 
1 1 1   21   18   29 o   61.220   5.6747   92.840   11.952   65.153   21.064  105.988   14.515   51.968   10.192   70.473   4.9938 -18.50544 11.34930 
1 1 1   21   18   30 o   24.581   6.2240   12.131   8.1816   17.796   12.022   7.2438   11.166   27.724   9.0995   21.438   8.4941 6.286283 12.44793 
1 1 1   21   18   31 o   24.190   6.3815   11.476   8.8522   16.619   12.037   5.4183   13.064   26.868   9.1112   21.513   8.9376 5.355183 12.76300 
1 1 1   21   18   32 o   72.592   4.6886  124.042   12.888  139.509   16.145   96.871   21.398   80.468   4.8645   64.717   8.0167 15.75172 9.377156 
1 1 1   21   18   33 o   22.485   6.2284   8.5469   8.6327   14.003   12.314   3.2733   12.106   25.111   9.1551   19.860   8.4472 5.250475 12.45679 
1 1 1   21   18   34 o   22.297   7.1236  -1.3455   13.997  -5.2905   19.476   2.8690   20.130   21.133   9.7210   23.460   10.416 -2.327888 14.24718 
1 1 1   21   18   35 o   34.756   7.6648   29.120   11.411   21.732   13.546   47.175   21.176   29.070   9.6647   40.442   11.899 -11.37198 15.32956 
1 1 1   21   18   36 o   43.877   7.9837   55.794   14.071   57.955   16.798   50.712   25.763   48.108   8.7898   39.646   13.330 8.462067 15.96735 
1 1 1   21   18   37 o   29.695   8.0975   19.027   13.745   6.6780   16.626   45.691   24.430   22.355   9.7071   37.034   12.963 -14.67953 16.19506 
1 1 1   21   18   38 o   32.684   7.9362   18.208   13.634  -1.0303   16.022   68.698   25.956   19.686   8.9650   45.682   13.098 -25.99620 15.87232 
1 1 1   21   19    0 o   11.502   5.1598   0.9356   7.5080   0.9356   7.5080   0.9356   7.5080   11.502   7.2970   11.502   7.2970 0.000000 0.000000 
1 1 1   21   19    1 o   47.036   3.2277   45.930   6.2569   47.919   8.8403   43.934   8.8571   48.064   4.4595   46.009   4.6675 2.054760 6.455414 
1 1 1   21   19    2 o  163.790   2.3215  556.413   15.527  565.509   20.655  544.593   23.545  165.372   3.0284  162.208   3.5194 3.164001 4.642935 
1 1 1   21   19    3 o  108.812   2.3675  245.093   10.519  245.745   13.939  244.229   16.032  109.007   3.1004  108.618   3.5787 0.3883896 4.734992 
1 1 1   21   19    4 o   83.137   2.8149  143.293   9.6447  141.100   13.852  145.357   13.437   82.511   4.0703   83.764   3.8894 -1.253716 5.629792 
1 1 1   21   19    5 o   54.076   3.6355   61.164   8.0575   56.096   11.735   65.684   11.083   51.914   5.4804   56.238   4.7783 -4.323822 7.270954 
1 1 1   21   19    6 o   97.479   2.4705  194.520   9.8008  184.038   12.719  209.842   15.377   94.306   3.2700  100.651   3.7042 -6.345459 4.941023 
1 1 1   21   19    7 o  119.132   2.5039  294.404   12.273  286.494   17.850  301.495   16.902  117.591   3.6804  120.673   3.3960 -3.081100 5.007800 
1 1 1   21   19    8 o   61.461   3.4085   78.843   8.6046   74.808   12.546   82.427   11.824   59.942   5.0745   62.979   4.5520 -3.036934 6.816996 
1 1 1   21   19    9 o   66.941   3.1642   92.788   8.7001   97.018   13.015   89.372   11.698   68.297   4.6204   65.585   4.3244 2.712090 6.328394 
1 1 1   21   19   10 o   98.794   2.4881  200.318   9.8431  210.617   16.143  194.223   12.419  100.738   3.8854   96.849   3.1089 3.889473 4.976128 
1 1 1   21   19   11 o  129.045   2.3543  342.461   12.176  356.137   19.879  334.249   15.404  131.022   3.6786  127.069   2.9392 3.953339 4.708605 
1 1 1   21   19   12 o  193.433   2.4835  778.511   19.691  752.213   29.239  800.336   26.637  190.365   3.7240  196.501   3.2867 -6.136292 4.966932 
1 1 1   21   19   13 o  164.262   2.3347  558.745   15.429  562.979   24.748  556.054   19.733  164.671   3.6439  163.852   2.9200 0.8193207 4.669497 
1 1 1   21   19   14 o   58.027   3.2687   69.980   7.4928   71.221   12.595   69.300   9.3219   58.328   5.2353   57.726   3.9153 0.6024170 6.537428 
1 1 1   21   19   15 o  114.138   2.5996  271.247   12.184  265.544   17.992  276.076   16.558  112.982   3.8611  115.294   3.4820 -2.312263 5.199254 
1 1 1   21   19   16 o   50.192   3.6583   52.217   7.1881   54.564   12.393   51.027   8.8238   50.914   5.9018   49.469   4.3247 1.444942 7.316696 
1 1 1   21   19   17 o   24.178   6.1180   9.6061   7.0656   15.737   13.578   7.3294   8.2742   27.912   9.6704   20.445   7.4969 7.466509 12.23601 
1 1 1   21   19   18 o   20.358   5.9204   2.8927   8.1116  -1.0423   11.190   7.2496   11.775   18.285   7.9519   22.431   8.7733 -4.145189 11.84077 
1 1 1   21   19   19 o   44.963   4.8505   42.862   8.9423   39.676   11.886   47.017   13.575   43.096   6.6868   46.829   7.0282 -3.733021 9.700964 
1 1 1   21   19   20 o   40.562   4.9285   34.986   7.9116   39.777   12.743   31.981   10.093   42.376   7.5685   38.749   6.3150 3.626678 9.857059 
1 1 1   21   19   21 o   37.364   5.2817   31.486   7.8328   26.389   12.087   35.177   10.284   34.074   8.6003   40.654   6.1335 -6.579758 10.56338 
1 1 1   21   19   22 o   65.420   3.4798   90.273   9.3512   87.606   13.734   92.578   12.768   64.450   5.1667   66.391   4.6627 -1.940628 6.959594 
1 1 1   21   19   23 o  109.263   3.6141  252.332   16.258  234.676   22.933  270.170   23.051  105.331   5.2789  113.194   4.9375 -7.862640 7.228113 
1 1 1   21   19   24 o   48.175   4.4860   49.826   8.9099   50.807   12.823   48.910   12.389   48.618   6.3951   47.732   6.2929 0.8856430 8.972024 
1 1 1   21   19   25 o   21.474   6.0539   6.2575   7.9404   7.2111   12.526   5.6169   10.267   22.540   8.9757   20.408   8.1262 2.132017 12.10782 
1 1 1   21   19   26 o   27.751   6.6292   4.0556   11.609   37.548   17.945 -20.0503   15.225   39.374   10.749   16.127   7.7620 23.24708 13.25847 
1 1 1   21   19   27 o   40.111   5.5464   37.674   8.7641   28.924   13.472   44.095   11.540   35.032   9.2041   45.191   6.1914 -10.15948 11.09271 
1 1 1   21   19   28 o   64.510   4.7234   94.557   11.242   82.558   20.350   99.827   13.486   60.525   8.1519   68.494   4.7738 -7.968624 9.446864 
1 1 1   21   19   29 o   65.849   3.8247   94.148   10.291   83.748   14.969  103.470   14.171   62.139   5.8407   69.558   4.9395 -7.419235 7.649302 
1 1 1   21   19   30 o   32.127   6.1042   24.693   8.2415   24.771   12.209   24.627   11.170   32.070   8.9108   32.185   8.3452 -0.1142540 12.20838 
1 1 1   21   19   31 o   32.029   6.3857   25.117   8.7701   26.724   13.051   23.794   11.843   32.851   9.2430   31.207   8.8133 1.644022 12.77131 
1 1 1   21   19   32 o   21.841   5.9082   6.5511   8.4615  -6.2671   12.663   16.892   11.374   16.991   7.8241   26.692   8.8550 -9.700569 11.81643 
1 1 1   21   19   33 o   49.834   4.8093   56.336   9.8246   49.883   13.912   62.756   13.876   46.696   7.2236   52.972   6.3510 -6.275585 9.618506 
1 1 1   21   19   34 o   28.369   6.9756   20.782   11.567   30.477   13.854  -1.5329   21.018   34.300   9.4779   22.438   10.237 11.86200 13.95124 
1 1 1   21   19   35 o   32.366   7.1021   29.672   12.681   43.748   15.704   3.2975   21.496   41.132   9.4550   23.600   10.600 17.53193 14.20427 
1 1 1   21   19   36 o   54.248   6.9436   74.845   14.170   69.953   17.137   85.421   25.196   53.914   7.7066   54.582   11.553 -0.6676064 13.88721 
1 1 1   21   19   37 o   19.110   6.4293  -8.6436   12.032  -9.9204   14.019  -5.0727   23.445   16.397   7.7677   21.823   10.247 -5.425577 12.85860 
1 1 1   21   20    0 o  166.098   2.1496  570.470   20.810  570.470   20.810  570.470   20.810  166.098   3.0400  166.098   3.0400 0.000000 0.000000 
1 1 1   21   20    1 o  124.065   2.1410  318.517   10.954  311.867   15.485  325.179   15.497  122.764   3.0582  125.365   2.9972 -2.601265 4.281991 
1 1 1   21   20    2 o  121.919   2.1472  307.556   10.797  310.788   15.369  304.408   15.171  122.551   3.0405  121.288   3.0326 1.263283 4.294375 
1 1 1   21   20    3 o  114.218   2.1679  269.985   10.212  271.429   14.508  268.567   14.377  114.520   3.0716  113.916   3.0600 0.6039658 4.335745 
1 1 1   21   20    4 o   42.592   4.6018   39.968   7.5363   27.323   10.849   51.758   10.476   35.341   7.6640   49.844   5.0960 -14.50309 9.203587 
1 1 1   21   20    5 o   53.729   3.6264   60.081   8.0274   62.008   11.687   58.360   11.045   54.536   5.1959   52.922   5.0602 1.613483 7.252765 
1 1 1   21   20    6 o   52.537   3.6435   58.318   7.7827   51.292   11.549   64.163   10.534   49.540   5.6523   55.533   4.5989 -5.992928 7.286900 
1 1 1   21   20    7 o  175.763   2.4508  639.430   17.662  648.937   26.541  631.874   23.662  176.888   3.6379  174.638   3.2851 2.249725 4.901660 
1 1 1   21   20    8 o  139.000   2.5368  400.079   14.528  375.642   20.135  426.616   20.982  134.570   3.6277  143.429   3.5469 -8.858398 5.073535 
1 1 1   21   20    9 o   89.946   2.7578  168.475   10.185  162.637   14.974  173.502   13.895   88.458   4.1042   91.434   3.6846 -2.976212 5.515503 
1 1 1   21   20   10 o   14.867   4.7438  -3.9039   5.8992  -4.0044   9.9438  -3.8493   7.3281   16.176   7.2415   13.557   6.1299 2.618949 9.487686 
1 1 1   21   20   11 o   79.406   2.7788  128.596   8.9490  144.513   14.294  118.336   11.476   83.332   4.1590   75.481   3.6864 7.850960 5.557565 
1 1 1   21   20   12 o  172.455   2.5276  618.193   17.951  576.913   25.315  659.938   25.458  166.622   3.6837  178.288   3.4620 -11.66565 5.055218 
1 1 1   21   20   13 o  108.395   2.4875  247.090   10.874  228.166   16.894  260.477   14.209  104.714   3.9118  112.075   3.0739 -7.360878 4.975030 
1 1 1   21   20   14 o   64.310   3.2742   86.201   8.6303   87.895   13.004   84.868   11.537   64.832   4.8634   63.788   4.3852 1.043488 6.548463 
1 1 1   21   20   15 o   57.716   3.9204   71.247   9.1299   85.452   12.682   55.967   13.154   63.927   4.8100   51.504   6.1922 12.42331 7.840863 
1 1 1   21   20   16 o   41.790   4.4753   38.755   6.8987   34.112   11.974   41.062   8.4403   39.280   7.6664   44.300   4.6194 -5.020821 8.950566 
1 1 1   21   20   17 o   18.527   5.7751  -0.3186   7.2907  -5.1520   16.102   0.9277   8.1769   20.535   9.2023   16.520   6.9804 4.014864 11.55025 
1 1 1   21   20   18 o  113.354   3.0088  266.931   13.902  256.720   18.169  281.353   21.592  110.864   3.9735  115.845   4.5191 -4.981613 6.017546 
1 1 1   21   20   19 f   87.483   3.5475  163.116   12.129  167.649   15.063  154.755   20.455   89.540   4.0786   85.426   5.8056 4.114525 7.095096 
1 1 1   21   20   20 o   47.788   4.2218   49.561   8.1196   39.043   11.819   58.961   11.174   42.696   6.7116   52.880   5.1233 -10.18364 8.443508 
1 1 1   21   20   21 o   91.273   2.8923  174.645   10.855  168.520   15.807  180.111   14.932   89.697   4.2728   92.850   3.8992 -3.153435 5.784526 
1 1 1   21   20   22 o   89.210   3.0298  167.878   11.049  160.014   16.534  174.224   14.852   87.195   4.5975   91.226   3.9474 -4.031212 6.059649 
1 1 1   21   20   23 o   76.993   3.9344  131.572   11.458  111.184   19.805  141.828   14.048   71.782   6.6896   82.203   4.1433 -10.42085 7.868742 
1 1 1   21   20   24 o   93.044   3.0583  182.102   11.727  172.442   16.455  192.071   16.717   90.501   4.4084   95.587   4.2402 -5.085312 6.116625 
1 1 1   21   20   25 o   93.864   3.4904  188.040   13.094  191.778   16.696  182.068   21.105   95.426   4.2422   92.301   5.5439 3.124344 6.980765 
1 1 1   21   20   26 o   39.671   5.2906   34.811   8.4480   41.327   12.645   29.558   11.353   43.445   7.0571   35.897   7.8840 7.547607 10.58112 
1 1 1   21   20   27 o   82.817   3.5226  145.366   11.696  150.870   19.035  142.028   14.825   83.753   5.5103   81.880   4.3898 1.872910 7.045143 
1 1 1   21   20   28 f   79.030   3.6551  134.322   11.665  132.515   18.370  135.543   15.101   78.256   5.6913   79.804   4.5879 -1.547974 7.310286 
1 1 1   21   20   29 o   37.872   5.7994   34.578   8.8819   26.625   13.672   40.385   11.683   32.999   9.5193   42.745   6.6266 -9.746590 11.59870 
1 1 1   21   20   30 o   32.783   5.9016   26.851   8.2288   18.512   12.577   33.094   10.881   27.804   9.3139   37.761   7.2502 -9.956970 11.80310 
1 1 1   21   20   31 o   33.651   6.0352   26.629   8.4624   36.234   13.029   19.621   11.129   38.826   8.3820   28.477   8.6855 10.34890 12.07045 
1 1 1   21   20   32 o   50.787   5.6102   62.863   10.833   72.306   14.142   49.458   16.850   57.118   6.0031   44.455   9.4795 12.66256 11.22043 
1 1 1   21   20   33 o   33.153   7.2234   21.175   11.021   8.1073   13.026   54.097   20.676   22.034   9.0156   44.273   11.288 -22.23835 14.44679 
1 1 1   21   20   34 o   38.852   7.4414   41.882   11.860   43.432   14.185   38.283   21.617   41.842   8.5096   35.862   12.210 5.979610 14.88285 
1 1 1   21   20   35 o   25.149   8.0204   6.0888   16.585   17.509   28.693   0.3591   20.324   28.184   12.477   22.113   10.081 6.070160 16.04089 
1 1 1   21   20   36 o   18.892   6.3238 -13.9109   11.948 -23.8165   14.546   6.6275   20.945   14.200   6.9952   23.583   10.537 -9.383119 12.64759 
1 1 1   21   21    0 o   59.107   2.8435   73.297   9.6991   73.297   9.6991   73.297   9.6991   59.107   4.0213   59.107   4.0213 0.000000 0.000000 
1 1 1   21   21    1 o  141.139   2.1348  412.458   12.427  418.215   17.616  406.757   17.532  142.121   3.0053  140.156   3.0328 1.965622 4.269644 
1 1 1   21   21    2 o   49.452   3.1519   50.851   6.4210   54.390   9.1998   47.489   8.9660   51.138   4.3618   47.766   4.5511 3.372360 6.303799 
1 1 1   21   21    3 o  164.399   2.1538  559.530   14.601  568.795   20.901  550.697   20.407  165.725   3.0578  163.072   3.0341 2.652573 4.307670 
1 1 1   21   21    4 o  182.628   2.4020  695.826   17.949  649.951   26.575  734.301   24.338  176.986   3.6406  188.269   3.1343 -11.28357 4.803954 
1 1 1   21   21    5 o  135.778   2.5421  382.588   14.234  375.214   20.157  389.922   20.102  134.464   3.6346  137.093   3.5551 -2.628754 5.084208 
1 1 1   21   21    6 o   68.387   3.1339   98.440   8.7410   86.479   12.795  108.908   11.970   64.389   4.8178   72.385   4.0093 -7.995308 6.267872 
1 1 1   21   21    7 o   52.082   3.6594   56.778   7.8090   56.077   11.692   57.342   10.492   51.749   5.4780   52.415   4.8535 -0.6661034 7.318765 
1 1 1   21   21    8 o   76.329   2.9388  120.491   9.2221  132.282   13.701  110.724   12.470   79.720   4.1671   72.939   4.1450 6.781036 5.877563 
1 1 1   21   21    9 o   75.347   2.7402  115.318   8.2735  129.457   13.710  107.220   10.376   78.837   4.2164   71.858   3.5009 6.978928 5.480337 
1 1 1   21   21   10 o   92.209   2.5298  176.528   9.3676  177.205   15.085  176.103   11.951   92.275   3.9637   92.143   3.1447 0.1316147 5.059646 
1 1 1   21   21   11 o  124.558   2.6675  321.827   13.686  305.012   18.796  340.801   19.966  121.106   3.7630  128.009   3.7817 -6.902847 5.334939 
1 1 1   21   21   12 o  146.525   2.4976  447.129   15.052  425.536   21.757  466.952   20.846  143.075   3.6870  149.974   3.3701 -6.899109 4.995170 
1 1 1   21   21   13 o  132.367   2.7201  377.634   14.057  319.598   22.964  412.418   17.778  123.722   4.5001  141.012   3.0567 -17.29030 5.440104 
1 1 1   21   21   14 o  145.473   2.5116  440.971   15.010  431.505   22.098  449.080   20.453  143.960   3.7217  146.987   3.3737 -3.027679 5.023211 
1 1 1   21   21   15 f   63.764   3.1627   86.891   7.8717   79.462   13.176   91.015   9.8161   61.428   5.2005   66.100   3.6006 -4.671539 6.325336 
1 1 1   21   21   16 o   99.758   3.0539  216.080   11.331  189.617   20.465  227.777   13.607   94.842   5.2318  104.675   3.1517 -9.833405 6.107763 
1 1 1   21   21   17 o  169.230   2.4410  596.392   16.750  596.791   26.197  596.115   21.785  169.125   3.7556  169.334   3.1193 -0.2093353 4.882023 
1 1 1   21   21   18 o   47.043   5.2520   46.430   9.4176   27.044   12.156   75.529   14.894   34.496   8.5798   59.590   6.0598 -25.09429 10.50400 
1 1 1   21   21   19 o   24.730   6.4147   9.6879   9.5488  -3.7338   14.779   19.306   12.511   19.979   8.8942   29.481   9.2458 -9.501997 12.82938 
1 1 1   21   21   20 o   72.642   3.2199  111.199   9.6158  103.603   13.811  118.347   13.396   70.160   4.7726   75.123   4.3237 -4.962456 6.439842 
1 1 1   21   21   21 o  117.229   2.6625  287.688   12.863  281.470   18.430  293.592   17.961  115.953   3.8536  118.504   3.6749 -2.550705 5.324941 
1 1 1   21   21   22 f   38.263   5.0301   31.613   7.6971   41.082   11.730   24.452   10.200   43.683   6.5105   32.842   7.6694 10.84097 10.06019 
1 1 1   21   21   23 o   99.175   3.5725  214.623   14.164  168.272   21.063  252.887   19.137   88.704   5.7571  109.646   4.2317 -20.94246 7.145031 
1 1 1   21   21   24 o   54.368   4.6455   58.915   9.5972   78.096   18.293   51.631   11.273   59.599   7.4419   49.137   5.5626 10.46167 9.291083 
1 1 1   21   21   25 o   63.348   4.3505   87.060   11.042   88.233   14.122   85.215   17.713   64.262   5.3283   62.433   6.8788 1.828896 8.701058 
1 1 1   21   21   26 o   27.349   6.2708   17.018   8.0502   18.808   12.091   15.592   10.790   28.449   9.1091   26.250   8.6206 2.199011 12.54160 
1 1 1   21   21   27 o   30.775   6.2651   23.312   8.4863   17.039   14.183   26.811   10.591   27.600   9.8566   33.949   7.7366 -6.348305 12.53027 
1 1 1   21   21   28 o   47.088   5.0477   50.828   9.3311   45.084   14.198   55.196   12.380   43.906   8.1402   50.271   5.9709 -6.365536 10.09533 
1 1 1   21   21   29 o   56.025   4.1956   69.052   9.6246   68.744   14.461   69.297   12.895   55.693   6.2956   56.356   5.5478 -0.6628304 8.391268 
1 1 1   21   21   30 o   44.302   5.1768   45.760   9.0528   38.936   13.350   51.569   12.317   40.336   8.3014   48.267   6.1873 -7.930885 10.35353 
1 1 1   21   21   31 o   58.512   4.2056   77.814   9.7968   58.951   14.359   94.240   13.400   51.062   6.8182   65.962   4.9255 -14.89997 8.411199 
1 1 1   21   21   32 o   28.618   6.9039   20.840   9.7610   20.580   13.360   21.139   14.296   28.476   9.5992   28.760   9.9251 -0.2837963 13.80770 
1 1 1   21   21   33 o   33.142   6.8505   31.771   11.180   40.694   13.464   11.951   20.066   40.639   8.3129   25.645   10.891 14.99383 13.70091 
1 1 1   21   21   34 o   26.065   7.4895   15.658   12.367   14.621   15.785   17.308   19.902   25.210   10.064   26.920   11.094 -1.710340 14.97897 
1 1 1   21   21   35 o   31.529   9.1428   30.294   18.405   44.360   30.436   22.185   23.109   34.639   13.923   28.419   11.854 6.219501 18.28563 
1 1 1   21   22    0 o   34.846   4.4078   27.533   8.1053   27.533   8.1053   27.533   8.1053   34.846   6.2336   34.846   6.2336 0.000000 0.000000 
1 1 1   21   22    1 o  148.732   2.1355  458.410   13.099  463.895   18.613  453.027   18.439  149.615   3.0163  147.850   3.0237 1.764740 4.270925 
1 1 1   21   22    2 o  128.656   2.1407  342.958   11.357  352.827   16.200  333.420   15.926  130.479   3.0104  126.833   3.0445 3.646217 4.281488 
1 1 1   21   22    3 o   62.685   3.0824   84.267   7.6425   72.302   12.181   92.035   9.8145   58.801   5.0226   66.569   3.5746 -7.767754 6.164767 
1 1 1   21   22    4 o   18.618   5.1085   0.2584   5.8080   12.158   10.224  -5.4121   7.0574   24.619   8.3968   12.616   5.8207 12.00395 10.21697 
1 1 1   21   22    5 o   41.138   4.4332   38.073   6.7542   30.718   11.335   42.123   8.4104   37.348   7.6167   44.929   4.5386 -7.581429 8.866433 
1 1 1   21   22    6 o   33.165   5.0027   23.196   6.5305   29.908   10.547   19.022   8.3165   36.942   7.1808   29.387   6.9675 7.555698 10.00550 
1 1 1   21   22    7 o   37.335   4.8952   30.323   7.3144   27.504   10.796   32.715   9.9444   35.277   7.6413   39.393   6.1206 -4.115990 9.790380 
1 1 1   21   22    8 o   77.260   3.1189  128.642   8.9710  114.604   16.260  134.786   10.756   73.925   5.3328   80.595   3.2359 -6.669746 6.237798 
1 1 1   21   22    9 o   96.105   2.5151  192.446   9.6696  189.597   15.652  194.204   12.297   95.439   3.9763   96.771   3.0809 -1.332008 5.030221 
1 1 1   21   22   10 o  102.491   2.5521  221.518   10.607  196.441   15.959  241.357   14.195   97.131   3.9836  107.850   3.1912 -10.71846 5.104254 
1 1 1   21   22   11 o   74.906   2.8319  117.460   8.5288  114.514   13.582  119.378   10.959   74.035   4.4479   75.776   3.5065 -1.741562 5.663839 
1 1 1   21   22   12 o   57.188   3.3022   69.601   7.3536   65.165   12.455   71.975   9.1112   55.607   5.4304   58.770   3.7589 -3.162529 6.604437 
1 1 1   21   22   13 o   67.317   3.1576   98.755   8.3233   80.537   13.316  110.437   10.663   61.822   5.2225   72.813   3.5506 -10.99131 6.315144 
1 1 1   21   22   14 o   78.682   2.9947  131.731   9.5474  111.910   14.130  148.384   12.951   73.014   4.6920   84.351   3.7227 -11.33664 5.989442 
1 1 1   21   22   15 o   78.919   3.3839  136.309   9.4871  119.882   18.406  142.252   11.071   75.147   5.9386   82.691   3.2461 -7.544624 6.767849 
1 1 1   21   22   16 o   59.255   4.3768   80.209   9.6262   60.434   16.530   90.356   11.841   52.852   7.5832   65.659   4.3726 -12.80689 8.753552 
1 1 1   21   22   17 o   62.798   3.4727   90.761   8.1094   60.441   13.273  108.820   10.244   53.317   6.0359   72.279   3.4361 -18.96238 6.945455 
1 1 1   21   22   18 o   36.645   5.3972   30.125   7.8886   28.310   11.331   31.832   10.989   35.444   7.9472   37.845   7.3049 -2.400402 10.79442 
1 1 1   21   22   19 o   44.318   5.2237   42.389   9.0243   27.875   11.933   61.782   13.793   34.922   8.3894   53.713   6.2261 -18.79107 10.44731 
1 1 1   21   22   20 o   79.002   3.0626  131.260   9.9663  130.165   14.431  132.257   13.781   78.646   4.4488   79.358   4.2103 -0.7125702 6.125242 
1 1 1   21   22   21 o   31.551   5.5505   21.730   7.4326   32.935   11.319   13.236   9.8548   38.292   7.4353   24.811   8.2432 13.48027 11.10106 
1 1 1   21   22   22 o  102.688   2.7701  221.565   11.710  217.149   16.990  225.560   16.161  101.649   4.0526  103.726   3.7776 -2.077568 5.540199 
1 1 1   21   22   23 o   20.814   5.6546   4.1298   8.3753 -24.0279   16.119   14.544   9.8025   16.042   7.7851   25.585   8.2030 -9.542841 11.30914 
1 1 1   21   22   24 o   71.401   3.9605  107.171   10.861  116.157   19.553  103.161   13.062   73.027   6.4917   69.776   4.5388 3.251106 7.921031 
1 1 1   21   22   25 f   30.322   5.6255   22.282   8.0035   7.6455   12.163   33.459   10.629   22.188   8.8418   38.455   6.9574 -16.26674 11.25093 
1 1 1   21   22   26 o   31.104   6.0970   24.564   8.4866   13.275   14.525   30.414   10.457   25.769   9.8319   36.439   7.2131 -10.67073 12.19403 
1 1 1   21   22   27 o   18.438   5.5401   1.6810   7.5375  -3.8418   11.632   5.6783   9.8962   17.078   7.7225   19.798   7.9458 -2.719484 11.08024 
1 1 1   21   22   28 o   50.360   4.4553   57.584   8.9819   47.132   13.478   65.934   12.047   45.631   7.1616   55.089   5.3019 -9.458187 8.910567 
1 1 1   21   22   29 o   20.647   6.0901   5.0688   8.3900   5.3138   13.845   4.9266   10.547   21.631   9.1083   19.663   8.0868 1.967564 12.18017 
1 1 1   21   22   30 o   17.289   5.4145  -0.7686   7.5738  -1.2259   11.647  -0.4337   9.9695   17.752   7.8998   16.827   7.4068 0.9247189 10.82898 
1 1 1   21   22   31 o   60.575   4.1833   82.902   10.275   69.352   14.909   95.163   14.182   55.289   6.5379   65.861   5.2208 -10.57160 8.366663 
1 1 1   21   22   32 o   25.614   7.1377   14.388   10.512   13.746   12.610   15.850   19.031   24.501   9.2037   26.728   10.912 -2.227266 14.27536 
1 1 1   21   22   33 o   24.892   8.2799   4.7655   12.811   4.2176   13.309   11.672   47.254   20.258   8.7407   29.525   14.065 -9.267366 16.55985 
1 1 1   21   22   34 o   56.065   6.2512   78.870   14.246   74.084   18.474   85.889   22.373   54.750   8.1813   57.379   9.4539 -2.629383 12.50237 
1 1 1   21   23    0 o  107.580   2.6147  240.478   16.363  240.478   16.363  240.478   16.363  107.580   3.6977  107.580   3.6977 0.000000 0.000000 
1 1 1   21   23    1 o   71.778   2.7421  106.879   7.9674  105.571   10.295  108.832   12.581   71.291   3.5012   72.266   4.2211 -0.9746246 5.484149 
1 1 1   21   23    2 o   53.645   3.2402   58.926   7.0682   53.615   9.1173   66.925   11.190   50.705   4.3596   56.584   4.7949 -5.879387 6.480494 
1 1 1   21   23    3 o   65.193   3.3028   87.065   8.1875   93.221   15.013   84.459   9.7680   66.650   5.4613   63.737   3.7158 2.912380 6.605505 
1 1 1   21   23    4 o  105.106   2.8161  235.793   11.305  213.909   19.708  246.525   13.801  101.180   4.7225  109.032   3.0690 -7.851845 5.632176 
1 1 1   21   23    5 o   63.315   3.0097   84.828   7.5867   78.412   12.199   88.875   9.6880   61.235   4.8302   65.395   3.5919 -4.160110 6.019344 
1 1 1   21   23    6 o  112.775   2.3793  262.504   10.758  270.965   17.513  257.377   13.634  114.138   3.7203  111.412   2.9670 2.725693 4.758552 
1 1 1   21   23    7 o   34.656   4.6454   24.990   6.1918   31.329   10.498   21.608   7.6674   37.832   6.9853   31.481   6.1257 6.350918 9.290743 
1 1 1   21   23    8 o   99.288   2.4905  207.901   9.8837  192.825   15.756  217.681   12.691   96.161   3.9728  102.414   3.0045 -6.252617 4.980935 
1 1 1   21   23    9 o   17.306   4.9096  -2.7989   5.6570   10.938   9.9489  -9.3620   6.8769   23.561   8.2712   11.051   5.2920 12.50951 9.819283 
1 1 1   21   23   10 o   59.995   3.3732   79.196   7.8225   63.517   12.782   88.585   9.8912   54.801   5.6552   65.189   3.6788 -10.38749 6.746469 
1 1 1   21   23   11 o  131.473   2.7070  357.154   13.319  369.202   24.901  352.325   15.764  132.692   4.5499  130.254   2.9343 2.437958 5.413992 
1 1 1   21   23   12 o   35.204   5.1718   27.716   7.1790   26.512   11.107   28.580   9.4082   34.323   7.9947   36.085   6.5631 -1.762054 10.34362 
1 1 1   21   23   13 o  131.619   2.8420  361.085   15.295  354.382   20.256  369.973   23.327  130.310   3.7689  132.929   4.2548 -2.619492 5.684001 
1 1 1   21   23   14 o  119.053   2.5839  295.437   12.614  297.461   18.911  293.816   16.930  119.350   3.8417  118.757   3.4565 0.5923080 5.167761 
1 1 1   21   23   15 o  126.009   2.8388  341.336   13.517  307.482   23.954  357.151   16.372  120.927   4.8027  131.090   3.0281 -10.16348 5.677646 
1 1 1   21   23   16 o   62.927   3.3879   89.948   7.8865   66.313   13.558  102.036   9.6957   55.860   5.8847   69.994   3.3586 -14.13398 6.775705 
1 1 1   21   23   17 f   87.412   2.6649  157.988   9.1871  165.861   15.609  153.815   11.364   88.894   4.2574   85.931   3.2064 2.963074 5.329778 
1 1 1   21   23   18 o   19.707   5.6188   4.2475   6.9629   7.1621   10.861   2.2137   9.0726   21.596   8.4316   17.818   7.4292 3.777178 11.23766 
1 1 1   21   23   19 o   39.799   5.5666   38.365   8.8694   54.390   11.981   18.931   13.193   50.488   5.7534   29.110   9.5313 21.37837 11.13320 
1 1 1   21   23   20 o   49.387   4.6659   53.777   9.2990   61.012   12.578   45.055   13.810   53.414   5.7093   45.360   7.3816 8.053249 9.331861 
1 1 1   21   23   21 o   81.921   3.0489  141.958   10.261  133.804   14.892  149.328   14.158   79.578   4.5372   84.264   4.0738 -4.685837 6.097706 
1 1 1   21   23   22 o   52.290   4.0382   59.604   8.5474   48.617   12.383   69.602   11.813   47.376   6.3374   57.204   5.0068 -9.827469 8.076497 
1 1 1   21   23   23 o   65.487   4.8241  107.172   10.962   63.725   18.963  128.976   13.434   52.842   8.7011   78.133   4.1687 -25.29111 9.648184 
1 1 1   21   23   24 o   30.077   7.3213   19.295   11.284   31.424   17.489   10.646   14.769   35.444   10.901   24.709   9.7756 10.73553 14.64252 
1 1 1   21   23   25 o   39.726   5.3848   36.337   8.4290   37.082   12.871   35.777   11.154   39.817   8.1127   39.635   7.0829 0.1815414 10.76952 
1 1 1   21   23   26 o   45.313   5.3371   48.139   9.0102   43.902   15.474   50.312   11.083   42.544   9.0943   48.082   5.5885 -5.537945 10.67413 
1 1 1   21   23   27 o   32.414   6.1260   25.090   8.2987   30.287   12.816   21.338   10.890   35.149   8.8471   29.678   8.4758 5.471155 12.25193 
1 1 1   21   23   28 o   29.038   6.1650   20.909   8.2142   14.937   12.676   25.232   10.785   25.685   9.3002   32.392   8.0953 -6.706348 12.32999 
1 1 1   21   23   29 o   33.380   5.9430   29.007   8.7734   16.256   14.307   36.691   11.107   26.458   9.8301   40.302   6.6819 -13.84464 11.88600 
1 1 1   21   23   30 o   31.256   6.1744   25.062   8.4587   19.267   12.682   29.706   11.353   27.694   9.3525   34.819   8.0639 -7.125425 12.34889 
1 1 1   21   23   31 o   36.641   6.0913   33.802   9.0250   32.789   13.454   34.632   12.169   35.742   9.1022   37.540   8.0973 -1.798672 12.18262 
1 1 1   21   23   32 o   54.165   5.6642   66.353   12.116   54.992   14.758   89.853   21.224   48.102   7.4385   60.228   8.5441 -12.12523 11.32835 
1 1 1   21   23   33 o   24.974   8.2713   5.9107   14.524   5.2752   15.323   11.534   45.581   21.307   9.2851   28.641   13.691 -7.334213 16.54251 
1 1 1   21   24    0 o  100.501   2.2193  209.652   12.981  209.652   12.981  209.652   12.981  100.501   3.1386  100.501   3.1386 0.000000 0.000000 
1 1 1   21   24    1 o  124.981   2.1405  324.134   11.030  312.223   15.419  336.617   15.784  122.625   3.0486  127.337   3.0054 -4.712471 4.280984 
1 1 1   21   24    2 o   89.190   2.6916  166.211   9.8546  161.388   14.539  170.310   13.403   87.938   4.0086   90.442   3.5932 -2.503426 5.383255 
1 1 1   21   24    3 o  112.789   2.4027  263.931   10.985  268.539   17.268  260.798   14.237  113.527   3.6879  112.052   3.0806 1.474525 4.805305 
1 1 1   21   24    4 o  175.083   2.3845  638.526   17.013  632.656   26.091  642.868   22.439  174.261   3.6302  175.906   3.0929 -1.645905 4.769082 
1 1 1   21   24    5 o   60.700   3.1759   80.293   7.5320   65.946   12.141   89.270   9.6035   55.935   5.2625   65.465   3.5568 -9.529022 6.351728 
1 1 1   21   24    6 o   38.853   4.6206   30.340   6.6519   38.874   12.596   27.039   7.8332   41.899   7.5675   35.806   5.3042 6.092907 9.241246 
1 1 1   21   24    7 o   45.374   4.6966   48.733   7.7226   25.931   11.453   67.741   10.457   33.892   8.2672   56.856   4.4594 -22.96415 9.393246 
1 1 1   21   24    8 o  102.895   2.4609  222.400   10.195  211.245   16.054  229.939   13.197  100.594   3.8693  105.195   3.0417 -4.600838 4.921731 
1 1 1   21   24    9 o  106.501   2.5254  239.814   10.919  210.169   16.274  264.089   14.726  100.308   3.9336  112.694   3.1683 -12.38567 5.050877 
1 1 1   21   24   10 o   58.059   3.5857   78.148   7.7245   48.810   12.335   97.074   9.9076   47.865   6.2483   68.252   3.5196 -20.38702 7.171383 
1 1 1   21   24   11 o   56.730   3.3410   68.207   7.3208   65.945   12.706   69.331   8.9569   55.826   5.5183   57.633   3.7681 -1.807350 6.682055 
1 1 1   21   24   12 o   40.194   4.7401   39.678   6.6628   24.886   11.704   46.769   8.1041   33.113   8.5206   47.276   4.1562 -14.16263 9.480245 
1 1 1   21   24   13 o  134.959   2.6004  380.588   14.443  353.062   20.475  407.849   20.376  130.034   3.8178  139.884   3.5318 -9.850189 5.200842 
1 1 1   21   24   14 o   49.990   3.6597   52.441   6.9470   53.713   12.618   51.888   8.3220   50.190   6.0952   49.789   4.0526 0.4017029 7.319495 
1 1 1   21   24   15 o   66.302   3.5208   88.828   8.2286  101.003   17.229   85.230   9.3659   68.721   6.0785   63.884   3.5546 4.837353 7.041587 
1 1 1   21   24   16 o   90.155   2.6945  175.180   9.5234  152.137   15.541  189.038   12.051   85.031   4.4312   95.280   3.0667 -10.24918 5.388932 
1 1 1   21   24   17 o   23.627   5.4434   10.550   7.2106  -2.6684   11.095   20.216   9.4876   17.405   7.7296   29.849   7.6664 -12.44344 10.88676 
1 1 1   21   24   18 o   21.011   5.2457   6.4348   6.8071  -6.9246   10.582   15.865   8.8907   15.501   7.1433   26.521   7.6838 -11.01998 10.49135 
1 1 1   21   24   19 o   56.318   3.7292   67.586   8.6477   67.274   12.577   67.866   11.910   56.140   5.4317   56.496   5.1112 -0.3561974 7.458374 
1 1 1   21   24   20 o   30.843   6.3289   21.861   8.5063   19.006   11.400   25.449   12.777   28.766   8.7939   32.921   9.1042 -4.155863 12.65778 
1 1 1   21   24   21 o   35.626   6.0839   29.510   8.8083   26.580   11.802   33.196   13.235   33.665   8.4985   37.586   8.7081 -3.920517 12.16782 
1 1 1   21   24   22 o   40.083   5.1863   35.990   8.3046   45.725   12.281   27.789   11.273   45.680   6.5185   34.487   8.0685 11.19335 10.37259 
1 1 1   21   24   23 o   58.884   3.8415   75.137   9.2205   72.016   13.961   77.551   12.280   57.574   5.8793   60.195   4.9461 -2.620052 7.683065 
1 1 1   21   24   24 o   48.102   6.3624   57.352   11.990   36.243   17.529   75.912   16.437   37.739   10.745   58.464   6.8165 -20.72465 12.72480 
1 1 1   21   24   25 o   32.569   5.7702   28.103   8.7467   9.0056   14.918   38.107   10.797   23.663   9.6612   41.474   6.3120 -17.81164 11.54036 
1 1 1   21   24   26 o   60.877   3.8484   81.757   9.4862   73.787   14.373   87.908   12.627   57.848   6.0241   63.907   4.7906 -6.058159 7.696702 
1 1 1   21   24   27 o   23.906   6.1403   12.471   7.9660   8.5953   12.024   15.502   10.635   22.140   8.8010   25.673   8.5647 -3.532782 12.28054 
1 1 1   21   24   28 o   18.566   5.6460   1.1017   7.6609   6.7883   12.382  -2.4251   9.7513   21.284   8.7587   15.848   7.1271 5.435877 11.29206 
1 1 1   21   24   29 o   33.914   5.6851   30.643   8.8032   11.835   13.812   43.508   11.424   23.934   9.4585   43.894   6.3103 -19.96045 11.37024 
1 1 1   21   24   30 f   23.447   6.3854   11.878   8.6066   12.430   13.538   11.504   11.150   23.999   9.4016   22.895   8.6430 1.104019 12.77074 
1 1 1   21   24   31 o   35.791   6.1682   33.233   9.0316   30.375   13.392   35.617   12.232   33.815   9.3080   37.767   8.0961 -3.951687 12.33636 
1 1 1   21   24   32 o   20.331   6.4138   2.2709   10.446   1.7389   12.866   3.3004   17.897   18.967   8.3781   21.696   9.7138 -2.729908 12.82766 
1 1 1   21   25    0 o   49.501   3.0517   52.051   8.6571   52.051   8.6571   52.051   8.6571   49.501   4.3157   49.501   4.3157 0.000000 0.000000 
1 1 1   21   25    1 o   17.077   4.8811   2.1816   5.7361  -8.8419   10.427   6.9658   6.8690   14.905   6.9447   19.248   6.8610 -4.343275 9.762270 
1 1 1   21   25    2 o   24.467   5.2427   12.116   6.5931   1.5295   9.6977   21.214   8.9906   18.100   7.6225   30.834   7.2001 -12.73378 10.48538 
1 1 1   21   25    3 o   81.195   2.7096  139.734   8.7997  128.167   13.950  147.378   11.341   78.227   4.3236   84.163   3.2670 -5.936111 5.419147 
1 1 1   21   25    4 f   59.518   3.2223   77.551   7.4539   63.131   12.109   86.350   9.4585   54.670   5.3701   64.366   3.5629 -9.696014 6.444540 
1 1 1   21   25    5 o   63.848   3.0757   87.468   7.8464   75.502   12.209   95.888   10.241   59.891   4.9425   67.804   3.6622 -7.913540 6.151415 
1 1 1   21   25    6 o   77.474   2.7068  125.769   8.3568  123.567   13.642  127.092   10.573   76.802   4.3067   78.146   3.2803 -1.343620 5.413674 
1 1 1   21   25    7 o   54.127   3.5458   66.785   7.2076   46.497   11.790   78.891   9.1076   46.741   6.1159   61.513   3.5898 -14.77161 7.091648 
1 1 1   21   25    8 o   37.914   5.2730   34.218   7.6626   22.991   12.541   40.907   9.6797   31.821   9.0982   44.007   5.3331 -12.18535 10.54603 
1 1 1   21   25    9 o   63.387   3.7809   89.144   9.2981   69.259   14.876  101.893   11.912   56.989   6.3288   69.785   4.1385 -12.79579 7.561794 
1 1 1   21   25   10 o   19.895   5.5069   6.0036   5.9605   2.3008   12.495   7.0943   6.7819   20.510   8.6456   19.281   6.8233 1.228931 11.01376 
1 1 1   21   25   11 o   70.039   2.9879  106.778   8.0821   90.347   13.483  115.994   10.097   65.446   4.9948   74.631   3.2804 -9.185005 5.975717 
1 1 1   21   25   12 o   61.490   3.1239   78.843   7.4915   81.453   12.977   77.538   9.1748   62.063   5.0696   60.918   3.6517 1.144997 6.247797 
1 1 1   21   25   13 o   78.655   3.1021  134.809   9.6880  103.681   14.591  159.351   12.956   69.988   5.0547   87.322   3.5974 -17.33444 6.204146 
1 1 1   21   25   14 o   66.640   3.6390   98.146   8.5838   85.820   16.682  102.585   10.011   63.183   6.4014   70.096   3.4626 -6.912926 7.277937 
1 1 1   21   25   15 o   73.383   2.9844  117.184   8.4962  100.021   14.081  127.009   10.654   68.744   4.9664   78.023   3.3108 -9.279167 5.968773 
1 1 1   21   25   16 o   45.855   4.3508   49.582   6.9652   36.751   12.401   55.496   8.4184   40.295   7.7432   51.415   3.9699 -11.11925 8.701517 
1 1 1   21   25   17 o   27.559   5.9736   17.024   7.3671   19.005   11.348   15.581   9.6856   28.802   8.7674   26.317   8.1159 2.485443 11.94716 
1 1 1   21   25   18 o   70.851   3.2768  107.705   9.4312   90.397   13.703  123.283   13.000   65.176   5.0976   76.526   4.1188 -11.34961 6.553653 
1 1 1   21   25   19 o   55.273   3.8395   67.039   8.5238   54.754   12.719   77.055   11.484   50.275   6.1339   60.270   4.6199 -9.995602 7.679082 
1 1 1   21   25   20 o   37.254   5.9000   32.720   8.8022   34.384   11.782   30.619   13.241   38.673   7.6577   35.835   8.9777 2.838535 11.80000 
1 1 1   21   25   21 o   62.806   4.1831   85.186   10.531   83.541   13.364   87.880   17.104   62.375   5.1947   63.236   6.5581 -0.8606567 8.366184 
1 1 1   21   25   22 o   41.959   5.1012   40.832   8.3568   33.977   12.736   46.015   11.074   37.920   8.3674   45.997   5.8374 -8.076847 10.20235 
1 1 1   21   25   23 o   41.577   5.9381   41.024   9.7402   40.635   12.850   41.548   14.933   41.739   7.7499   41.416   8.9991 0.3222427 11.87622 
1 1 1   21   25   24 o   53.410   5.3718   68.384   10.093   59.089   18.463   72.346   12.054   48.986   9.4808   57.834   5.0535 -8.847504 10.74352 
1 1 1   21   25   25 o   51.759   4.5395   57.373   9.3534   68.518   15.883   51.456   11.573   55.108   6.9881   48.410   5.7962 6.698181 9.079079 
1 1 1   21   25   26 o   34.317   6.0560   29.292   8.5380   25.941   13.133   31.745   11.237   32.094   9.3506   36.541   7.6986 -4.447193 12.11208 
1 1 1   21   25   27 o   20.406   5.8749   6.2164   7.6799   8.7476   11.944   4.4325   10.027   21.921   8.7535   18.891   7.8378 3.029531 11.74971 
1 1 1   21   25   28 o   19.688   5.8332   3.6446   7.8892   9.6849   12.574  -0.2769   10.131   22.514   8.9842   16.862   7.4423 5.651979 11.66637 
1 1 1   21   25   29 o   18.668   5.7152   1.0994   7.8080   7.7831   13.155  -2.5362   9.7018   21.725   8.9923   15.611   7.0564 6.113231 11.43042 
1 1 1   21   25   30 o   46.247   5.6313   53.710   9.8582   47.321   16.220   57.453   12.414   42.218   9.5396   50.276   5.9868 -8.057686 11.26258 
1 1 1   21   25   31 o   16.185   5.5099 -14.6523   10.147 -18.9065   12.688  -7.1044   16.900   13.712   6.7094   18.659   8.7419 -4.946657 11.01988 
1 1 1   21   26    0 o  144.905   2.3791  435.796   20.084  435.796   20.084  435.796   20.084  144.905   3.3646  144.905   3.3646 0.000000 0.000000 
1 1 1   21   26    1 o   63.558   2.9520   84.203   7.4590   85.818   12.358   83.277   9.3553   63.914   4.6879   63.202   3.5889 0.7127838 5.903949 
1 1 1   21   26    2 o   87.941   2.5748  162.575   9.0850  155.428   14.468  167.228   11.673   86.210   4.0690   89.671   3.1563 -3.461060 5.149679 
1 1 1   21   26    3 o   66.917   3.5130   94.305   8.4465   94.234   16.676   94.330   9.7962   66.558   6.0746   67.276   3.5305 -0.7172699 7.025999 
1 1 1   21   26    4 o   58.127   4.3452   81.354   8.4330   54.782   16.369   90.956   9.8393   50.211   7.9041   66.043   3.6122 -15.83196 8.690382 
1 1 1   21   26    5 o   95.866   2.5315  190.744   9.8347  196.412   15.514  186.936   12.716   96.958   3.8795   94.773   3.2532 2.185356 5.062982 
1 1 1   21   26    6 o   37.507   4.6534   32.331   6.3400   26.397   11.266   35.081   7.6697   34.146   8.1185   40.867   4.5503 -6.721378 9.306711 
1 1 1   21   26    7 o   60.195   3.5662   78.493   7.7463   72.244   14.855   80.827   9.0782   58.149   6.1940   62.241   3.5364 -4.091358 7.132398 
1 1 1   21   26    8 o   45.085   4.9161   50.191   7.4701   32.873   13.686   57.540   8.9152   37.785   8.9244   52.384   4.1263 -14.59956 9.832158 
1 1 1   21   26    9 o   66.379   3.4409   96.824   8.3137   84.670   15.501  101.732   9.8504   62.939   5.9714   69.820   3.4207 -6.880806 6.881709 
1 1 1   21   26   10 o   60.046   3.7842   81.067   7.9815   67.499   15.452   86.005   9.3212   55.925   6.6990   64.168   3.5220 -8.242989 7.568462 
1 1 1   21   26   11 o   67.371   3.4315   97.619   8.3922   92.081   16.055   99.701   9.8443   65.636   5.9305   69.105   3.4539 -3.469627 6.862961 
1 1 1   21   26   12 o  113.905   2.7927  276.180   11.962  261.468   21.669  282.629   14.347  111.291   4.7207  116.518   2.9853 -5.227165 5.585439 
1 1 1   21   26   13 o   50.639   3.8968   54.999   7.8513   53.398   12.798   55.965   9.9418   49.813   6.2293   51.465   4.6837 -1.651730 7.793633 
1 1 1   21   26   14 o   54.780   4.7392   74.358   8.0405   51.027   16.414   81.723   9.2228   47.077   8.7767   62.483   3.5788 -15.40622 9.478330 
1 1 1   21   26   15 o   71.486   3.0785  112.789   8.5247   90.569   13.861  126.305   10.811   65.240   5.1515   77.732   3.3721 -12.49235 6.156996 
1 1 1   21   26   16 o   54.888   3.6145   67.071   7.5499   55.647   12.829   73.123   9.3380   50.770   6.1268   59.007   3.8370 -8.237202 7.229080 
1 1 1   21   26   17 o   25.752   6.2782   13.191   8.4203   6.4037   11.336   21.547   12.577   21.229   8.5098   30.275   9.2330 -9.045628 12.55648 
1 1 1   21   26   18 o   59.878   4.0829   78.960   9.7825   84.906   12.734   70.399   15.280   63.071   4.8953   56.685   6.5357 6.385574 8.165734 
1 1 1   21   26   19 o   28.073   5.9482   18.716   7.6138   13.565   11.700   22.500   10.027   25.108   8.9539   31.038   7.8328 -5.929859 11.89642 
1 1 1   21   26   20 o   16.285   5.1779  -3.3704   7.0522  -0.6615   11.458  -5.0225   8.9479   18.117   7.9583   14.453   6.6264 3.664340 10.35586 
1 1 1   21   26   21 f   33.426   6.3883   28.249   9.4405   35.762   12.386   17.834   14.584   39.017   7.9660   27.834   9.9892 11.18327 12.77655 
1 1 1   21   26   22 o   66.628   3.9510   97.319   10.695   99.308   14.082   94.606   16.441   67.784   5.0369   65.471   6.0885 2.312935 7.901903 
1 1 1   21   26   23 o   40.321   6.0693   38.826   9.7125   35.866   12.833   42.794   14.860   38.687   8.2918   41.955   8.8652 -3.268372 12.13857 
1 1 1   21   26   24 o   38.740   7.4551   36.638   10.036   42.686   25.048   35.482   10.953   38.328   13.143   39.153   7.0415 -0.8257980 14.91024 
1 1 1   21   26   25 f   55.263   4.3898   71.580   9.4004   50.128   14.179   88.405   12.557   46.615   7.3749   63.911   4.7636 -17.29657 8.779565 
1 1 1   21   26   26 o   27.418   6.2507   18.915   8.2386   14.153   12.532   22.539   10.933   24.789   9.2020   30.047   8.4622 -5.257721 12.50141 
1 1 1   21   26   27 o   70.919   3.4647  109.083   10.099  121.210   14.990   99.004   13.666   74.522   4.8772   67.316   4.9223 7.205986 6.929331 
1 1 1   21   26   28 o   15.211   5.0110  -6.2183   7.5557  -6.8872   11.806  -5.7542   9.8330   15.810   7.3741   14.612   6.7869 1.197185 10.02199 
1 1 1   21   26   29 o   24.192   6.3329   14.247   8.3706   13.637   12.568   14.733   11.221   23.975   9.1462   24.408   8.7619 -0.4326973 12.66585 
1 1 1   21   26   30 o   30.193   6.6002   23.780   8.9709   30.890   14.211   19.069   11.567   33.441   9.7219   26.945   8.9295 6.495493 13.20042 
1 1 1   21   27    0 o   23.115   6.9497   16.196   9.5189   16.196   9.5189   16.196   9.5189   23.115   9.8284   23.115   9.8284 0.000000 0.000000 
1 1 1   21   27    1 o   26.174   5.5216   14.907   6.7248   21.242   9.5572   8.6962   9.4640   30.623   7.6021   21.726   8.0101 8.897921 11.04325 
1 1 1   21   27    2 o  110.690   2.4109  256.460   10.801  251.540   16.898  259.859   14.045  109.658   3.7363  111.721   3.0481 -2.063446 4.821869 
1 1 1   21   27    3 o   51.040   3.4156   56.076   6.8567   51.206   11.277   58.932   8.6363   49.048   5.5746   53.032   3.9485 -3.983349 6.831295 
1 1 1   21   27    4 o  130.337   2.8199  367.198   13.882  327.097   24.527  386.098   16.838  124.478   4.7773  136.197   2.9976 -11.71922 5.639886 
1 1 1   21   27    5 o   73.939   2.9893  122.065   8.5068   88.601   13.483  144.196   10.965   64.698   5.0527   83.181   3.1960 -18.48347 5.978612 
1 1 1   21   27    6 o   29.544   5.4755   15.176   6.2098   32.299   12.732   9.8312   7.1133   37.567   8.4247   21.521   6.9963 16.04594 10.95101 
1 1 1   21   27    7 o   32.929   5.7188   22.031   7.6431   36.999   13.107   14.319   9.4083   40.368   8.1530   25.489   8.0218 14.87983 11.43768 
1 1 1   21   27    8 o  102.635   2.9057  225.341   11.436  209.224   19.897  233.292   13.975   99.487   4.8490  105.784   3.2030 -6.297676 5.811370 
1 1 1   21   27    9 o   63.858   3.4135   85.687   8.0102   87.520   15.350   85.001   9.3903   63.962   5.8185   63.754   3.5711 0.2075653 6.826997 
1 1 1   21   27   10 o   23.405   5.7435   12.322   6.6083 -11.4521   18.909   15.629   7.0530   20.419   9.4586   26.391   6.5181 -5.972214 11.48694 
1 1 1   21   27   11 o   23.564   6.3394  -0.9580   6.1643   29.320   18.789  -4.6103   6.5255   34.959   11.371   12.169   5.6085 22.79015 12.67880 
1 1 1   21   27   12 o   42.463   5.0274   40.111   7.9435   39.576   14.038   40.364   9.6342   41.432   8.5003   43.494   5.3705 -2.062687 10.05473 
1 1 1   21   27   13 o   65.843   4.4601   91.780   8.7790   96.741   22.251   90.866   9.5540   65.809   8.1978   65.877   3.5163 -0.6813812E-01 8.920136 
1 1 1   21   27   14 o   49.245   4.2921   53.962   7.3113   49.406   14.806   55.431   8.4078   47.176   7.6096   51.314   3.9727 -4.137161 8.584185 
1 1 1   21   27   15 f   78.697   2.8423  131.560   8.7708  127.571   14.777  133.729   10.898   77.484   4.6238   79.910   3.3067 -2.425621 5.684525 
1 1 1   21   27   16 o   36.120   5.0099   34.528   6.6551   17.357   11.814   42.511   8.0549   27.465   9.0205   44.774   4.3618 -17.30916 10.01973 
1 1 1   21   27   17 f   42.119   4.8012   39.755   7.9555   38.929   12.504   40.316   10.312   41.126   7.6535   43.112   5.7991 -1.986649 9.602358 
1 1 1   21   27   18 o   92.380   2.8553  181.396   10.824  169.192   15.749  192.322   14.901   89.278   4.2770   95.481   3.7839 -6.203125 5.710549 
1 1 1   21   27   19 o   32.958   5.7870   26.194   7.7844   23.581   12.198   27.990   10.111   31.170   8.9912   34.746   7.2882 -3.575508 11.57405 
1 1 1   21   27   20 o   51.545   4.3903   60.842   8.9006   43.259   13.044   76.162   12.175   43.689   7.2390   59.402   4.9696 -15.71260 8.780666 
1 1 1   21   27   21 o   52.658   4.1566   61.551   8.8955   56.205   13.359   65.809   11.923   50.253   6.4454   55.062   5.2502 -4.808586 8.313133 
1 1 1   21   27   22 o   20.260   5.9954   2.3981   9.0728   11.104   12.146  -8.5926   13.647   23.472   8.9823   17.047   7.9434 6.425459 11.99081 
1 1 1   21   27   23 o   24.408   6.4596   12.782   9.0583   17.354   12.038   6.8150   13.753   26.810   9.1117   22.006   9.1586 4.804192 12.91915 
1 1 1   21   27   24 o   21.271   6.8683  -9.7674   9.0052   23.317   24.486 -14.9421   9.6839   30.292   12.374   12.251   5.9655 18.04092 13.73664 
1 1 1   21   27   25 o   17.186   5.5515  -3.2153   8.4510 -15.2781   16.498   1.0757   9.8399   17.172   8.2162   17.199   7.4681 -0.2674675E-01 11.10305 
1 1 1   21   27   26 o   43.438   5.2250   46.522   8.7291   32.944   12.958   57.803   11.811   35.956   8.8075   50.920   5.6239 -14.96413 10.44995 
1 1 1   21   27   27 o   19.000   5.4726   1.6094   7.8454 -12.2397   11.516   13.602   10.717   14.224   6.8211   23.777   8.5598 -9.552871 10.94517 
1 1 1   21   27   28 o   55.859   4.4641   73.998   9.7947   52.392   14.205   93.581   13.524   46.772   7.3636   64.946   5.0487 -18.17385 8.928187 
1 1 1   21   28    0 o   83.290   2.7476  145.184   13.282  145.184   13.282  145.184   13.282   83.290   3.8857   83.290   3.8857 0.000000 0.000000 
1 1 1   21   28    1 o   44.306   4.2688   43.127   7.4140   32.692   10.464   53.648   10.506   38.322   6.8727   50.290   5.0654 -11.96810 8.537684 
1 1 1   21   28    2 o   27.422   5.5839   16.963   6.7281   20.209   9.5895   13.815   9.4422   29.770   7.7385   25.073   8.0521 4.696363 11.16787 
1 1 1   21   28    3 o   29.461   5.0148   18.284   5.8495   25.439   9.9454   14.499   7.2328   33.513   7.3936   25.410   6.7769 8.103182 10.02956 
1 1 1   21   28    4 o   66.042   3.0642   96.253   7.8326   76.988   12.742  107.954   9.9303   60.195   5.1322   71.890   3.3491 -11.69510 6.128344 
1 1 1   21   28    5 o   29.329   5.1806   21.739   6.3252   9.9277   12.188   26.092   7.3996   23.619   9.0075   35.038   5.1204 -11.41918 10.36119 
1 1 1   21   28    6 o   70.517   3.1351  100.165   8.2564  116.377   15.881   94.161   9.6653   73.945   5.2073   67.090   3.4929 6.855339 6.270273 
1 1 1   21   28    7 o   18.947   5.2667   5.4701   5.8332  -1.1880   11.659   7.6933   6.7370   18.310   8.0359   19.584   6.8102 -1.273701 10.53347 
1 1 1   21   28    8 o   84.151   2.9891  150.988   9.4197  144.693   17.227  153.672   11.251   82.499   5.0628   85.803   3.1791 -3.303680 5.978218 
1 1 1   21   28    9 o   60.094   3.5882   79.222   7.8664   71.407   14.723   82.344   9.3060   57.496   6.2087   62.692   3.5990 -5.195946 7.176438 
1 1 1   21   28   10 o   15.327   4.6829  -0.8778   5.6959 -19.2545   12.180   4.2662   6.4439   13.845   6.7299   16.810   6.5135 -2.964787 9.365760 
1 1 1   21   28   11 o   19.819   5.4694   6.4525   5.8424   3.1777   12.389   7.3890   6.6253   20.420   8.6082   19.219   6.7495 1.200947 10.93884 
1 1 1   21   28   12 o   89.383   3.1537  169.764   10.974  168.400   18.865  170.461   13.492   88.695   5.1568   90.071   3.6319 -1.376404 6.307405 
1 1 1   21   28   13 o   61.480   5.8633  101.775   9.1773   65.115   22.966  108.742   10.011   50.948   11.232   72.012   3.3707 -21.06415 11.72668 
1 1 1   21   28   14 o   91.306   2.9690  180.296   10.092  167.395   18.460  185.796   12.052   88.383   5.0639   94.229   3.1011 -5.846573 5.938035 
1 1 1   21   28   15 o   20.053   5.6153   6.4950   6.0513   3.2197   13.562   7.3092   6.7616   20.974   8.9315   19.133   6.8085 1.841639 11.23064 
1 1 1   21   28   16 o   27.318   6.2748   17.661   7.9741   14.452   13.985   19.207   9.7065   26.067   9.7121   28.570   7.9477 -2.502491 12.54950 
1 1 1   21   28   17 o   16.628   5.1012  -1.5051   6.9877 -12.2500   11.304   5.1394   8.8895   14.420   6.8720   18.836   7.5410 -4.415899 10.20245 
1 1 1   21   28   18 o   19.706   5.5041   5.5507   7.1000  -4.0038   11.891   10.844   8.8508   17.109   7.7650   22.302   7.8030 -5.193609 11.00828 
1 1 1   21   28   19 o   46.396   5.4570   51.558   9.2792   45.161   16.180   54.694   11.327   42.710   9.4363   50.083   5.4837 -7.372181 10.91399 
1 1 1   21   28   20 o   20.952   6.1342   5.3768   7.9770   8.6746   14.811   4.0294   9.4674   23.375   9.5945   18.529   7.6458 4.845892 12.26837 
1 1 1   21   28   21 o   17.938   5.6864  -2.9176   7.9237   4.2785   14.594  -5.9257   9.4355   21.451   9.2028   14.425   6.6819 7.025199 11.37273 
1 1 1   21   28   22 o   58.499   4.7093   77.777   11.073   77.993   14.228   77.447   17.635   59.238   5.8234   57.761   7.4025 1.477028 9.418504 
1 1 1   21   28   23 o   29.026   6.4490   20.883   9.9156   5.3300   14.782   33.605   13.369   21.648   9.2740   36.404   8.9639 -14.75590 12.89799 
1 1 1   21   28   24 o   23.574   6.4705   11.958   9.0050   11.468   12.743   12.446   12.727   23.335   9.1270   23.813   9.1743 -0.4780922 12.94098 
1 1 1   21   28   25 o   54.317   5.4015   72.242   10.694   65.860   18.730   75.328   13.026   50.491   9.3382   58.144   5.4318 -7.652855 10.80305 
1 1 1   21   28   26 o   27.245   6.2840   19.630   8.2899   15.177   12.951   22.721   10.790   24.819   9.3267   29.670   8.4241 -4.851095 12.56792 
1 1 1   21   28   27 o   38.133   5.7109   37.538   8.8466   27.647   13.108   45.811   11.989   31.923   9.3534   44.343   6.5551 -12.41991 11.42171 
1 1 1   21   29    0 o   59.764   3.2879   75.950   11.302   75.950   11.302   75.950   11.302   59.764   4.6497   59.764   4.6497 0.000000 0.000000 
1 1 1   21   29    1 o   42.040   4.6539   40.849   7.3825   24.739   10.624   55.890   10.266   32.767   7.9438   51.312   4.8508 -18.54506 9.307711 
1 1 1   21   29    2 o   30.080   5.5263   20.854   7.0159   25.288   9.8837   16.351   9.9609   33.321   7.3857   26.839   8.2227 6.482517 11.05266 
1 1 1   21   29    3 o   62.970   3.3138   84.246   8.5504   72.809   11.997   96.051   12.189   58.510   4.9715   67.431   4.3828 -8.921688 6.627594 
1 1 1   21   29    4 o   82.942   3.0680  147.256   10.303  132.943   15.664  158.167   13.677   79.121   4.8002   86.762   3.8221 -7.640739 6.135933 
1 1 1   21   29    5 o   88.892   2.9555  170.224   9.7163  158.480   17.990  175.061   11.545   86.213   5.0593   91.570   3.0569 -5.356758 5.911069 
1 1 1   21   29    6 o   65.797   3.6574  101.590   8.6334   71.604   15.291  115.622   10.460   57.307   6.4693   74.288   3.4139 -16.98057 7.314839 
1 1 1   21   29    7 o   67.451   3.3914   98.397   8.4891   93.134   15.677  100.580   10.098   65.671   5.7879   69.230   3.5364 -3.559120 6.782784 
1 1 1   21   29    8 o   32.663   5.3483   22.736   6.3449   28.998   12.706   20.656   7.3233   34.943   8.8166   30.382   6.0567 4.561335 10.69652 
1 1 1   21   29    9 o   29.543   5.0147   22.106   6.2060   10.874   11.018   27.327   7.5110   23.365   8.6371   35.721   5.0981 -12.35625 10.02947 
1 1 1   21   29   10 o   68.883   3.1756  108.388   8.2355   78.015   13.556  126.156   10.368   60.164   5.4629   77.601   3.2395 -17.43685 6.351181 
1 1 1   21   29   11 o   15.948   4.8233   0.7916   5.6297  -8.3523   10.893   4.1240   6.5760   15.178   7.0807   16.718   6.5515 -1.539832 9.646672 
1 1 1   21   29   12 o   36.164   5.6614   37.935   8.0361   12.154   16.274   46.249   9.2413   25.819   10.247   46.508   4.8177 -20.68948 11.32279 
1 1 1   21   29   13 o   34.491   4.9845   34.220   6.6225   10.602   12.341   43.771   7.8482   23.568   9.0458   45.415   4.1899 -21.84698 9.969085 
1 1 1   21   29   14 o   37.424   5.4668   37.606   6.8650   23.062   14.727   41.644   7.7597   30.613   10.072   44.235   4.2532 -13.62159 10.93353 
1 1 1   21   29   15 o   20.445   5.7241   3.6496   5.8960   15.591   13.607   0.8895   6.5420   26.293   9.6181   14.596   6.2091 11.69702 11.44818 
1 1 1   21   29   16 o   41.537   5.3072   42.950   8.1924   30.433   13.584   50.106   10.271   34.999   9.2649   48.075   5.1797 -13.07655 10.61449 
1 1 1   21   29   17 o   46.063   5.2592   54.128   8.5541   34.867   14.510   64.389   10.590   37.394   9.4142   54.732   4.6913 -17.33883 10.51836 
1 1 1   21   29   18 o   45.180   5.0512   51.154   8.3244   29.502   12.773   67.142   10.976   34.553   8.9061   55.807   4.7684 -21.25366 10.10231 
1 1 1   21   29   19 o   25.325   6.2501   14.599   7.9838   18.409   12.285   11.813   10.504   27.439   9.2054   23.212   8.4568 4.227081 12.50024 
1 1 1   21   29   20 o   23.970   5.9864   9.8731   7.7811   23.658   12.771   1.7349   9.8127   30.431   9.3085   17.509   7.5300 12.92164 11.97287 
1 1 1   21   29   21 o   20.227   5.8886   6.0881   7.8125   5.2469   12.491   6.6286   10.012   20.531   8.6489   19.923   7.9936 0.6086826 11.77710 
1 1 1   21   29   22 o   24.029   6.5365   12.716   9.1071   12.005   12.427   13.540   13.385   23.529   9.0654   24.529   9.4191 -0.9995670 13.07291 
1 1 1   21   29   23 o   20.651   5.9291  -1.0172   8.2471   20.658   14.614 -11.1458   9.9899   28.021   10.005   13.281   6.3647 14.74032 11.85827 
1 1 1   21   29   24 o   42.666   5.8252   45.492   10.117   22.147   13.623   74.206   15.108   28.658   9.6930   56.673   6.4636 -28.01470 11.65044 
1 1 1   21   29   25 o   22.296   6.5515   9.4247   9.3041   7.2926   18.041   10.197   10.860   22.877   10.019   21.716   8.4443 1.161413 13.10306 
1 1 1   21   30    0 o   9.4676   4.6274  -6.3445   8.6645  -6.3445   8.6645  -6.3445   8.6645   9.4676   6.5442   9.4676   6.5442 0.000000 0.000000 
1 1 1   21   30    1 o   59.599   3.3126   75.968   8.0446   62.077   11.251   90.496   11.506   53.840   5.0669   65.358   4.2685 -11.51842 6.625236 
1 1 1   21   30    2 o   34.680   5.0625   27.510   7.1215   33.862   10.008   20.995   10.136   39.414   6.1565   29.946   8.0381 9.468264 10.12491 
1 1 1   21   30    3 o   39.042   5.4667   42.401   8.5022   13.450   14.256   58.383   10.592   25.821   9.7671   52.263   4.9138 -26.44155 10.93350 
1 1 1   21   30    4 o   64.953   3.4987   91.561   9.0917   84.088   14.371   96.547   11.740   62.391   5.5848   67.515   4.2158 -5.124279 6.997416 
1 1 1   21   30    5 o   38.751   5.2832   34.584   7.9600   32.316   13.003   35.944   10.066   36.866   8.6933   40.636   6.0062 -3.770805 10.56633 
1 1 1   21   30    6 o   39.421   4.7476   31.512   6.7942   42.762   13.427   27.641   7.8771   43.016   7.8577   35.827   5.3307 7.188744 9.495244 
1 1 1   21   30    7 o   37.935   4.6715   33.874   6.4218   27.825   11.403   36.685   7.7715   34.362   8.1659   41.507   4.5396 -7.144367 9.342946 
1 1 1   21   30    8 o   22.260   5.5371   9.0368   5.7560   15.005   11.122   6.8538   6.7268   25.768   8.7583   18.751   6.7772 7.016844 11.07423 
1 1 1   21   30    9 o   91.989   2.6912  177.618   9.8479  182.921   16.321  174.582   12.349   92.784   4.2650   91.193   3.2833 1.591064 5.382377 
1 1 1   21   30   10 f   35.848   4.8722   29.756   6.4321   27.510   11.679   30.734   7.7062   33.889   8.3983   37.808   4.9419 -3.919151 9.744375 
1 1 1   21   30   11 o   54.623   3.6875   63.340   7.9801   69.273   13.510   60.161   9.8897   56.226   5.8258   53.021   4.5224 3.204216 7.375086 
1 1 1   21   30   12 o   33.073   6.2697   26.147   7.6246   26.978   16.910   25.934   8.5423   32.408   10.799   33.737   6.3726 -1.329533 12.53941 
1 1 1   21   30   13 o   77.103   3.0104  131.019   8.7946  115.300   15.345  138.707   10.732   72.985   5.0977   81.221   3.2037 -8.236038 6.020821 
1 1 1   21   30   14 o   54.920   3.5245   62.985   7.2204   70.440   13.764   60.155   8.4812   56.587   5.8973   53.253   3.8614 3.333931 7.049025 
1 1 1   21   30   15 o   29.299   5.1983   21.859   7.6130   2.5236   12.476   33.329   9.6093   19.751   8.4923   38.848   5.9974 -19.09655 10.39652 
1 1 1   21   30   16 o   69.988   3.2641  106.045   9.2838  101.779   14.216  109.217   12.259   68.474   5.0336   71.502   4.1569 -3.028389 6.528167 
1 1 1   21   30   17 o   18.313   5.5906   2.1070   7.3747   0.8050   12.879   2.7422   8.9954   19.183   8.4317   17.444   7.3434 1.738565 11.18118 
1 1 1   21   30   18 o   39.975   5.6144   38.888   8.7383   36.012   14.299   40.602   11.040   37.519   9.2895   42.431   6.3082 -4.912025 11.22890 
1 1 1   21   30   19 o   77.818   3.5716  138.397   10.847  106.684   16.943  160.420   14.119   69.049   5.9494   86.587   3.9535 -17.53870 7.143178 
1 1 1   21   30   20 o   99.309   2.9034  213.201   11.814  192.766   17.073  231.977   16.365   94.435   4.3835  104.184   3.8086 -9.748650 5.806894 
1 1 1   21   30   21 o   64.829   3.5694   92.207   9.4890   96.579   14.322   88.786   12.668   66.013   5.2604   63.645   4.8259 2.368114 7.138739 
1 1 1   21   30   22 o   22.865   6.2567   11.751   8.5645   4.4090   15.314   15.093   10.331   21.108   9.2379   24.623   8.4407 -3.515306 12.51335 
1 1 1   21   30   23 o   46.686   5.5157   52.466   10.140   38.626   13.507   70.338   15.348   38.632   8.6876   54.739   6.7982 -16.10683 11.03135 
1 1 1   21   31    0 o   31.189   6.2370   25.314   9.8263   25.314   9.8263   25.314   9.8263   31.189   8.8204   31.189   8.8204 0.000000 0.000000 
1 1 1   21   31    1 o   22.577   5.3334   9.9441   6.5348   1.2932   9.3242   18.295   9.1612   17.245   7.3761   27.908   7.7055 -10.66275 10.66687 
1 1 1   21   31    2 o   31.108   5.2354   22.352   7.1600   33.239   10.216   11.841   10.038   38.799   6.3840   23.417   8.2996 15.38210 10.47089 
1 1 1   21   31    3 o   56.849   3.9027   71.923   8.8867   59.566   13.430   81.547   11.853   51.980   6.2643   61.717   4.6563 -9.737183 7.805330 
1 1 1   21   31    4 o   41.142   4.9241   36.953   8.0359   45.740   13.076   31.620   10.186   45.143   7.0231   37.140   6.9038 8.002762 9.848198 
1 1 1   21   31    5 o   38.184   5.5413   36.023   8.3418   25.464   13.215   43.017   10.755   32.083   9.3889   44.285   5.8885 -12.20233 11.08266 
1 1 1   21   31    6 o   51.009   3.8827   56.675   8.1632   57.013   11.772   56.361   11.330   51.109   5.5845   50.909   5.3958 0.1998520 7.765417 
1 1 1   21   31    7 o   44.318   3.8498   43.826   6.5289   39.630   11.246   45.960   8.0186   42.194   6.4622   46.441   4.1863 -4.247368 7.699645 
1 1 1   21   31    8 o   49.599   3.9721   57.952   7.1886   43.145   12.557   65.170   8.7673   43.758   6.9577   55.441   3.8342 -11.68275 7.944209 
1 1 1   21   31    9 o   24.967   5.4957   11.058   5.8029   24.089   11.607   6.7158   6.7003   31.422   8.6726   18.512   6.7527 12.90969 10.99148 
1 1 1   21   31   10 o   38.766   4.9904   38.565   6.7306   25.473   12.443   43.980   8.0023   32.139   9.0192   45.393   4.2743 -13.25400 9.980788 
1 1 1   21   31   11 o   21.310   6.1111   2.7778   6.7339   18.181   16.008  -0.5338   7.4225   27.927   10.394   14.692   6.4307 13.23565 12.22224 
1 1 1   21   31   12 f   37.320   5.1276   32.387   6.6057   31.821   13.456   32.567   7.5823   35.767   9.0997   38.874   4.7291 -3.106651 10.25518 
1 1 1   21   31   13 o   48.228   4.0669   50.368   7.0665   53.263   13.983   49.375   8.1892   48.381   7.0073   48.075   4.1301 0.3060150 8.133841 
1 1 1   21   31   14 o   43.387   4.8701   47.479   7.0554   34.648   13.404   52.396   8.2979   37.269   8.8519   49.505   4.0640 -12.23610 9.740220 
1 1 1   21   31   15 o   18.561   5.4543   3.7278   7.1394  -4.4003   12.187   7.9744   8.8091   16.967   7.7622   20.154   7.6646 -3.187441 10.90859 
1 1 1   21   31   16 f   17.433   5.2518   1.8420   6.8553  -5.5102   11.443   5.9584   8.5620   16.070   7.4135   18.796   7.4409 -2.725807 10.50370 
1 1 1   21   31   17 o   36.418   5.3838   31.534   7.6984   34.724   12.243   29.448   9.9006   37.591   8.1329   35.246   7.0567 2.344421 10.76758 
1 1 1   21   31   18 o   48.340   5.0089   57.996   8.9389   36.385   13.303   75.789   12.070   37.914   8.6924   58.767   4.9798 -20.85362 10.01786 
1 1 1   21   31   19 o   36.988   6.4521   35.746   9.7817   35.794   13.759   35.697   13.909   37.059   9.0743   36.918   9.1749 0.1407776 12.90429 
1 1 1   21   31   20 o   94.624   3.5363  197.887   13.773  195.135   18.844  201.044   20.182   94.102   4.8551   95.145   5.1430 -1.042274 7.072654 
1 1 1   21   31   21 o   44.090   8.4585   51.908   13.569   45.200   15.230   77.717   29.874   41.407   9.1607   46.773   14.222 -5.365387 16.91700 
1 1 1   21   32    0 o   47.535   4.1136   50.044   10.948   50.044   10.948   50.044   10.948   47.535   5.8175   47.535   5.8175 0.000000 0.000000 
1 1 1   21   32    1 o   52.144   3.7885   59.838   7.9822   46.876   11.318   72.667   11.260   46.140   5.9472   58.147   4.6949 -12.00651 7.577013 
1 1 1   21   32    2 o   65.203   3.2858   90.886   8.8040   80.787   12.052  102.439   12.891   61.268   4.7695   69.139   4.5208 -7.870621 6.571589 
1 1 1   21   32    3 o   59.461   3.8297   77.542   9.2524   73.448   14.104   80.635   12.259   57.764   5.9201   61.157   4.8599 -3.392975 7.659390 
1 1 1   21   32    4 o   42.114   4.8338   40.298   8.0206   40.219   12.619   40.351   10.389   41.402   7.6725   42.826   5.8817 -1.423538 9.667562 
1 1 1   21   32    5 o   23.850   5.3426   10.770   6.9407   23.179   10.038  -0.5980   9.6076   31.152   7.8234   16.548   7.2778 14.60356 10.68514 
1 1 1   21   32    6 o   59.535   3.4845   77.757   8.4001   63.788   12.181   90.425   11.600   54.044   5.4647   65.027   4.3250 -10.98285 6.969096 
1 1 1   21   32    7 o   35.284   5.0898   28.121   7.2634   36.707   11.119   21.729   9.5932   40.412   6.6707   30.156   7.6894 10.25649 10.17967 
1 1 1   21   32    8 o   50.345   4.0470   56.948   8.1612   49.372   12.549   62.501   10.743   46.929   6.4835   53.760   4.8452 -6.831524 8.093937 
1 1 1   21   32    9 o   45.982   3.8927   42.355   6.7476   57.117   13.077   36.998   7.8773   50.541   6.2733   41.424   4.6106 9.116581 7.785341 
1 1 1   21   32   10 o   68.218   3.2007  102.669   8.2536   93.999   14.608  106.735   10.004   65.411   5.4145   71.026   3.4149 -5.614594 6.401441 
1 1 1   21   32   11 o   40.111   5.8885   35.383   7.9673   46.386   17.747   32.606   8.9162   41.843   10.343   38.378   5.6329 3.464989 11.77705 
1 1 1   21   32   12 o   91.957   2.7401  180.081   9.8352  182.192   16.892  178.998   12.097   91.851   4.4590   92.063   3.1859 -0.2125473 5.480168 
1 1 1   21   32   13 o   44.399   4.4609   45.835   6.9772   42.517   13.064   47.159   8.2527   41.993   7.8310   46.805   4.2751 -4.811203 8.921897 
1 1 1   21   32   14 o   74.087   3.1503  121.455   8.7910  111.327   15.650  126.124   10.626   71.021   5.3429   77.153   3.3392 -6.131882 6.300515 
1 1 1   21   32   15 o   21.667   6.1305   7.5325   8.9783   15.088   11.794  -2.8831   13.847   24.989   8.9813   18.346   8.3469 6.642597 12.26106 
1 1 1   21   32   16 o   23.971   6.2931   10.369   9.3640  -2.4661   12.997   24.222   13.503   17.855   8.1093   30.088   9.6255 -12.23245 12.58616 
1 1 1   21   32   17 o   51.642   5.3476   63.262   11.300   58.266   14.891   70.047   17.352   49.523   7.2903   53.762   7.8255 -4.239235 10.69521 
1 1 1   21   32   18 o   49.144   5.5340   58.930   10.947   53.074   15.031   65.542   15.973   45.999   8.2246   52.288   7.4066 -6.288738 11.06809 
1 1 1   21   32   19 o   45.942   5.6768   52.494   10.405   43.968   14.607   61.277   14.824   41.080   8.8799   50.805   7.0746 -9.725403 11.35352 
1 1 1   21   33    0 o   26.893   6.9503   21.246   10.053   21.246   10.053   21.246   10.053   26.893   9.8291   26.893   9.8291 0.000000 0.000000 
1 1 1   21   33    1 o   47.786   4.0136   50.524   7.8934   46.856   11.144   54.218   11.182   45.924   5.8837   49.648   5.4607 -3.723812 8.027223 
1 1 1   21   33    2 o   42.074   5.2399   43.969   8.3700   30.604   13.020   53.383   10.927   34.845   8.9974   49.303   5.3736 -14.45783 10.47989 
1 1 1   21   33    3 o   29.955   6.1107   22.702   8.0156   19.365   12.535   25.010   10.426   27.864   9.2985   32.046   7.9311 -4.181684 12.22144 
1 1 1   21   33    4 o   98.027   3.1530  213.688   12.252  175.991   19.020  240.421   16.017   89.696   5.1413  106.357   3.6513 -16.66090 6.305935 
1 1 1   21   33    5 o   42.965   4.9778   44.325   8.1688   27.847   11.620   60.427   11.486   33.492   8.4207   52.438   5.3109 -18.94602 9.955598 
1 1 1   21   33    6 o  100.041   3.4904  219.525   13.823  148.296   18.971  300.141   20.183   81.805   5.6228  118.277   4.1373 -36.47187 6.980883 
1 1 1   21   33    7 o   28.725   5.8253   20.420   7.2220   20.390   11.028   20.442   9.5566   28.540   8.6326   28.911   7.8239 -0.3706932 11.65057 
1 1 1   21   33    8 o   22.610   5.6926   11.512   6.8868   7.1352   10.522   14.792   9.1087   20.428   8.1952   24.792   7.9031 -4.363621 11.38511 
1 1 1   21   33    9 o   26.967   6.4481   18.379   8.6702   21.257   11.073   13.818   13.938   29.079   8.6179   24.855   9.5939 4.224487 12.89616 
1 1 1   21   33   10 o   25.774   6.7216   15.033   9.9054   23.173   14.014   6.9041   14.003   29.727   9.8276   21.821   9.1727 7.906975 13.44321 
1 1 1   21   33   11 o   17.918   6.1862 -14.6723   10.411 -16.2926   11.497  -7.2848   24.549   13.443   6.5353   22.393   10.506 -8.950348 12.37248 
1 1 1   21   33   12 o   28.317   6.9260   20.728   10.145   14.163   14.281   27.417   14.414   24.808   9.6732   31.825   9.9150 -7.017223 13.85202 
1 1 1   21   33   13 o   24.001   6.6287   12.645   9.6002   17.245   13.917   8.4691   13.260   26.123   9.6972   21.880   9.0402 4.242950 13.25744 
1 1 1   21   33   14 o   25.098   6.8403   15.202   10.123   18.646   14.118   11.558   14.522   26.722   9.7938   23.474   9.5521 3.248032 13.68068 
1 1 1   21   33   15 o   41.494   6.2472   45.153   10.698   29.850   15.068   60.708   15.192   32.573   10.136   50.415   7.3060 -17.84198 12.49435 
1 1 1   21   33   16 o   24.543   5.8710   7.4313   9.6772   32.002   13.579 -17.9272   13.795   34.437   9.3291   14.649   7.1304 19.78774 11.74200 
1 1 1   21   34    0 o   52.357   3.8117   60.252   11.358   60.252   11.358   60.252   11.358   52.357   5.3905   52.357   5.3905 0.000000 0.000000 
1 1 1   21   34    1 o   81.275   2.9117  141.944   9.7596  144.027   13.912  139.926   13.695   81.860   4.1206   80.690   4.1150 1.169403 5.823452 
1 1 1   21   34    2 o   65.997   3.5822   92.601   9.5926  114.283   15.309   78.586   12.308   72.093   5.1487   59.901   4.9820 12.19194 7.164471 
1 1 1   21   34    3 o   53.200   4.2114   62.461   9.1488   71.959   14.215   55.745   11.954   56.483   6.1019   49.917   5.8062 6.566277 8.422863 
1 1 1   21   34    4 o   50.882   4.2087   58.805   8.5441   42.476   11.944   75.915   12.227   42.965   6.7404   58.799   5.0417 -15.83364 8.417345 
1 1 1   21   34    5 o   31.116   5.9133   24.239   7.7374   26.989   11.496   21.961   10.462   32.672   8.4630   29.561   8.2611 3.110891 11.82655 
1 1 1   21   34    6 o   22.236   5.7328   9.6113   7.0395   17.744   10.977   3.9312   9.1742   26.533   8.6945   17.938   7.4742 8.594856 11.46551 
1 1 1   21   34    7 o   66.561   3.5561   96.545   9.5283  102.655   15.399   92.755   12.129   67.826   5.5045   65.296   4.5038 2.529510 7.112247 
1 1 1   21   34    8 o   34.469   5.9434   30.466   9.7861   11.029   13.908   49.525   13.772   23.197   9.3810   45.741   7.3001 -22.54376 11.88675 
1 1 1   21   34    9 o   42.775   6.1472   46.673   10.475   46.566   14.787   46.781   14.841   42.731   8.6864   42.819   8.7005 -0.8798981E-01 12.29440 
1 1 1   21   34   10 o   37.267   7.9464   33.904   12.495   65.482   23.888   22.010   14.660   46.112   12.324   28.422   10.035 17.69012 15.89275 
1 1 1   21   34   11 f   21.113   6.7843   1.9164   11.887   5.0209   13.560  -8.3866   24.703   20.489   8.8316   21.736   10.301 -1.246645 13.56856 
1 1 1   21   34   12 o   25.742   6.6910   15.594   10.031   5.3500   14.032   26.300   14.344   20.775   8.9694   30.708   9.9312 -9.932951 13.38204 
1 1 1   21   34   13 o   22.355   6.4820   9.4333   9.6457   14.063   13.963   5.2069   13.341   24.302   9.5398   20.408   8.7782 3.894814 12.96397 
1 1 1   21   35    0 o   15.442   6.4578   7.2025   10.019   7.2025   10.019   7.2025   10.019   15.442   9.1327   15.442   9.1327 0.000000 0.000000 
1 1 1   21   35    1 o   34.081   6.0392   29.574   8.3164   32.149   13.363   27.946   10.625   34.761   9.1830   33.401   7.8459 1.359974 12.07835 
1 1 1   21   35    2 o   33.112   6.3055   27.329   8.4991   35.565   14.476   22.997   10.499   36.268   9.5467   29.956   8.2400 6.311878 12.61104 
1 1 1   21   35    3 o   27.095   6.4361   19.279   8.3948   18.356   13.847   19.815   10.556   26.492   9.7006   27.698   8.4613 -1.206408 12.87227 
1 1 1   21   35    4 o   63.181   4.1312   89.097   10.449   97.301   17.206   84.303   13.153   64.826   6.4352   61.535   5.1823 3.291096 8.262442 
1 1 1   21   35    5 o   28.732   5.6813   23.463   8.2615   4.4680   14.646   32.327   10.005   20.748   9.0586   36.715   6.8593 -15.96782 11.36255 
1 1 1   21   35    6 o   29.658   6.4214   22.059   8.1801   29.003   14.394   18.746   9.9415   32.268   9.8844   27.049   8.1998 5.219091 12.84282 
1 1 1   21   35    7 o   29.632   6.1470   24.029   8.1168   18.070   14.167   26.941   9.9034   26.268   9.7773   32.996   7.4530 -6.728916 12.29402 
1 1 1   21   35    8 o   32.169   6.7589   28.235   9.9321   36.551   14.275   20.430   13.828   36.843   9.3718   27.496   9.7417 9.347261 13.51786 
1 1 1   22    0    0 o   68.647   5.7555  101.410   22.192  101.410   22.192  101.410   22.192   68.647   8.1396   68.647   8.1396 0.000000 0.000000 
1 1 1   22    0    1 o   73.618   3.9067  113.862   16.558  113.862   16.558  113.862   16.558   73.618   5.5249   73.618   5.5249 0.000000 0.000000 
1 1 1   22    0    2 o  182.668   3.1257  690.206   33.260  690.206   33.260  690.206   33.260  182.668   4.4205  182.668   4.4205 0.000000 0.000000 
1 1 1   22    0    3 o  366.125   4.1854  2772.95   89.329  2772.95   89.329  2772.95   89.329  366.125   5.9190  366.125   5.9190 0.000000 0.000000 
1 1 1   22    0    4 o   27.653   8.0167   22.187   12.762   22.187   12.762   22.187   12.762   27.653   11.337   27.653   11.337 0.000000 0.000000 
1 1 1   22    0    5 o  228.421   3.3041  1078.93   43.980  1078.93   43.980  1078.93   43.980  228.421   4.6727  228.421   4.6727 0.000000 0.000000 
1 1 1   22    0    6 o   49.804   3.8777   53.089   10.916   53.089   10.916   53.089   10.916   49.804   5.4839   49.804   5.4839 0.000000 0.000000 
1 1 1   22    0    7 o   43.441   3.6797   40.634   8.9699   40.634   8.9699   40.634   8.9699   43.441   5.2039   43.441   5.2039 0.000000 0.000000 
1 1 1   22    0    8 o   36.660   4.4653   30.133   8.6981   30.133   8.6981   30.133   8.6981   36.660   6.3148   36.660   6.3148 0.000000 0.000000 
1 1 1   22    0    9 o   78.291   2.4639  127.269   11.201  127.269   11.201  127.269   11.201   78.291   3.4845   78.291   3.4845 0.000000 0.000000 
1 1 1   22    0   10 o  180.225   2.1850  670.910   22.955  670.910   22.955  670.910   22.955  180.225   3.0901  180.225   3.0901 0.000000 0.000000 
1 1 1   22    0   11 o  381.621   3.0288  3008.71   67.400  3008.71   67.400  3008.71   67.400  381.621   4.2833  381.621   4.2833 0.000000 0.000000 
1 1 1   22    0   12 o  151.374   2.4499  473.736   21.606  473.736   21.606  473.736   21.606  151.374   3.4647  151.374   3.4647 0.000000 0.000000 
1 1 1   22    0   13 o   91.546   2.8869  174.091   15.346  174.091   15.346  174.091   15.346   91.546   4.0827   91.546   4.0827 0.000000 0.000000 
1 1 1   22    0   14 o  198.924   2.2581  817.354   26.185  817.354   26.185  817.354   26.185  198.924   3.1934  198.924   3.1934 0.000000 0.000000 
1 1 1   22    0   15 o   30.871   5.6215   23.243   8.7489   23.243   8.7489   23.243   8.7489   30.871   7.9500   30.871   7.9500 0.000000 0.000000 
1 1 1   22    0   16 o   70.540   2.6900  103.639   10.994  103.639   10.994  103.639   10.994   70.540   3.8043   70.540   3.8043 0.000000 0.000000 
1 1 1   22    0   17 o  344.149   2.8517  2447.18   57.227  2447.18   57.227  2447.18   57.227  344.149   4.0329  344.149   4.0329 0.000000 0.000000 
1 1 1   22    0   18 o   32.162   8.5480   29.044   14.990   29.044   14.990   29.044   14.990   32.162   12.089   32.162   12.089 0.000000 0.000000 
1 1 1   22    0   19 o  234.636   2.9079  1138.55   39.770  1138.55   39.770  1138.55   39.770  234.636   4.1124  234.636   4.1124 0.000000 0.000000 
1 1 1   22    0   20 o  139.156   2.5385  400.774   20.573  400.774   20.573  400.774   20.573  139.156   3.5900  139.156   3.5900 0.000000 0.000000 
1 1 1   22    0   21 o  179.500   2.4880  666.365   26.027  666.365   26.027  666.365   26.027  179.500   3.5186  179.500   3.5186 0.000000 0.000000 
1 1 1   22    0   22 o  238.589   2.8491  1177.75   39.625  1177.75   39.625  1177.75   39.625  238.589   4.0293  238.589   4.0293 0.000000 0.000000 
1 1 1   22    0   23 o  148.014   2.7237  453.887   23.479  453.887   23.479  453.887   23.479  148.014   3.8519  148.014   3.8519 0.000000 0.000000 
1 1 1   22    0   24 o  168.282   3.0631  587.464   30.021  587.464   30.021  587.464   30.021  168.282   4.3319  168.282   4.3319 0.000000 0.000000 
1 1 1   22    0   25 o   70.296   3.4761  103.966   14.093  103.966   14.093  103.966   14.093   70.296   4.9159   70.296   4.9159 0.000000 0.000000 
1 1 1   22    0   26 o  181.276   2.5247  680.854   26.672  680.854   26.672  680.854   26.672  181.276   3.5704  181.276   3.5704 0.000000 0.000000 
1 1 1   22    0   27 o   40.224   5.8226   37.791   12.077   37.791   12.077   37.791   12.077   40.224   8.2345   40.224   8.2345 0.000000 0.000000 
1 1 1   22    0   28 o   33.039   6.8514   28.119   11.470   28.119   11.470   28.119   11.470   33.039   9.6893   33.039   9.6893 0.000000 0.000000 
1 1 1   22    0   29 o   75.215   3.4050  119.163   14.798  119.163   14.798  119.163   14.798   75.215   4.8154   75.215   4.8154 0.000000 0.000000 
1 1 1   22    0   30 o   18.709   8.2315   6.1377   18.138   6.1377   18.138   6.1377   18.138   18.709   11.641   18.709   11.641 0.000000 0.000000 
1 1 1   22    0   31 o   15.803   6.9811   3.7875   13.179   3.7875   13.179   3.7875   13.179   15.803   9.8728   15.803   9.8728 0.000000 0.000000 
1 1 1   22    0   32 o   11.091   5.3724  -6.7337   11.083  -6.7337   11.083  -6.7337   11.083   11.091   7.5977   11.091   7.5977 0.000000 0.000000 
1 1 1   22    0   33 o   62.401   4.0563   83.641   14.477   83.641   14.477   83.641   14.477   62.401   5.7365   62.401   5.7365 0.000000 0.000000 
1 1 1   22    0   34 o   22.458   8.0071   16.461   12.972   16.461   12.972   16.461   12.972   22.458   11.324   22.458   11.324 0.000000 0.000000 
1 1 1   22    0   35 o   9.4585   4.7392 -13.3184   10.884 -13.3184   10.884 -13.3184   10.884   9.4585   6.7023   9.4585   6.7023 0.000000 0.000000 
1 1 1   22    0   36 o   52.588   4.6056   61.251   13.545   61.251   13.545   61.251   13.545   52.588   6.5133   52.588   6.5133 0.000000 0.000000 
1 1 1   22    0   37 o   64.994   3.9437   91.127   14.697   91.127   14.697   91.127   14.697   64.994   5.5772   64.994   5.5772 0.000000 0.000000 
1 1 1   22    0   38 o   14.698   7.1482 -10.0848   20.069 -10.0848   20.069 -10.0848   20.069   14.698   10.109   14.698   10.109 0.000000 0.000000 
1 1 1   22    0   39 o   31.484   11.870   39.612   29.625   39.612   29.625   39.612   29.625   31.484   16.787   31.484   16.787 0.000000 0.000000 
1 1 1   22    0   40 o   27.250   10.901   29.690   26.651   29.690   26.651   29.690   26.651   27.250   15.416   27.250   15.416 0.000000 0.000000 
1 1 1   22    0   41 o   21.275   9.6718   11.324   27.470   11.324   27.470   11.324   27.470   21.275   13.678   21.275   13.678 0.000000 0.000000 
1 1 1   22    1    0 o   74.112   3.7792  115.236   16.142  115.236   16.142  115.236   16.142   74.112   5.3446   74.112   5.3446 0.000000 0.000000 
1 1 1   22    1    1 o  116.114   3.2086  278.601   15.341  256.999   21.392  301.471   22.011  111.475   4.6528  120.752   4.4195 -9.277412 6.417222 
1 1 1   22    1    2 f  181.850   3.1343  683.246   23.500  703.403   33.788  664.360   32.706  184.445   4.4415  179.255   4.4237 5.190033 6.268664 
1 1 1   22    1    3 o  119.502   3.1439  295.264   15.495  296.563   22.028  293.992   21.800  119.761   4.4596  119.243   4.4326 0.5183334 6.287761 
1 1 1   22    1    4 o  136.498   3.0806  385.117   17.341  392.721   24.735  377.767   24.318  137.823   4.3514  135.173   4.3619 2.650345 6.161226 
1 1 1   22    1    5 o  108.074   3.2491  241.566   14.482  239.531   20.477  243.602   20.486  107.617   4.6133  108.530   4.5765 -0.9131241 6.498224 
1 1 1   22    1    6 f  107.141   2.4095  234.398   10.513  221.125   13.664  253.663   16.461  103.476   3.2015  110.806   3.6018 -7.330498 4.819017 
1 1 1   22    1    7 o  199.380   2.2211  820.919   18.265  827.564   25.937  814.382   25.725  200.180   3.1414  198.579   3.1409 1.600708 4.442270 
1 1 1   22    1    8 o  183.471   2.1842  694.914   16.525  708.744   23.648  681.715   23.102  185.253   3.0950  181.688   3.0829 3.565704 4.368428 
1 1 1   22    1    9 o  273.435   2.4981  1544.52   28.169  1529.92   39.467  1559.68   40.219  272.121   3.5165  274.750   3.5491 -2.629242 4.996194 
1 1 1   22    1   10 o  193.890   2.2104  776.349   17.676  782.146   25.150  770.690   24.847  194.604   3.1335  193.175   3.1186 1.429016 4.420852 
1 1 1   22    1   11 o   48.534   3.3184   48.795   6.6285   47.852   9.6400   49.640   9.1292   48.082   4.8610   48.985   4.5186 -0.9023247 6.636808 
1 1 1   22    1   12 o  312.295   2.6813  2015.85   34.536  2021.70   48.994  2010.07   48.690  312.744   3.7983  311.845   3.7856 0.8986816 5.362633 
1 1 1   22    1   13 o  120.764   2.1786  301.231   10.850  296.832   15.336  305.639   15.353  119.880   3.1018  121.648   3.0601 -1.767960 4.357193 
1 1 1   22    1   14 o  192.325   2.4425  755.747   18.988  723.604   24.302  806.125   30.424  187.166   3.1481  197.484   3.7352 -10.31813 4.884912 
1 1 1   22    1   15 o  140.799   2.1887  409.334   12.707  420.724   18.172  398.435   17.776  142.715   3.0872  138.883   3.1033 3.832886 4.377372 
1 1 1   22    1   16 o  177.570   2.2169  651.302   16.234  658.052   23.168  644.791   22.755  178.472   3.1474  176.667   3.1229 1.805023 4.433826 
1 1 1   22    1   17 o   90.307   2.6347  161.868   9.5239  196.744   15.984  142.672   11.859   97.531   3.9736   83.084   3.4607 14.44731 5.269321 
1 1 1   22    1   18 o  194.279   3.3332  778.578   26.011  767.577   33.101  796.336   42.056  192.587   4.1673  195.970   5.2033 -3.382202 6.666346 
1 1 1   22    1   19 o  182.590   3.2834  683.474   23.700  716.665   40.074  665.620   29.391  185.843   5.2282  179.336   3.9736 6.506760 6.566827 
1 1 1   22    1   20 o   97.752   2.9592  198.311   11.838  194.620   17.798  201.240   15.854   96.906   4.4529   98.597   3.8987 -1.691162 5.918448 
1 1 1   22    1   21 o   48.756   4.3676   50.088   8.6841   55.870   11.938   43.589   12.656   51.824   5.5850   45.687   6.7165 6.137318 8.735180 
1 1 1   22    1   22 o   65.127   3.4811   88.096   9.3503   88.667   13.284   87.535   13.163   65.335   4.9298   64.918   4.9162 0.4168320 6.962181 
1 1 1   22    1   23 o  110.160   2.8322  252.028   12.847  259.627   17.842  243.848   18.513  111.908   3.8656  108.412   4.1404 3.496017 5.664421 
1 1 1   22    1   24 o  117.839   4.6379  311.305   20.716  356.725   26.011  232.511   34.259  130.880   4.8185  104.798   7.9261 26.08260 9.275810 
1 1 1   22    1   25 o   23.953   6.1547   10.022   7.9229   7.1268   10.928   13.231   11.503   22.045   8.4989   25.862   8.9044 -3.816875 12.30931 
1 1 1   22    1   26 o   99.300   2.8619  205.227   11.717  198.644   16.532  211.872   16.610   97.687   4.1032  100.913   3.9908 -3.225639 5.723869 
1 1 1   22    1   27 o   28.907   6.4242   17.863   8.4310   17.018   10.949   19.096   13.215   28.029   8.6263   29.785   9.5219 -1.755762 12.84835 
1 1 1   22    1   28 o   63.668   3.7435   84.999   9.8111   87.088   14.399   83.189   13.404   64.369   5.4238   62.968   5.1612 1.401295 7.487004 
1 1 1   22    1   29 o  130.033   3.5239  361.399   17.331  340.733   31.032  370.768   20.893  126.754   5.9358  133.313   3.7998 -6.558846 7.047850 
1 1 1   22    1   30 o   53.559   6.5736   64.600   14.008   78.210   20.047   51.615   19.582   59.945   8.1085   47.174   10.349 12.77132 13.14712 
1 1 1   22    1   31 o   75.747   4.5385  128.442   13.373  148.042   17.258   98.993   21.155   83.844   4.9907   67.650   7.5819 16.19424 9.077029 
1 1 1   22    1   32 o   59.443   3.9877   74.829   9.7548   81.692   14.316   68.882   13.328   61.990   5.5994   56.897   5.6793 5.092152 7.975448 
1 1 1   22    1   33 o   73.549   3.6107  114.609   10.950  116.458   15.420  112.727   15.554   74.172   5.0404   72.925   5.1712 1.247139 7.221327 
1 1 1   22    1   34 o   67.275   5.9446  110.208   14.394  134.714   18.481   72.425   22.948   79.351   5.6469   55.199   10.463 24.15250 11.88929 
1 1 1   22    1   35 o   38.428   6.3173   33.938   9.7973   41.904   14.996   28.007   12.941   42.376   8.8649   34.480   9.0026 7.896286 12.63463 
1 1 1   22    1   36 o   22.774   6.8129   5.3928   10.058   3.7655   19.684   5.9679   11.701   24.414   10.582   21.134   8.5842 3.279675 13.62572 
1 1 1   22    1   37 o   25.149   6.1370   12.277   8.3231   22.424   12.248   3.5701   11.345   30.559   9.0650   19.739   8.2750 10.81938 12.27397 
1 1 1   22    1   38 o   23.883   7.3634   4.3961   13.640   3.1628   18.943   5.7242   19.657   23.355   10.247   24.411   10.578 -1.056665 14.72678 
1 1 1   22    1   39 o   36.844   7.8385   30.479   16.952  -9.2736   24.120   69.283   23.830   22.660   10.559   51.028   11.587 -28.36822 15.67694 
1 1 1   22    1   40 o   29.297   8.4555   19.012   16.729   30.301   23.425   7.2614   23.900   32.851   12.497   25.743   11.393 7.107998 16.91100 
1 1 1   22    1   41 f   31.006   13.264   25.077   30.157   0.0000   0.0000   25.077   30.157  ?   ?    31.006   13.264      ?      ? 
1 1 1   22    2    0 o   19.477   7.6657   10.731   12.911   10.731   12.911   10.731   12.911   19.477   10.841   19.477   10.841 0.000000 0.000000 
1 1 1   22    2    1 f   99.447   3.3242  204.558   13.633  205.514   19.164  203.579   19.398   99.685   4.6612   99.209   4.7408 0.4753418 6.648439 
1 1 1   22    2    2 o  214.868   3.2605  954.747   28.894  958.373   41.074  951.194   40.654  215.270   4.6261  214.466   4.5960 0.8037567 6.521038 
1 1 1   22    2    3 o  191.731   3.1682  759.996   25.051  769.645   35.721  750.657   35.141  192.927   4.4892  190.534   4.4717 2.392715 6.336318 
1 1 1   22    2    4 o  367.651   4.1997  2800.71   63.681  2791.71   89.795  2809.81   90.324  367.059   5.9313  368.243   5.9471 -1.183289 8.399327 
1 1 1   22    2    5 o   93.736   3.0848  180.537   11.701  176.003   15.063  187.439   18.582   92.283   3.9575   95.190   4.7330 -2.906662 6.169582 
1 1 1   22    2    6 o  236.587   2.5316  1155.53   24.425  1150.60   32.186  1162.24   37.506  236.024   3.3063  237.151   3.8345 -1.127213 5.063129 
1 1 1   22    2    7 o   96.440   2.4644  191.773   9.7064  189.544   12.823  194.763   14.854   95.797   3.2453   97.084   3.7097 -1.286980 4.928884 
1 1 1   22    2    8 o  124.370   2.1619  319.433   11.085  307.806   15.606  331.273   15.749  122.084   3.0994  126.657   3.0147 -4.573204 4.323767 
1 1 1   22    2    9 o  202.273   2.2335  844.700   18.630  862.082   26.661  828.114   26.044  204.305   3.1639  200.240   3.1534 4.064499 4.467052 
1 1 1   22    2   10 o   44.001   3.5312   40.078   6.4084   40.309   9.0950   39.850   9.0310   44.127   4.9972   43.875   4.9905 0.2518959 7.062405 
1 1 1   22    2   11 o  204.886   2.2528  866.994   19.035  872.351   27.110  861.784   26.735  205.509   3.1984  204.263   3.1734 1.246017 4.505528 
1 1 1   22    2   12 o   83.362   2.4504  143.487   8.4149  153.636   12.066  133.876   11.742   86.233   3.3925   80.491   3.5369 5.742790 4.900857 
1 1 1   22    2   13 o  126.443   2.5666  330.337   13.383  334.665   19.138  326.195   18.722  127.252   3.6464  125.634   3.6131 1.618111 5.133289 
1 1 1   22    2   14 o  149.420   2.1775  461.017   13.417  470.372   19.158  452.012   18.797  150.908   3.0780  147.933   3.0807 2.974670 4.354915 
1 1 1   22    2   15 o  198.424   2.2488  813.380   18.404  809.792   26.008  816.977   26.046  197.985   3.1849  198.862   3.1755 -0.8774567 4.497549 
1 1 1   22    2   16 o  179.938   2.5927  668.540   19.216  719.487   27.658  621.000   26.717  186.565   3.5944  173.310   3.7376 13.25520 5.185478 
1 1 1   22    2   17 o  262.483   2.6974  1426.17   28.899  1414.48   44.064  1434.99   38.282  261.486   4.0858  263.481   3.5227 -1.995239 5.394742 
1 1 1   22    2   18 o   66.994   4.7745   94.737   12.913  101.002   16.975   86.132   19.894   69.734   5.9020   64.255   7.5066 5.479034 9.548970 
1 1 1   22    2   19 o  138.120   2.8213  386.593   15.558  427.060   25.965  363.926   19.433  143.588   4.3844  132.651   3.5519 10.93755 5.642571 
1 1 1   22    2   20 o  108.816   2.9954  245.137   13.309  246.413   20.335  244.181   17.602  109.029   4.5220  108.603   3.9297 0.4263458 5.990892 
1 1 1   22    2   21 o   56.128   3.9418   65.940   9.0436   56.021   12.812   75.788   12.767   51.858   5.9903   60.398   5.1251 -8.540451 7.883534 
1 1 1   22    2   22 o   80.163   3.1520  133.286   10.417  138.504   14.840  128.216   14.628   81.715   4.4031   78.610   4.5116 3.104851 6.304077 
1 1 1   22    2   23 o   67.990   4.3077   96.852   11.898   76.277   16.474  119.285   17.203   60.341   6.6195   75.639   5.5142 -15.29849 8.615352 
1 1 1   22    2   24 o   66.676   3.8819   91.991   10.561   87.273   13.814   98.627   16.384   64.684   5.1780   68.667   5.7849 -3.982597 7.763866 
1 1 1   22    2   25 o   33.357   5.6841   22.937   9.0864   4.5094   12.673   42.432   13.035   21.891   8.9174   44.823   7.0509 -22.93171 11.36813 
1 1 1   22    2   26 o   27.040   6.2613   15.323   8.0615   14.214   11.686   16.329   11.135   26.445   8.9776   27.636   8.7304 -1.190950 12.52265 
1 1 1   22    2   27 o   23.335   5.8138   7.1962   8.0006   19.178   11.373  -4.5441   11.258   29.545   8.7279   17.124   7.6828 12.42073 11.62764 
1 1 1   22    2   28 o   48.844   4.5513   51.889   8.6520   37.434   12.135   66.832   12.339   41.292   7.3972   56.397   5.3046 -15.10538 9.102594 
1 1 1   22    2   29 o   34.333   5.8994   26.741   8.3614   32.325   11.777   21.066   11.874   38.059   7.7654   30.607   8.8832 7.451788 11.79885 
1 1 1   22    2   30 o   73.512   4.6053  106.839   12.517   97.082   14.484  135.627   24.880   67.848   5.1759   79.176   7.6188 -11.32817 9.210649 
1 1 1   22    2   31 o  121.971   3.0108  313.756   14.874  298.811   23.017  324.472   19.490  119.266   4.6791  124.675   3.7902 -5.408630 6.021604 
1 1 1   22    2   32 o   76.019   3.5578  123.615   11.015  107.313   16.107  137.940   15.098   71.075   5.4944   80.964   4.5213 -9.889404 7.115547 
1 1 1   22    2   33 o  106.266   4.2333  241.267   18.537  227.674   25.725  255.947   26.735  103.117   6.0487  109.415   5.9243 -6.297455 8.466594 
1 1 1   22    2   34 o   20.625   5.8620   3.3445   8.0275   11.771   11.859  -3.7816   10.906   24.465   8.9747   16.784   7.5437 7.680073 11.72400 
1 1 1   22    2   35 o   56.260   4.4462   69.174   10.216   75.403   13.995   62.066   14.949   59.227   5.7289   53.293   6.8010 5.934055 8.892367 
1 1 1   22    2   36 f   82.166   3.3435  143.918   11.324  149.520   16.012  138.313   16.017   83.820   4.6315   80.512   4.8235 3.307930 6.687089 
1 1 1   22    2   37 o   29.476   6.4667   20.757   8.6814   21.057   12.276   20.458   12.279   29.666   9.1348   29.286   9.1558 0.3802319 12.93339 
1 1 1   22    2   38 o   36.541   6.8868   37.992   12.275   49.292   14.495   9.3348   23.083   46.424   7.5703   26.658   11.507 19.76549 13.77368 
1 1 1   22    2   39 o   30.591   8.4548   21.901   15.534   15.532   21.043   29.529   23.029   27.895   11.441   33.287   12.451 -5.392305 16.90956 
1 1 1   22    2   40 o   36.289   8.0853   31.587   17.045   68.678   24.475  -3.3434   23.752   49.333   12.117   23.246   10.709 26.08766 16.17069 
1 1 1   22    2   41 o   21.896   10.473 -16.2825   26.764   0.0000   0.0000 -16.2825   26.764  ?   ?    21.896   10.473      ?      ? 
1 1 1   22    3    0 o  325.827   3.9008  2195.64   74.086  2195.64   74.086  2195.64   74.086  325.827   5.5165  325.827   5.5165 0.000000 0.000000 
1 1 1   22    3    1 o  132.523   3.1272  363.117   17.093  361.569   24.146  364.673   24.200  132.239   4.4271  132.806   4.4180 -0.5670776 6.254458 
1 1 1   22    3    2 o  175.680   3.1159  638.081   22.576  632.190   31.744  644.111   32.115  174.861   4.4016  176.501   4.4115 -1.639938 6.231811 
1 1 1   22    3    3 o   60.506   4.2640   75.870   10.639   75.942   14.910   75.796   15.185   60.538   5.9716   60.474   6.0882 0.6392288E-01 8.528007 
1 1 1   22    3    4 o  181.828   3.1359  683.471   23.514  670.992   32.949  696.424   33.569  180.137   4.4348  183.519   4.4349 -3.381943 6.271845 
1 1 1   22    3    5 o  118.135   2.8554  287.416   13.616  283.457   17.483  293.519   21.708  117.132   3.6190  119.138   4.4178 -2.006721 5.710825 
1 1 1   22    3    6 o   85.126   2.5937  148.286   9.0330  139.114   11.904  160.736   13.869   82.059   3.5173   88.192   3.8128 -6.133095 5.187368 
1 1 1   22    3    7 o  164.375   2.3154  558.045   15.541  557.800   20.574  558.370   23.715  164.352   3.0351  164.399   3.4975 -0.4707336E-01 4.630805 
1 1 1   22    3    8 o  264.744   2.4607  1448.03   26.869  1446.20   37.947  1449.88   38.049  264.576   3.4774  264.912   3.4824 -0.3359375 4.921357 
1 1 1   22    3    9 o  322.191   2.7333  2145.57   36.321  2144.02   51.277  2147.14   51.456  322.075   3.8601  322.307   3.8708 -0.2322693 5.466589 
1 1 1   22    3   10 o  131.369   2.1611  356.302   11.708  363.151   16.729  349.727   16.391  132.606   3.0587  130.132   3.0539 2.473831 4.322225 
1 1 1   22    3   11 o   61.169   2.8320   77.359   7.1432   75.275   10.073   79.467   10.132   60.339   4.0474   61.999   3.9621 -1.660576 5.663927 
1 1 1   22    3   12 o  259.909   2.4472  1395.73   26.232  1401.86   37.324  1389.74   36.875  260.471   3.4743  259.347   3.4474 1.124542 4.894378 
1 1 1   22    3   13 o   86.490   2.4257  154.556   8.6513  154.175   12.106  154.952   12.368   86.383   3.3978   86.597   3.4629 -0.2142944 4.851429 
1 1 1   22    3   14 o  202.739   2.2668  849.106   18.954  849.284   26.780  848.928   26.831  202.761   3.2023  202.717   3.2090 0.4321289E-01 4.533519 
1 1 1   22    3   15 o   90.693   2.4009  169.963   8.9804  169.189   12.626  170.756   12.776   90.485   3.3832   90.902   3.4075 -0.4165878 4.801841 
1 1 1   22    3   16 o   66.301   2.7831   91.071   7.5877   82.783   10.712   99.418   10.750   63.260   4.1055   69.343   3.7586 -6.082855 5.566157 
1 1 1   22    3   17 o   43.422   5.8370   44.852   9.5775   56.279   12.122   25.864   15.625   52.082   5.6430   34.762   10.219 17.32034 11.67395 
1 1 1   22    3   18 o   37.282   6.7554   31.272   10.187   34.358   12.490   25.138   17.607   39.883   7.8722   34.682   10.980 5.201778 13.51082 
1 1 1   22    3   19 o   33.760   6.8016   24.298   9.8869   27.807   14.959   21.575   13.175   35.755   9.8358   31.764   9.3971 3.991304 13.60325 
1 1 1   22    3   20 o  101.667   3.2281  213.715   13.494  207.244   18.267  221.487   20.020   99.994   4.4292  103.340   4.6971 -3.346436 6.456103 
1 1 1   22    3   21 o  192.251   2.9604  764.014   23.117  777.641   36.110  754.552   30.091  193.619   4.5218  190.882   3.8221 2.736481 5.920775 
1 1 1   22    3   22 o   32.584   6.1563   23.165   8.4339   22.296   11.808   24.070   12.051   31.989   8.7134   33.180   8.6992 -1.191961 12.31256 
1 1 1   22    3   23 o   52.817   4.5505   57.780   9.7925   62.447   15.299   54.540   12.746   54.557   6.7988   51.077   6.0502 3.480213 9.101007 
1 1 1   22    3   24 o   85.248   3.8662  160.993   12.752  191.770   16.573  116.335   19.963   96.068   4.1827   74.427   6.5033 21.64055 7.732312 
1 1 1   22    3   25 o   72.130   3.6542  108.549   10.740  107.642   14.112  109.797   16.558   71.844   4.7624   72.416   5.5436 -0.5724716 7.308402 
1 1 1   22    3   26 o  114.913   3.2234  280.585   14.903  303.779   19.582  248.653   22.976  120.835   3.9291  108.992   5.1111 11.84335 6.446815 
1 1 1   22    3   27 o  157.851   3.0434  523.090   19.524  496.266   29.850  543.143   25.810  154.128   4.6957  161.575   3.8729 -7.447449 6.086782 
1 1 1   22    3   28 o   44.114   5.1082   43.950   8.6911   32.215   13.001   53.433   11.686   37.882   8.5265   50.346   5.6279 -12.46387 10.21639 
1 1 1   22    3   29 o   24.633   6.9720   3.7834   11.726   18.142   16.759  -9.9895   16.414   29.842   10.708   19.425   8.9311 10.41722 13.94392 
1 1 1   22    3   30 o   58.095   4.1404   71.564   9.9161   69.233   13.772   74.073   14.289   57.117   5.8463   59.074   5.8645 -1.957504 8.280800 
1 1 1   22    3   31 o  104.644   3.6095  237.122   14.599  211.510   24.707  250.861   18.096   99.745   6.0058  109.543   4.0053 -9.798302 7.218904 
1 1 1   22    3   32 o   43.737   5.2669   41.912   9.1930   51.368   13.588   33.931   12.484   48.795   6.7517   38.680   8.0856 10.11524 10.53386 
1 1 1   22    3   33 o   48.816   5.1857   54.007   9.8088   44.393   14.986   61.213   12.974   44.117   8.5448   53.514   5.8781 -9.397137 10.37136 
1 1 1   22    3   34 o   29.816   6.3864   20.546   8.6208   17.049   12.502   23.717   11.903   27.703   9.2862   31.930   8.7699 -4.227587 12.77285 
1 1 1   22    3   35 o   39.591   5.8282   35.902   9.1981   30.291   12.446   42.656   13.654   36.004   8.5148   43.179   7.9606 -7.174557 11.65642 
1 1 1   22    3   36 o   46.535   4.8500   47.982   9.2620   45.450   13.529   50.217   12.707   45.191   7.2583   47.879   6.4347 -2.688358 9.699906 
1 1 1   22    3   37 o   27.539   6.4243   17.718   8.4562   18.011   12.380   17.462   11.578   27.742   9.2402   27.336   8.9277 0.4062080 12.84855 
1 1 1   22    3   38 o   27.097   6.2260   16.918   10.920   30.702   12.278 -35.2343   23.884   35.609   8.4815   18.585   9.1168 17.02457 12.45196 
1 1 1   22    3   39 o   32.211   8.7604   25.202   16.438   16.409   21.620   37.247   25.305   28.286   11.599   36.136   13.132 -7.849363 17.52090 
1 1 1   22    3   40 o   30.732   9.0375   23.892   18.772   25.027   24.102   22.141   29.931   30.866   12.396   30.599   13.155 0.2673416 18.07506 
1 1 1   22    3   41 o   30.657   9.9272   18.108   24.651   31.478   52.433   14.314   27.930   33.319   15.541   27.994   12.356 5.325428 19.85433 
1 1 1   22    4    0 o  222.486   3.2815  1023.63   42.543  1023.63   42.543  1023.63   42.543  222.486   4.6407  222.486   4.6407 0.000000 0.000000 
1 1 1   22    4    1 o   71.036   3.8981  104.636   11.385   94.501   16.018  114.982   16.184   67.542   5.7499   74.529   5.2649 -6.987480 7.796219 
1 1 1   22    4    2 o  293.558   3.6843  1783.43   44.602  1764.90   62.416  1802.77   63.758  292.006   5.1825  295.110   5.2382 -3.104431 7.368660 
1 1 1   22    4    3 o   72.086   3.8772  107.484   11.474   93.916   15.900  122.229   16.574   67.331   5.7254   76.841   5.2297 -9.510414 7.754337 
1 1 1   22    4    4 o   13.931   4.7224 -15.2457   7.4565 -17.1994   9.5186 -12.1424   11.996   12.130   5.9083   15.731   7.3686 -3.600999 9.444805 
1 1 1   22    4    5 o   62.189   3.7392   80.343   9.3704   81.353   12.073   78.814   14.861   62.709   4.6678   61.668   5.8428 1.041264 7.478418 
1 1 1   22    4    6 o  223.127   2.4785  1029.12   22.587  1032.59   29.958  1024.54   34.384  223.592   3.2486  222.662   3.7441 0.9302979 4.956963 
1 1 1   22    4    7 o   93.740   2.4931  179.218   9.5358  166.688   12.443  197.049   14.844   89.829   3.3585   97.651   3.6855 -7.822121 4.986240 
1 1 1   22    4    8 o  307.222   2.8695  1948.11   35.889  1931.85   47.021  1970.81   55.546  305.748   3.7287  308.696   4.3627 -2.948456 5.739025 
1 1 1   22    4    9 o  149.992   2.1434  464.567   13.259  470.153   18.835  459.079   18.669  150.886   3.0265  149.098   3.0359 1.788193 4.286805 
1 1 1   22    4   10 o  220.369   2.2951  1002.95   20.858  1014.32   29.758  991.970   29.245  221.596   3.2559  219.143   3.2357 2.452713 4.590268 
1 1 1   22    4   11 f   19.456   5.1984   5.0391   5.8483   8.8565   8.5057   1.6163   8.0543   21.887   7.6499   17.025   7.0408 4.862411 10.39677 
1 1 1   22    4   12 o  141.281   2.1795  412.265   12.700  417.528   17.992  407.040   17.928  142.181   3.0682  140.382   3.0965 1.799026 4.359097 
1 1 1   22    4   13 o  217.836   2.3022  980.154   20.682  971.266   28.999  989.354   29.505  216.833   3.2426  218.839   3.2689 -2.006546 4.604368 
1 1 1   22    4   14 o  102.682   2.3097  217.779   9.7796  224.481   13.937  211.278   13.726  104.239   3.2417  101.124   3.2910 3.114731 4.619445 
1 1 1   22    4   15 o  176.347   2.3754  643.403   17.117  648.470   22.758  636.804   25.971  177.173   3.1144  175.521   3.5876 1.651138 4.750813 
1 1 1   22    4   16 o  156.593   2.7469  506.717   17.652  503.349   23.763  510.864   26.367  156.034   3.6924  157.152   4.0679 -1.118210 5.493790 
1 1 1   22    4   17 o   80.422   3.4860  135.101   11.466  121.912   16.770  146.680   15.713   76.676   5.3027   84.168   4.5264 -7.491562 6.971907 
1 1 1   22    4   18 o   79.214   3.2857  130.122   10.719  121.656   15.134  138.644   15.183   76.615   4.7894   81.813   4.4995 -5.198502 6.571422 
1 1 1   22    4   19 o  192.930   2.8557  772.824   22.632  741.454   33.121  800.304   30.999  189.207   4.2442  196.653   3.8219 -7.445511 5.711411 
1 1 1   22    4   20 o  247.905   2.8218  1274.51   28.609  1258.97   43.221  1286.63   38.168  246.487   4.2514  249.322   3.7117 -2.835358 5.643682 
1 1 1   22    4   21 o   60.593   3.9153   76.830   9.6897   72.839   14.534   80.023   13.001   59.126   5.9598   62.060   5.0792 -2.934151 7.830505 
1 1 1   22    4   22 o   90.849   3.3555  170.553   12.439  177.217   19.189  165.723   16.337   92.331   5.0390   89.367   4.4322 2.963730 6.710904 
1 1 1   22    4   23 o   92.977   3.3567  175.309   12.502  198.617   20.765  162.056   15.658   97.628   5.1569   88.326   4.2982 9.302254 6.713316 
1 1 1   22    4   24 o   96.566   2.9439  193.414   11.698  199.096   17.227  188.552   15.936   97.861   4.2682   95.272   4.0556 2.589294 5.887725 
1 1 1   22    4   25 o   37.981   6.5446   34.701   11.049   13.340   18.104   47.382   13.949   28.647   10.965   47.316   7.1476 -18.66995 13.08917 
1 1 1   22    4   26 o   59.776   3.8344   74.953   9.4528   74.840   13.290   75.069   13.448   59.735   5.3943   59.816   5.4509 -0.8102417E-01 7.668822 
1 1 1   22    4   27 o   65.631   3.5699   90.289   9.6407   83.045   13.609   97.587   13.659   62.947   5.2418   68.315   4.8479 -5.368355 7.139888 
1 1 1   22    4   28 o   47.099   4.7583   48.039   8.8249   36.617   12.228   60.455   12.749   40.709   7.5613   53.489   5.7787 -12.78040 9.516660 
1 1 1   22    4   29 o   32.747   7.3143   24.042   10.277   24.952   11.852   21.283   20.632   33.185   8.5916   32.308   11.840 0.8769112 14.62852 
1 1 1   22    4   30 o   37.773   5.4259   31.325   8.3077   41.565   12.196   22.460   11.347   44.054   6.7123   31.492   8.5268 12.56235 10.85177 
1 1 1   22    4   31 o   84.053   3.7941  145.141   12.449  162.417   21.896  136.890   15.133   87.354   6.0775   80.752   4.5436 6.601807 7.588158 
1 1 1   22    4   32 f   29.263   6.2105   19.383   8.2527   14.640   11.833   23.874   11.516   26.273   9.0318   32.253   8.5271 -5.979870 12.42108 
1 1 1   22    4   33 o   76.529   3.7261  124.297   11.605  124.970   17.933  123.812   15.221   76.526   5.6817   76.531   4.8222 -0.5332947E-02 7.452259 
1 1 1   22    4   34 o   77.212   3.5045  126.605   11.146  125.489   16.135  127.624   15.414   76.825   5.0922   77.599   4.8160 -0.7739105 7.008903 
1 1 1   22    4   35 o   51.875   4.7125   58.981   10.041   60.657   13.738   57.059   14.714   52.824   6.3056   50.927   7.0051 1.896248 9.425048 
1 1 1   22    4   36 o   82.237   3.4086  144.261   11.554  137.412   16.094  151.545   16.598   80.198   4.8656   84.276   4.7751 -4.077431 6.817296 
1 1 1   22    4   37 o   54.734   6.0556   74.166   11.836   81.891   14.446   58.388   20.646   61.347   5.7094   48.121   10.681 13.22584 12.11117 
1 1 1   22    4   38 f   38.355   7.1185   40.981   11.731   47.071   13.630   23.584   23.038   45.537   7.2572   31.173   12.248 14.36411 14.23700 
1 1 1   22    4   39 o   22.200   7.2985  -8.2532   16.049  -9.8148   21.621  -6.3366   23.952   21.330   9.9591   23.070   10.672 -1.739937 14.59706 
1 1 1   22    4   40 o   37.018   10.593   48.196   26.287   28.278   49.090   56.203   31.126   33.287   15.356   40.748   14.596 -7.461407 21.18628 
1 1 1   22    4   41 o   24.444   8.4639 -19.2134   22.961  -9.4538   48.963 -21.9645   25.996   28.187   13.653   20.701   10.008 7.486145 16.92783 
1 1 1   22    4   42 o   25.564   11.760   6.1533   28.510   0.0000   0.0000   6.1533   28.510  ?   ?    25.564   11.760      ?      ? 
1 1 1   22    5    0 o  445.108   4.7969  4101.82  124.475  4101.82  124.475  4101.82  124.475  445.108   6.7839  445.108   6.7839 0.000000 0.000000 
1 1 1   22    5    1 o  393.720   4.4023  3213.52   71.471  3248.02  102.425  3180.79   99.777  395.761   6.2749  391.678   6.1764 4.083344 8.804693 
1 1 1   22    5    2 o  124.217   2.8760  321.223   14.407  307.657   22.649  330.443   18.672  121.966   4.5023  126.469   3.5797 -4.503090 5.751953 
1 1 1   22    5    3 o   81.010   3.3128  132.660   10.770  123.234   13.538  148.913   17.777   77.202   4.2517   84.818   5.0817 -7.615829 6.625695 
1 1 1   22    5    4 o  160.717   2.8238  537.075   18.387  551.841   24.045  516.282   28.533  163.431   3.5672  158.003   4.3784 5.427765 5.647612 
1 1 1   22    5    5 f  108.512   2.4132  243.942   10.677  248.084   14.142  238.452   16.283  109.601   3.1285  107.423   3.6751 2.178299 4.826317 
1 1 1   22    5    6 o  249.226   2.5879  1281.81   26.283  1272.69   34.536  1294.36   40.514  248.211   3.3736  250.240   3.9253 -2.028900 5.175822 
1 1 1   22    5    7 o  223.177   2.4885  1026.73   22.619  1014.56   29.646  1043.68   34.990  221.629   3.2432  224.724   3.7751 -3.095215 4.976936 
1 1 1   22    5    8 o  401.663   3.3911  3338.19   55.575  3335.23   73.407  3342.17   85.067  401.556   4.4322  401.769   5.1336 -0.2129517 6.782201 
1 1 1   22    5    9 o  220.490   2.2927  1003.57   20.842  1026.30   29.988  982.342   28.987  222.900   3.2619  218.079   3.2227 4.821167 4.585371 
1 1 1   22    5   10 o  157.059   2.1605  509.321   13.993  519.652   19.973  499.360   19.611  158.623   3.0529  155.495   3.0579 3.128204 4.320984 
1 1 1   22    5   11 o  105.489   2.4416  230.598   10.546  235.928   14.182  224.003   15.774  106.870   3.2174  104.108   3.6735 2.762596 4.883295 
1 1 1   22    5   12 o  147.623   2.1982  450.005   13.382  459.099   19.103  441.240   18.753  149.088   3.1066  146.159   3.1109 2.928833 4.396462 
1 1 1   22    5   13 o  105.710   2.4385  229.526   10.547  241.434   16.122  220.616   13.946  108.083   3.6165  103.338   3.2721 4.744293 4.877080 
1 1 1   22    5   14 o  174.354   2.5565  627.882   18.364  587.868   25.618  670.177   26.338  168.637   3.6832  180.071   3.5462 -11.43471 5.112908 
1 1 1   22    5   15 o   38.466   4.3163   31.483   6.5135   22.891   9.0328   40.789   9.4012   32.566   6.9374   44.367   5.1376 -11.80085 8.632653 
1 1 1   22    5   16 o  192.637   2.4708  769.673   19.467  745.190   29.237  789.170   26.091  189.844   3.7340  195.429   3.2370 -5.585449 4.941693 
1 1 1   22    5   17 o  182.824   2.8637  691.907   21.391  693.837   28.397  689.377   32.523  183.162   3.7590  182.488   4.3211 0.6740723 5.727331 
1 1 1   22    5   18 o   52.577   3.8776   58.463   8.0669   53.362   13.117   61.566   10.230   50.642   6.2800   54.511   4.5502 -3.868649 7.755185 
1 1 1   22    5   19 o  204.596   2.7598  871.190   22.942  837.772   35.267  895.706   30.206  201.104   4.2519  208.088   3.5195 -6.983810 5.519562 
1 1 1   22    5   20 o  153.099   2.5959  486.349   16.351  460.983   23.541  509.994   22.728  149.208   3.8253  156.990   3.5102 -7.781784 5.191784 
1 1 1   22    5   21 o   55.617   5.5904   68.213   10.706   61.124   20.811   70.764   12.484   52.888   9.9044   58.347   5.1878 -5.458614 11.18081 
1 1 1   22    5   22 o  169.973   2.8592  599.292   19.908  597.150   29.921  600.993   26.667  169.645   4.2763  170.301   3.7965 -0.6553192 5.718425 
1 1 1   22    5   23 o   43.513   4.7423   39.820   8.4932   40.643   11.719   38.909   12.327   44.016   6.4553   43.009   6.9489 1.006863 9.484596 
1 1 1   22    5   24 o   52.875   4.1975   59.237   9.0493   51.721   13.215   65.874   12.418   49.604   6.4591   56.147   5.3624 -6.542324 8.394905 
1 1 1   22    5   25 o   94.617   2.9508  186.172   11.492  203.156   16.517  170.239   15.998   98.820   4.0525   90.413   4.2902 8.407120 5.901552 
1 1 1   22    5   26 o  146.032   2.8531  444.545   16.912  447.004   22.082  441.057   26.301  146.648   3.6510  145.416   4.3853 1.231583 5.706143 
1 1 1   22    5   27 o  130.542   2.6619  354.491   14.331  351.991   20.326  356.963   20.209  130.077   3.7886  131.008   3.7401 -0.9300232 5.323701 
1 1 1   22    5   28 o   92.222   2.9479  177.607   11.191  193.228   16.073  162.908   15.591   96.189   4.0513   88.255   4.2832 7.933685 5.895713 
1 1 1   22    5   29 o   44.113   6.8456   51.502   11.134   59.596   12.865   27.352   22.223   53.005   5.8847   35.220   12.362 17.78489 13.69119 
1 1 1   22    5   30 o   76.288   3.3446  122.537   10.498  131.537   14.797  113.417   14.896   79.172   4.5315   73.403   4.9204 5.768738 6.689178 
1 1 1   22    5   31 o   36.160   7.0036   28.287   10.004   36.201   18.647   25.089   11.854   39.140   11.061   33.179   8.5938 5.961128 14.00715 
1 1 1   22    5   32 o   40.723   5.6327   38.759   9.0450   27.929   13.761   46.996   12.002   34.637   9.3950   46.810   6.2164 -12.17269 11.26541 
1 1 1   22    5   33 o   30.515   6.0466   21.680   8.3632   12.492   12.401   29.344   11.327   25.135   9.1839   35.895   7.8679 -10.75912 12.09329 
1 1 1   22    5   34 o  100.744   3.0194  214.382   12.504  195.100   17.709  233.553   17.659   96.114   4.4674  105.374   4.0631 -9.260597 6.038724 
1 1 1   22    5   35 o   49.564   4.5855   53.772   9.3484   56.685   13.032   50.685   13.418   51.074   6.1866   48.054   6.7700 3.020233 9.170949 
1 1 1   22    5   36 o   35.572   5.8162   29.783   8.9767   15.954   12.656   43.785   12.734   26.691   9.3312   44.452   6.9457 -17.76124 11.63247 
1 1 1   22    5   37 o   23.482   7.3306   1.1874   11.008  -1.6682   12.225   13.422   25.305   18.209   8.0990   28.755   12.221 -10.54547 14.66125 
1 1 1   22    5   38 o   35.568   7.6505   33.301   11.480   34.418   13.090   29.577   23.897   37.680   8.6111   33.457   12.648 4.222412 15.30092 
1 1 1   22    5   39 o   51.285   8.0858   69.840   16.616   64.301   22.395   76.624   24.785   49.109   11.293   53.461   11.576 -4.352562 16.17158 
1 1 1   22    5   40 o   46.687   10.917   83.391   26.010   68.066   53.362   88.166   29.788   39.303   17.222   54.071   13.420 -14.76846 21.83305 
1 1 1   22    5   41 o   31.454   9.7240   27.656   24.071   5.7759   49.428   34.459   27.561   29.660   14.199   33.247   13.290 -3.586191 19.44807 
1 1 1   22    5   42 o   29.895   12.925   26.031   29.224   0.0000   0.0000   26.031   29.224  ?   ?    29.895   12.925      ?      ? 
1 1 1   22    6    0 o   45.395   5.8445   46.666   13.956   46.666   13.956   46.666   13.956   45.395   8.2654   45.395   8.2654 0.000000 0.000000 
1 1 1   22    6    1 o  128.832   2.8839  345.761   14.978  330.028   23.547  356.454   19.412  126.315   4.5197  131.348   3.5832 -5.032967 5.767805 
1 1 1   22    6    2 o  234.312   2.7221  1134.38   26.302  1117.18   36.811  1152.33   37.596  232.499   3.8388  236.125   3.8604 -3.626114 5.444177 
1 1 1   22    6    3 o  165.887   2.5258  567.667   17.268  543.426   23.868  594.288   25.013  162.178   3.5683  169.597   3.5758 -7.419067 5.051641 
1 1 1   22    6    4 o   61.443   3.9230   79.732   9.5959   84.784   12.308   71.900   15.324   64.015   4.6616   58.871   6.3109 5.144016 7.845924 
1 1 1   22    6    5 o   71.005   2.8148  104.739   8.1346  107.657   10.756  100.839   12.434   72.181   3.6128   69.829   4.3174 2.352150 5.629530 
1 1 1   22    6    6 o  258.452   2.6351  1377.98   27.734  1365.33   36.361  1395.57   42.886  257.078   3.4293  259.827   4.0019 -2.748322 5.270217 
1 1 1   22    6    7 o  102.191   2.4326  214.143   10.155  204.862   13.345  226.913   15.653   99.589   3.2488  104.792   3.6216 -5.202438 4.865288 
1 1 1   22    6    8 o  202.819   2.5809  849.979   21.585  846.400   30.201  853.717   30.862  202.386   3.6181  203.251   3.6815 -0.8656158 5.161788 
1 1 1   22    6    9 o  140.805   2.4648  409.794   14.307  415.147   19.996  404.179   20.478  141.752   3.4201  139.857   3.5501 1.895096 4.929542 
1 1 1   22    6   10 o   83.189   2.4489  143.007   8.4012  141.680   11.940  144.308   11.823   82.805   3.4962   83.572   3.4300 -0.7675247 4.897746 
1 1 1   22    6   11 o  142.497   2.1557  419.355   12.669  421.274   18.033  417.485   17.802  142.818   3.0614  142.176   3.0357 0.6419525 4.311368 
1 1 1   22    6   12 o   49.045   3.3502   49.806   6.7415   56.717   9.6854   43.311   9.3893   52.356   4.4853   45.734   4.9777 6.621429 6.700365 
1 1 1   22    6   13 o  196.266   2.2461  795.699   18.181  801.986   25.862  789.556   25.565  197.031   3.1824  195.500   3.1706 1.531570 4.492241 
1 1 1   22    6   14 o  115.055   2.2298  273.339   10.578  264.948   14.780  282.152   15.147  113.245   3.1643  116.865   3.1424 -3.620331 4.459578 
1 1 1   22    6   15 o  171.035   2.2108  603.507   15.584  581.501   21.548  627.640   22.565  167.771   3.1140  174.298   3.1390 -6.526382 4.421545 
1 1 1   22    6   16 o  123.602   2.5382  314.340   12.786  325.386   19.807  306.448   16.742  125.433   3.8287  121.770   3.3334 3.662819 5.076474 
1 1 1   22    6   17 o   90.467   3.5270  165.536   12.865  188.996   20.993  151.427   16.281   95.440   5.3331   85.494   4.6171 9.945602 7.054080 
1 1 1   22    6   18 o  164.168   2.5586  558.066   17.276  549.772   25.297  565.315   23.650  163.004   3.7627  165.333   3.4682 -2.329651 5.117267 
1 1 1   22    6   19 o  164.364   2.7767  562.971   18.458  540.044   28.779  578.993   24.058  161.433   4.3223  167.294   3.4867 -5.861862 5.553341 
1 1 1   22    6   20 o   78.836   3.2181  129.530   10.344  105.875   14.472  154.236   14.790   71.404   4.9141   86.267   4.1567 -14.86324 6.436296 
1 1 1   22    6   21 o  102.139   3.0490  214.424   12.666  227.660   19.862  205.351   16.444  104.733   4.5981   99.546   4.0052 5.186859 6.097901 
1 1 1   22    6   22 o   14.349   4.8472 -14.7444   7.9835 -20.4643   12.767 -11.0713   10.231   14.442   6.9895   14.257   6.7177 0.1856470 9.694340 
1 1 1   22    6   23 o  140.785   2.5612  411.096   14.869  406.850   21.144  415.251   20.915  140.057   3.6602  141.512   3.5835 -1.455414 5.122355 
1 1 1   22    6   24 o   67.451   3.4689   94.989   9.6413   90.465   13.658   99.483   13.612   65.829   5.0304   69.074   4.7779 -3.244080 6.937829 
1 1 1   22    6   25 o   99.434   2.8765  205.977   11.780  193.407   16.658  218.552   16.661   96.368   4.1909  102.499   3.9412 -6.131271 5.752984 
1 1 1   22    6   26 o   93.428   3.1930  180.624   12.153  172.735   15.841  191.909   18.946   91.041   4.2186   95.815   4.7942 -4.773773 6.386014 
1 1 1   22    6   27 o   92.534   3.0466  178.433   11.613  166.409   16.109  191.443   16.756   89.276   4.3749   95.792   4.2411 -6.515633 6.093211 
1 1 1   22    6   28 o   28.882   6.2763   18.489   8.2494   20.762   11.416   16.004   11.934   30.392   8.6776   27.371   9.0702 3.021784 12.55260 
1 1 1   22    6   29 o   59.643   5.6333   80.749   11.438   83.676   13.295   72.407   22.445   63.011   5.1155   56.274   10.038 6.736744 11.26663 
1 1 1   22    6   30 o   89.233   3.0986  166.631   11.391  172.112   16.597  161.751   15.662   90.598   4.4417   87.868   4.3216 2.730347 6.197121 
1 1 1   22    6   31 o   28.144   7.0021   10.725   9.1303   30.758   19.022   4.7275   10.408   36.178   11.409   20.110   8.1212 16.06800 14.00412 
1 1 1   22    6   32 o   45.623   5.3817   45.883   9.7963   47.234   15.035   44.887   12.914   45.693   8.2831   45.554   6.8732 0.1394157 10.76338 
1 1 1   22    6   33 o  104.066   3.6255  229.596   15.263  227.513   19.726  232.703   24.094  103.773   4.6088  104.359   5.5978 -0.5860443 7.250974 
1 1 1   22    6   34 o   66.792   3.8224   96.584   10.349   78.309   14.850  113.846   14.432   60.308   5.9699   73.275   4.7753 -12.96664 7.644838 
1 1 1   22    6   35 o   30.066   6.2242   21.366   8.2482   19.122   11.924   23.424   11.422   28.628   9.0334   31.505   8.5649 -2.877178 12.44832 
1 1 1   22    6   36 o   57.244   4.4416   71.406   10.445   67.845   14.044   75.813   15.627   55.746   6.1082   58.742   6.4498 -2.995998 8.883181 
1 1 1   22    6   37 o   44.093   7.0627   59.252   11.939   68.567   13.473   25.195   25.762   55.942   5.8392   32.244   12.862 23.69732 14.12537 
1 1 1   22    6   38 o   29.957   6.9730   24.060   11.152   31.280   12.534  -3.3651   24.430   35.887   8.5837   24.027   10.991 11.85909 13.94594 
1 1 1   22    6   39 f   36.686   8.9511   37.647   16.412   29.156   21.511   49.472   25.386   32.730   12.075   40.643   13.217 -7.913040 17.90223 
1 1 1   22    6   40 o   30.432   9.1755   21.057   21.358   2.2092   32.012   36.177   28.673   26.625   12.324   34.240   13.597 -7.614782 18.35103 
1 1 1   22    6   41 o   40.543   10.346   67.182   26.717   21.172   53.536   82.440   30.830   31.426   14.971   49.661   14.286 -18.23573 20.69280 
1 1 1   22    6   42 o   20.939   10.170 -20.9367   27.660   0.0000   0.0000 -20.9367   27.660  ?   ?    20.939   10.170      ?      ? 
1 1 1   22    7    0 o   71.620   3.2382  107.237   13.401  107.237   13.401  107.237   13.401   71.620   4.5796   71.620   4.5796 0.000000 0.000000 
1 1 1   22    7    1 f  215.910   2.6526  962.982   23.615  947.760   32.913  979.131   33.902  214.155   3.7263  217.664   3.7763 -3.509293 5.305266 
1 1 1   22    7    2 o  172.388   2.8386  610.385   19.676  597.114   25.039  631.808   31.815  169.998   3.5712  174.779   4.4134 -4.780579 5.677259 
1 1 1   22    7    3 o  146.221   2.5138  441.673   15.158  451.670   21.591  431.958   21.286  147.854   3.5407  144.589   3.5694 3.264542 5.027640 
1 1 1   22    7    4 o  140.261   2.6178  402.412   14.278  418.872   24.964  394.410   17.406  142.325   4.2527  138.198   3.0537 4.127136 5.235538 
1 1 1   22    7    5 o  119.876   2.3543  295.646   11.511  289.079   15.112  304.720   17.765  118.311   3.0969  121.442   3.5469 -3.130974 4.708637 
1 1 1   22    7    6 o   82.261   2.6182  140.217   8.7745  142.353   11.589  137.349   13.432   83.011   3.3850   81.511   3.9953 1.499954 5.236479 
1 1 1   22    7    7 o   45.557   3.9189   44.696   7.0752   52.633   9.4028   34.336   10.742   50.439   4.5198   40.675   6.4033 9.764893 7.837796 
1 1 1   22    7    8 o  110.468   2.4036  250.930   10.844  243.991   14.280  260.386   16.669  108.685   3.1855  112.252   3.6003 -3.566978 4.807269 
1 1 1   22    7    9 f   60.408   3.1153   74.503   7.6782   69.215   10.017   82.038   11.957   57.851   4.1980   62.964   4.6041 -5.113026 6.230639 
1 1 1   22    7   10 o  175.605   2.1880  636.842   15.846  644.130   22.570  629.757   22.252  176.595   3.0988  174.614   3.0898 1.980515 4.375958 
1 1 1   22    7   11 o   75.566   2.5781  118.045   8.0296  112.659   11.320  123.498   11.392   73.828   3.7176   77.304   3.5729 -3.476830 5.156123 
1 1 1   22    7   12 o  100.433   2.5084  207.578   10.293  214.729   15.783  202.285   13.578  101.919   3.7547   98.947   3.3272 2.971558 5.016741 
1 1 1   22    7   13 f   43.694   3.9866   38.293   7.0652   48.391   11.232   31.682   9.0883   48.304   5.6380   39.085   5.6378 9.218998 7.973233 
1 1 1   22    7   14 o  104.849   2.5192  225.727   10.694  219.639   13.774  234.965   16.967  103.102   3.2391  106.595   3.8593 -3.493340 5.038476 
1 1 1   22    7   15 o   54.227   3.5508   60.915   7.7204   61.005   12.478   60.859   9.8271   54.229   5.5789   54.225   4.3940 0.4566193E-02 7.101500 
1 1 1   22    7   16 o  172.350   2.6747  614.725   18.998  642.127   26.852  587.258   26.884  176.210   3.6947  168.490   3.8686 7.719376 5.349473 
1 1 1   22    7   17 o   42.505   4.8899   37.980   8.2495   48.061   12.217   29.532   11.184   48.068   6.1625   36.943   7.5939 11.12528 9.779761 
1 1 1   22    7   18 o  181.485   2.4082  681.273   17.570  680.792   28.185  681.578   22.471  181.374   3.7677  181.595   3.0002 -0.2215576 4.816332 
1 1 1   22    7   19 o  119.000   3.0024  295.623   14.298  284.384   22.978  302.724   18.264  117.065   4.7590  120.935   3.6617 -3.869408 6.004714 
1 1 1   22    7   20 o  161.368   2.7903  540.841   18.155  532.772   28.774  546.177   23.401  160.286   4.3525  162.450   3.4926 -2.164505 5.580578 
1 1 1   22    7   21 o  170.969   3.7808  605.614   26.660   0.0000   0.0000  605.614   26.660  ?   ?   170.969   3.7808      ?      ? 
1 1 1   22    7   22 o  123.751   2.8883  318.961   14.677  305.019   21.505  331.117   20.081  121.166   4.3033  126.336   3.8538 -5.169899 5.776650 
1 1 1   22    7   23 o   35.275   5.6592   27.443   8.1301   20.304   11.366   34.924   11.634   30.458   8.6453   40.092   7.3052 -9.633924 11.31845 
1 1 1   22    7   24 o  139.683   2.7383  405.325   15.773  395.063   22.068  416.043   22.552  137.874   3.8807  141.492   3.8645 -3.618118 5.476666 
1 1 1   22    7   25 o   23.456   5.9934   9.1868   7.7467   15.253   11.098   3.4210   10.819   26.902   8.7384   20.010   8.2052 6.891142 11.98687 
1 1 1   22    7   26 o   71.284   3.7315  105.992   10.785  103.706   13.959  109.378   16.988   70.434   4.8053   72.134   5.7101 -1.700233 7.463016 
1 1 1   22    7   27 o   90.086   2.9482  169.399   10.941  180.946   15.646  158.349   15.305   93.114   4.0741   87.057   4.2626 6.056808 5.896435 
1 1 1   22    7   28 o   53.255   5.5533   56.186   10.771   50.833   12.349   73.199   22.016   48.909   6.1220   57.601   9.2672 -8.691582 11.10668 
1 1 1   22    7   29 o   89.288   3.0665  166.918   11.281  156.348   15.737  178.088   16.178   86.357   4.4185   92.220   4.2534 -5.863739 6.133062 
1 1 1   22    7   30 o   15.714   5.0993  -7.7824   7.5642  -2.7796   11.182 -12.0037   10.271   17.542   7.7765   13.886   6.5984 3.656130 10.19867 
1 1 1   22    7   31 o   57.959   5.1803   72.926   10.833   73.155   21.151   72.844   12.613   57.285   8.9520   58.633   5.2156 -1.347843 10.36059 
1 1 1   22    7   32 o   18.663   5.6282  -1.1688   8.2038 -11.3057   12.336   6.8700   10.985   15.823   7.4309   21.503   8.4550 -5.680050 11.25631 
1 1 1   22    7   33 o   39.308   5.6942   36.945   8.9540   23.803   13.584   47.043   11.907   31.898   9.5659   46.718   6.1796 -14.81944 11.38831 
1 1 1   22    7   34 o   65.631   3.7118   92.026   10.041   95.837   14.198   88.213   14.201   67.039   5.1348   64.222   5.3614 2.816978 7.423665 
1 1 1   22    7   35 o   40.549   5.5107   37.870   8.9674   32.724   13.013   42.525   12.375   37.187   8.6477   43.911   6.8330 -6.724400 11.02145 
1 1 1   22    7   36 f   30.999   7.1684   25.742   11.639   32.863   12.675 -12.5622   29.397   37.224   8.4490   24.775   11.583 12.44840 14.33683 
1 1 1   22    7   37 o   34.008   7.9568   23.109   11.049   16.640   12.367   48.701   24.598   26.661   9.2296   41.356   12.964 -14.69489 15.91356 
1 1 1   22    7   38 o   41.965   6.8835   52.805   11.944   63.570   13.838   21.362   23.651   53.515   6.2697   30.415   12.257 23.09938 13.76708 
1 1 1   22    7   39 o   39.655   8.2168   43.216   13.124   42.725   14.887   44.927   27.806   41.413   8.9748   37.898   13.766 3.514717 16.43353 
1 1 1   22    7   40 o   37.472   9.9402   46.212   21.789   29.762   31.503   61.298   30.169   32.315   13.680   42.628   14.425 -10.31306 19.88041 
1 1 1   22    7   41 o   31.385   9.9769   26.506   23.596   42.578   51.680   22.273   26.521   33.583   15.585   29.186   12.461 4.397499 19.95374 
1 1 1   22    7   42 o   39.619   13.998   57.613   28.534   0.0000   0.0000   57.613   28.534  ?   ?    39.619   13.998      ?      ? 
1 1 1   22    8    0 o   56.653   4.3981   68.732   14.087   68.732   14.087   68.732   14.087   56.653   6.2199   56.653   6.2199 0.000000 0.000000 
1 1 1   22    8    1 o  270.646   2.8770  1514.09   32.111  1497.12   44.999  1531.70   45.836  269.103   4.0543  272.189   4.0830 -3.085571 5.753960 
1 1 1   22    8    2 o   82.430   2.7028  141.606   9.0594  132.652   13.775  148.431   12.026   80.097   4.1697   84.762   3.4400 -4.665527 5.405595 
1 1 1   22    8    3 o   62.051   3.1432   77.552   7.9362   96.639   12.395   64.289   10.332   68.355   4.3964   55.748   4.4935 12.60633 6.286483 
1 1 1   22    8    4 o  181.969   2.3813  680.780   17.610  702.775   27.546  665.579   22.901  184.417   3.6216  179.520   3.0930 4.897766 4.762595 
1 1 1   22    8    5 o   73.139   2.6176  110.328   7.8764   99.795   10.896  121.854   11.398   69.486   3.8020   76.792   3.5989 -7.305664 5.235188 
1 1 1   22    8    6 f  207.361   2.4364  887.683   20.603  883.678   27.147  893.123   31.639  206.839   3.1822  207.884   3.6901 -1.045074 4.872732 
1 1 1   22    8    7 o  141.504   2.3344  411.721   13.465  401.511   17.639  425.978   20.844  139.429   3.0673  143.580   3.5199 -4.150894 4.668851 
1 1 1   22    8    8 o  179.060   3.0406  662.458   22.443  639.334   31.131  687.483   32.384  175.811   4.2932  182.309   4.3069 -6.498367 6.081141 
1 1 1   22    8    9 o   95.984   2.9404  190.259   10.765  189.818   12.952  191.243   19.360   95.856   3.2761   96.112   4.8839 -0.2560349 5.880895 
1 1 1   22    8   10 o  133.467   2.3986  367.653   12.992  365.820   16.908  370.295   20.302  133.083   3.0804  133.850   3.6775 -0.7668152 4.797200 
1 1 1   22    8   11 o  109.526   2.2380  247.817   10.109  248.769   14.251  246.851   14.343  109.739   3.1486  109.313   3.1813 0.4257736 4.475961 
1 1 1   22    8   12 o  143.066   2.1714  422.653   12.810  412.102   17.932  433.648   18.306  141.243   3.0782  144.889   3.0634 -3.646484 4.342733 
1 1 1   22    8   13 o  170.643   2.3994  605.446   16.748  568.092   24.878  636.404   22.648  165.773   3.6386  175.513   3.1287 -9.739624 4.798767 
1 1 1   22    8   14 o  238.197   2.3755  1172.44   23.336  1164.26   32.776  1180.86   33.234  237.355   3.3480  239.038   3.3710 -1.682983 4.751072 
1 1 1   22    8   15 o  108.443   2.5614  240.663   11.334  259.657   17.598  227.200   14.816  112.046   3.8081  104.839   3.4265 7.207397 5.122729 
1 1 1   22    8   16 o   21.959   5.6823   5.9728   7.3296   14.615   10.521  -2.1765   10.217   26.655   8.4934   17.264   7.5508 9.391117 11.36454 
1 1 1   22    8   17 o   82.442   3.0054  142.502   10.084  119.205   14.536  164.111   14.000   75.832   4.6477   89.052   3.8117 -13.21949 6.010782 
1 1 1   22    8   18 f  152.570   2.3809  483.202   14.663  472.911   23.127  490.118   18.961  151.158   3.7096  153.982   2.9855 -2.823990 4.761745 
1 1 1   22    8   19 o  166.234   2.7746  574.964   18.659  558.835   29.176  586.127   24.273  164.176   4.3087  168.291   3.4970 -4.114822 5.549179 
1 1 1   22    8   20 o  191.997   2.7785  769.100   21.617  733.492   33.440  794.664   28.334  188.060   4.3112  195.933   3.5062 -7.872742 5.556944 
1 1 1   22    8   21 o  122.538   2.9793  312.341   14.894  307.084   22.696  316.317   19.740  121.569   4.5265  123.507   3.8751 -1.937912 5.958625 
1 1 1   22    8   22 o  145.460   2.7322  440.858   16.272  423.213   24.248  455.312   21.947  142.739   4.1188  148.182   3.5909 -5.442230 5.464369 
1 1 1   22    8   23 o   84.447   3.0067  148.339   10.472  146.480   14.771  150.217   14.848   83.913   4.2681   84.982   4.2361 -1.069199 6.013382 
1 1 1   22    8   24 o   89.841   2.9365  168.384   10.857  157.480   15.483  178.934   15.228   86.939   4.3178   92.743   3.9811 -5.803932 5.873057 
1 1 1   22    8   25 o   76.307   3.2726  121.949   10.250  117.641   15.094  125.637   13.965   74.999   4.8795   77.615   4.3624 -2.615829 6.545236 
1 1 1   22    8   26 o   92.630   2.9327  178.886   11.202  181.201   15.743  176.511   15.942   93.250   4.0933   92.010   4.2010 1.240166 5.865394 
1 1 1   22    8   27 o   94.290   3.1877  186.583   12.212  188.143   15.999  184.405   18.904   94.895   4.0877   93.685   4.8924 1.209778 6.375340 
1 1 1   22    8   28 o   65.410   4.9573   91.066   11.981   90.125   14.096   93.516   22.739   65.373   5.2279   65.446   8.4241 -0.7323456E-01 9.914507 
1 1 1   22    8   29 o   95.498   2.9437  190.972   11.585  182.857   16.411  199.033   16.357   93.442   4.2583   97.554   4.0654 -4.111427 5.887300 
1 1 1   22    8   30 o   25.253   5.6427   11.001   7.6583   24.476   11.168  -0.9594   10.522   32.843   8.2543   17.663   7.6958 15.17966 11.28533 
1 1 1   22    8   31 o   32.005   6.3065   24.580   9.0140   14.543   14.461   30.957   11.527   27.023   9.9108   36.988   7.8017 -9.964983 12.61308 
1 1 1   22    8   32 o   32.077   6.2340   23.963   8.5948   19.733   12.573   27.672   11.776   29.459   9.2738   34.695   8.3336 -5.236162 12.46803 
1 1 1   22    8   33 o   26.959   6.3072   16.210   8.1863   13.997   12.485   17.879   10.843   25.910   9.2482   28.008   8.5786 -2.098698 12.61434 
1 1 1   22    8   34 o   63.186   3.8291   85.677   9.9647   91.475   14.182   80.023   14.004   65.367   5.2605   61.004   5.5657 4.362186 7.658275 
1 1 1   22    8   35 o   36.915   6.0706   32.502   9.0833   28.912   13.256   35.679   12.471   34.659   9.1418   39.171   7.9899 -4.511856 12.14128 
1 1 1   22    8   36 o   34.550   7.9288   24.289   11.099   18.336   12.485   46.716   24.234   27.899   9.2788   41.201   12.860 -13.30182 15.85765 
1 1 1   22    8   37 o   48.108   7.4087   61.114   12.700   63.678   14.588   53.093   25.805   53.371   6.6273   42.846   13.253 10.52557 14.81748 
1 1 1   22    8   38 o   22.986   6.9554   6.5693   10.911   9.5043   12.422  -3.3434   22.828   22.730   8.9738   23.241   10.629 -0.5110874 13.91085 
1 1 1   22    8   39 o   24.954   7.4535   10.454   13.314   17.002   15.110 -12.2860   28.157   26.710   10.067   23.197   10.995 3.512970 14.90709 
1 1 1   22    8   40 o   29.749   9.1840   19.960   21.395   27.440   30.619   12.825   29.907   31.495   13.416   28.004   12.546 3.490755 18.36803 
1 1 1   22    8   41 o   33.155   10.529   20.617   25.244   98.282   52.475  -2.7690   28.795   42.196   17.748   24.114   11.334 18.08236 21.05849 
1 1 1   22    8   42 o   27.946   9.4701 -11.7465   24.588   71.884   50.489 -37.7478   28.152   36.746   16.393   19.146   9.4868 17.59934 18.94022 
1 1 1   22    9    0 o   40.568   5.2242   37.249   11.148   37.249   11.148   37.249   11.148   40.568   7.3882   40.568   7.3882 0.000000 0.000000 
1 1 1   22    9    1 o  130.455   2.3464  352.220   12.482  347.077   19.071  356.073   16.510  129.603   3.5678  131.307   3.0485 -1.704056 4.692801 
1 1 1   22    9    2 o  266.670   2.6767  1466.46   29.041  1489.96   45.088  1449.80   37.965  268.445   4.0723  264.896   3.4749 3.549194 5.353372 
1 1 1   22    9    3 o  118.971   2.6839  293.702   12.440  289.036   21.372  296.093   15.299  118.209   4.3837  119.734   3.0980 -1.525230 5.367862 
1 1 1   22    9    4 o  134.349   2.6359  368.960   13.765  385.193   24.103  361.102   16.769  136.470   4.2822  132.227   3.0749 4.243149 5.271824 
1 1 1   22    9    5 o  329.311   3.4082  2235.00   43.228  2217.65   52.377  2272.07   76.557  327.532   3.8772  331.091   5.6063 -3.558777 6.816368 
1 1 1   22    9    6 o  265.587   3.0537  1453.55   31.244  1443.78   37.872  1474.37   55.285  264.337   3.4737  266.837   5.0234 -2.500488 6.107483 
1 1 1   22    9    7 o  293.584   3.0026  1782.18   36.348  1804.77   52.113  1760.78   50.724  295.389   4.2774  291.779   4.2149 3.610046 6.005165 
1 1 1   22    9    8 o  140.544   2.5189  407.937   14.594  390.208   20.385  426.579   20.903  137.410   3.5969  143.677   3.5274 -6.267273 5.037884 
1 1 1   22    9    9 o  105.340   2.4515  228.876   10.543  226.404   13.918  232.204   16.151  104.688   3.2234  105.992   3.6946 -1.303574 4.903080 
1 1 1   22    9   10 o   37.804   4.6779   31.696   6.8520   39.317   9.2090   22.244   10.256   43.565   5.1252   32.043   7.8272 11.52213 9.355901 
1 1 1   22    9   11 o  232.731   2.3531  1118.72   22.580  1100.92   31.464  1137.63   32.424  230.826   3.3050  234.636   3.3505 -3.809799 4.706258 
1 1 1   22    9   12 o  185.714   2.2167  712.248   16.974  701.285   23.651  723.893   24.375  184.244   3.1123  187.185   3.1572 -2.941513 4.433370 
1 1 1   22    9   13 o  151.509   2.1839  473.696   13.639  457.848   18.905  490.897   19.697  148.870   3.0790  154.147   3.0981 -5.277664 4.367868 
1 1 1   22    9   14 o   62.700   3.5538   81.346   9.0890   98.607   13.244   65.976   12.497   69.000   4.6536   56.400   5.3722 12.60016 7.107504 
1 1 1   22    9   15 o   77.456   2.9184  124.373   9.2151  122.899   14.105  125.471   12.172   77.032   4.4396   77.879   3.7893 -0.8471985 5.836874 
1 1 1   22    9   16 o  151.403   2.8676  477.838   17.712  500.320   23.714  449.474   26.636  155.508   3.6973  147.298   4.3843 8.210312 5.735216 
1 1 1   22    9   17 o  165.168   2.3816  563.494   15.814  567.539   25.419  560.941   20.199  165.598   3.7217  164.738   2.9728 0.8589783 4.763286 
1 1 1   22    9   18 o   83.757   2.8189  145.919   9.4076  142.984   15.361  147.680   11.901   83.030   4.4855   84.484   3.4153 -1.453484 5.637742 
1 1 1   22    9   19 o   73.776   3.7464  110.489   11.045  123.861   18.435  103.002   13.794   77.115   5.7962   70.437   4.7482 6.677597 7.492797 
1 1 1   22    9   20 o   83.121   4.5608  141.608   12.948  149.747   27.923  139.378   14.615   84.292   8.0316   81.950   4.3239 2.341988 9.121572 
1 1 1   22    9   21 o   42.858   5.2646   40.608   8.7409   23.454   12.175   58.856   12.557   32.652   8.8287   53.064   5.7374 -20.41271 10.52917 
1 1 1   22    9   22 o   98.549   3.0252  202.117   12.184  200.662   18.484  203.235   16.202   98.179   4.5646   98.919   3.9713 -0.7401352 6.050384 
1 1 1   22    9   23 o   62.302   3.6032   81.146   9.2561   83.450   13.087   78.840   13.093   63.200   5.0206   61.405   5.1698 1.794243 7.206491 
1 1 1   22    9   24 o  102.581   2.8163  218.913   11.913  225.358   17.054  212.772   16.647  104.057   3.9737  101.105   3.9920 2.951714 5.632629 
1 1 1   22    9   25 o   28.327   6.1530   16.916   8.0461   22.712   11.770   11.832   11.024   31.943   8.6991   24.711   8.7042 7.232243 12.30603 
1 1 1   22    9   26 o   52.935   4.2514   60.123   8.9947   42.997   12.585   78.010   12.861   44.931   6.7909   60.940   5.1169 -16.00932 8.502893 
1 1 1   22    9   27 o   25.630   5.8119   10.927   8.7447   25.759   11.639  -8.2947   13.250   33.755   8.3953   17.504   8.0394 16.25080 11.62383 
1 1 1   22    9   28 o   23.551   6.6714   7.5669   9.4268   8.7600   11.382   4.9618   16.820   22.890   8.7107   24.213   10.107 -1.322802 13.34278 
1 1 1   22    9   29 o  124.862   2.7488  325.663   14.153  324.851   20.209  326.445   19.827  124.692   3.9296  125.032   3.8447 -0.3403625 5.497641 
1 1 1   22    9   30 o   20.931   5.9673   4.6610   8.0261   9.0349   11.819   0.9184   10.933   23.144   8.8598   18.719   7.9963 4.425028 11.93469 
1 1 1   22    9   31 o   82.879   3.6038  144.766   12.166  149.947   18.872  141.081   15.915   83.987   5.4480   81.772   4.7189 2.214836 7.207521 
1 1 1   22    9   32 o   33.516   6.8176   28.164   9.7667   16.842   19.526   31.942   11.279   29.463   11.360   37.569   7.5412 -8.105610 13.63530 
1 1 1   22    9   33 o   85.239   3.1634  153.343   11.105  157.366   16.221  149.793   15.236   86.250   4.5598   84.228   4.3859 2.021530 6.326789 
1 1 1   22    9   34 o   64.985   3.7730   90.662   10.098   91.134   14.696   90.240   13.898   65.077   5.4754   64.893   5.1926 0.1839600 7.546011 
1 1 1   22    9   35 o   24.993   6.3845   13.295   8.3856   13.477   12.811   13.159   11.092   25.326   9.3221   24.661   8.7262 0.6647320 12.76905 
1 1 1   22    9   36 o   28.476   7.6039   15.798   10.925   11.828   12.644   27.492   21.700   24.157   9.1837   32.796   12.122 -8.639685 15.20786 
1 1 1   22    9   37 o   29.488   9.0653   13.699   12.921   12.931   13.439   23.080   46.983   24.861   9.4640   34.115   15.465 -9.253981 18.13061 
1 1 1   22    9   38 o   32.440   7.4602   29.447   11.948   34.591   13.602   12.079   24.993   37.314   8.9529   27.566   11.936 9.747639 14.92042 
1 1 1   22    9   39 o   23.515   7.2989   6.6765   12.328   9.5689   13.813  -4.6440   27.328   22.930   9.3218   24.101   11.234 -1.170872 14.59777 
1 1 1   22    9   40 o   38.248   10.064   51.141   21.330   47.118   30.856   54.823   29.519   36.749   14.249   39.747   14.217 -2.997215 20.12895 
1 1 1   22    9   41 o   21.110   7.4879 -40.0563   23.282 -69.0794   51.123 -32.4622   26.151   23.192   11.679   19.028   9.3746 4.164333 14.97580 
1 1 1   22   10    0 o  202.476   3.2305  848.156   38.109  848.156   38.109  848.156   38.109  202.476   4.5687  202.476   4.5687 0.000000 0.000000 
1 1 1   22   10    1 o  158.863   2.7804  522.093   17.906  523.601   23.288  519.913   28.004  159.181   3.5471  158.545   4.2825 0.6353455 5.560739 
1 1 1   22   10    2 o  143.119   2.3420  421.587   13.667  433.351   21.105  413.091   17.935  144.815   3.5335  141.424   3.0748 3.391037 4.684001 
1 1 1   22   10    3 o  131.202   2.3353  355.278   12.475  357.762   19.276  353.487   16.364  131.578   3.5520  130.826   3.0327 0.7520599 4.670579 
1 1 1   22   10    4 o   74.187   2.5281  113.749   7.7343  111.681   10.950  115.807   10.926   73.512   3.6116   74.861   3.5385 -1.349014 5.056182 
1 1 1   22   10    5 o  216.630   2.2786  969.168   20.355  956.260   28.470  982.667   29.115  215.156   3.2083  218.104   3.2366 -2.947266 4.557219 
1 1 1   22   10    6 o  173.632   2.1810  622.686   15.618  622.307   21.963  623.075   22.213  173.579   3.0678  173.684   3.1009 -0.1041870 4.362028 
1 1 1   22   10    7 o   58.451   3.1811   71.683   7.5116   76.495   9.8879   65.118   11.551   60.826   3.9414   56.077   4.9943 4.749084 6.362187 
1 1 1   22   10    8 o  174.669   2.3783  630.965   16.933  634.262   22.339  626.512   25.963  175.232   3.0909  174.106   3.6155 1.126099 4.756614 
1 1 1   22   10    9 o   31.838   4.8150   23.308   6.5419   35.712   8.8272   8.1948   9.7438   41.517   5.1551   22.159   8.1340 19.35802 9.629946 
1 1 1   22   10   10 o  141.721   2.3655  415.157   13.665  415.824   18.009  414.253   20.979  141.878   3.0775  141.565   3.5931 0.3124084 4.730911 
1 1 1   22   10   11 o  147.100   2.3458  446.479   14.055  442.992   18.445  451.309   21.705  146.439   3.0539  147.762   3.5615 -1.322647 4.691533 
1 1 1   22   10   12 o  101.602   2.3051  213.311   9.6597  213.042   13.634  213.582   13.688  101.538   3.2555  101.666   3.2644 -0.1281662 4.610270 
1 1 1   22   10   13 o  142.086   2.5215  418.056   14.750  391.656   20.961  443.952   20.760  137.623   3.6927  146.550   3.4345 -8.927246 5.043054 
1 1 1   22   10   14 o  188.799   2.4760  739.127   19.197  711.553   28.180  763.005   26.224  185.477   3.6837  192.121   3.3094 -6.643814 4.951966 
1 1 1   22   10   15 o   64.461   3.3127   87.049   8.6656   80.325   13.201   92.141   11.487   62.216   5.1443   66.706   4.1753 -4.490002 6.625426 
1 1 1   22   10   16 o  126.460   2.5915  331.049   13.459  329.591   19.954  332.266   18.230  126.184   3.8341  126.736   3.4875 -0.5520477 5.182954 
1 1 1   22   10   17 o   65.608   3.2134   89.866   8.3781   87.039   13.723   91.546   10.579   64.727   5.1403   66.489   3.8576 -1.761543 6.426761 
1 1 1   22   10   18 o  135.961   2.3844  380.399   13.047  391.935   21.018  373.165   16.642  137.582   3.7039  134.340   3.0036 3.242172 4.768720 
1 1 1   22   10   19 o   83.567   3.6344  147.830   11.909  136.517   19.822  154.219   14.897   80.901   5.9406   86.232   4.1885 -5.331108 7.268770 
1 1 1   22   10   20 o   36.834   6.7393   35.815   10.702   1.0874   24.442   44.051   11.903   27.808   11.919   45.861   6.2930 -18.05337 13.47864 
1 1 1   22   10   21 o  133.761   2.6201  370.465   14.435  357.985   19.790  384.655   21.101  131.370   3.6524  136.153   3.7576 -4.782471 5.240177 
1 1 1   22   10   22 o  155.776   2.6872  503.925   17.102  504.598   26.040  503.414   22.678  155.792   4.0526  155.761   3.5300 0.3114319E-01 5.374405 
1 1 1   22   10   23 o  129.829   2.7868  350.307   14.742  352.890   22.715  348.428   19.377  130.156   4.2314  129.502   3.6278 0.6534424 5.573660 
1 1 1   22   10   24 o   92.539   2.9559  178.013   11.267  186.904   16.454  170.163   15.461   94.702   4.2125   90.376   4.1477 4.326317 5.911737 
1 1 1   22   10   25 o   54.493   4.0068   62.278   8.9858   65.585   13.254   59.464   12.224   55.810   5.7581   53.176   5.5734 2.633347 8.013666 
1 1 1   22   10   26 o   52.592   4.2019   59.505   8.9308   46.832   12.763   71.665   12.502   46.853   6.6045   58.330   5.1964 -11.47758 8.403709 
1 1 1   22   10   27 o   24.630   7.8624   3.9425   11.037   8.1787   11.313 -79.7093   50.273   22.555   8.6599   26.704   13.125 -4.148830 15.72488 
1 1 1   22   10   28 o   36.796   5.6013   29.480   8.5035   42.038   12.706   19.291   11.444   44.240   6.9634   29.351   8.7755 14.88956 11.20261 
1 1 1   22   10   29 o   54.474   4.1045   63.087   9.1986   62.116   13.429   63.945   12.625   54.017   6.0279   54.932   5.5725 -0.9147949 8.209037 
1 1 1   22   10   30 o   39.476   5.4553   37.488   8.6939   16.340   12.651   56.413   11.968   27.489   9.3407   51.463   5.6383 -23.97367 10.91052 
1 1 1   22   10   31 o   14.546   4.8155  -9.9939   7.3723 -16.0833   10.973  -4.9843   9.9530   13.507   6.5232   15.586   7.0854 -2.078541 9.630956 
1 1 1   22   10   32 o   19.091   6.0138  -1.2306   8.8453 -18.2993   19.440   3.2255   9.9330   19.295   9.1422   18.886   7.8155 0.4081516 12.02755 
1 1 1   22   10   33 o   63.428   3.8643   86.290   10.099   85.841   14.585   86.702   13.998   63.211   5.5942   63.644   5.3325 -0.4328880 7.728583 
1 1 1   22   10   34 o   49.998   5.1081   54.615   9.9602   76.247   15.347   38.873   13.092   59.070   6.2992   40.926   8.0430 18.14422 10.21619 
1 1 1   22   10   35 o   41.875   5.5155   40.503   9.1559   43.420   13.512   38.026   12.450   43.259   7.8628   40.492   7.7368 2.766571 11.03092 
1 1 1   22   10   36 o   25.337   7.4265   7.5831   10.884   3.4041   12.369   21.917   22.909   20.087   8.5410   30.588   12.152 -10.50131 14.85296 
1 1 1   22   10   37 o   25.844   8.6889   1.9619   11.586   1.5522   11.887   9.7416   51.801   19.027   8.2350   32.660   15.303 -13.63293 17.37781 
1 1 1   22   10   38 o   24.483   7.5713   2.4017   12.262  -3.6255   13.937   23.051   25.796   18.418   8.3774   30.547   12.614 -12.12929 15.14251 
1 1 1   22   10   39 o   21.772   7.0804  -0.9314   12.461  -0.5164   14.102  -2.4093   26.614   19.321   8.6384   24.223   11.221 -4.902225 14.16078 
1 1 1   22   10   40 o   32.779   9.4928   33.588   20.583   46.414   30.568   22.948   27.840   36.066   14.128   29.492   12.683 6.574057 18.98566 
1 1 1   22   10   41 o   30.773   9.1875   30.077   20.206   23.755   29.481   35.678   27.750   29.167   12.790   32.378   13.193 -3.210491 18.37508 
1 1 1   22   11    0 o  108.830   2.6162  245.368   16.564  245.368   16.564  245.368   16.564  108.830   3.6998  108.830   3.6998 0.000000 0.000000 
1 1 1   22   11    1 f  106.366   2.4330  234.276   10.538  230.482   16.178  237.073   13.889  105.599   3.7145  107.132   3.1433 -1.533676 4.865957 
1 1 1   22   11    2 o  218.262   2.4781  982.589   22.017  995.513   34.097  973.347   28.834  219.457   3.7670  217.068   3.2206 2.388870 4.956107 
1 1 1   22   11    3 o  153.650   2.3266  482.428   14.501  516.072   22.986  460.188   18.689  158.031   3.5267  149.269   3.0356 8.761780 4.653205 
1 1 1   22   11    4 o   78.302   2.6825  128.130   8.5296  117.620   12.941  136.202   11.342   75.413   4.1607   81.191   3.3869 -5.778076 5.364954 
1 1 1   22   11    5 o  206.848   2.4375  882.935   20.562  891.954   31.602  876.313   27.077  207.733   3.6885  205.963   3.1875 1.769608 4.874920 
1 1 1   22   11    6 o  250.654   2.5911  1295.38   26.477  1277.67   34.779  1319.78   40.833  248.664   3.3910  252.644   3.9186 -3.980011 5.182165 
1 1 1   22   11    7 o  142.326   2.3605  418.527   13.662  418.355   17.886  418.767   21.170  142.314   3.0471  142.337   3.6061 -0.2326965E-01 4.721073 
1 1 1   22   11    8 o  150.989   2.3366  471.841   14.393  476.470   19.056  465.692   21.962  151.875   3.0422  150.102   3.5474 1.772690 4.673218 
1 1 1   22   11    9 o   76.348   2.7660  120.572   8.6205  120.736   11.408  120.353   13.161   76.424   3.6193   76.272   4.1837 0.1520996 5.532003 
1 1 1   22   11   10 o  134.121   2.5794  370.195   14.233  337.638   19.444  407.774   20.890  127.794   3.6890  140.449   3.6062 -12.65500 5.158779 
1 1 1   22   11   11 o   24.402   5.3521   12.273   6.3378   17.451   8.3505   5.2373   9.7336   28.402   7.1372   20.402   7.9776 7.999588 10.70422 
1 1 1   22   11   12 o  117.051   2.2428  282.957   10.823  277.229   15.049  289.095   15.578  115.826   3.1501  118.276   3.1934 -2.449387 4.485667 
1 1 1   22   11   13 o  212.431   2.4230  929.000   20.640  950.214   33.527  916.052   26.192  214.313   3.7929  210.549   3.0162 3.764236 4.846003 
1 1 1   22   11   14 o  128.957   2.4561  340.471   12.917  366.258   20.095  322.313   16.862  133.056   3.6617  124.858   3.2744 8.197395 4.912217 
1 1 1   22   11   15 o  216.653   2.6986  971.480   24.112  980.831   34.350  962.397   33.856  217.678   3.8260  215.627   3.8068 2.051193 5.397255 
1 1 1   22   11   16 o  112.946   2.6476  264.538   12.312  253.503   17.684  274.920   17.153  110.640   3.8752  115.251   3.6085 -4.611053 5.295176 
1 1 1   22   11   17 o  150.782   2.8877  471.790   17.688  474.911   23.139  467.403   27.433  151.448   3.7045  150.116   4.4308 1.331787 5.775359 
1 1 1   22   11   18 o   63.362   3.4136   87.910   8.3829   67.488   13.426  100.957   10.732   56.911   5.7201   69.814   3.7270 -12.90339 6.827175 
1 1 1   22   11   19 o  180.007   3.5361  671.410   26.253   0.0000   0.0000  671.410   26.253  ?   ?   180.007   3.5361      ?      ? 
1 1 1   22   11   20 o  163.841   3.4076  562.646   21.204  549.910   38.115  568.355   25.517  162.167   5.6986  165.516   3.7379 -3.348938 6.815154 
1 1 1   22   11   21 o  138.396   2.5712  397.473   14.676  400.026   20.871  394.977   20.641  138.834   3.6449  137.959   3.6276 0.8749390 5.142479 
1 1 1   22   11   22 o  108.160   2.7256  243.134   12.157  246.888   17.405  239.559   16.987  108.971   3.8726  107.350   3.8365 1.621605 5.451225 
1 1 1   22   11   23 o   44.440   5.0145   43.808   8.6737   34.985   13.045   50.799   11.612   39.725   8.2324   49.155   5.7279 -9.429558 10.02896 
1 1 1   22   11   24 o   81.475   3.0720  138.454   10.322  138.219   14.686  138.683   14.511   81.401   4.3744   81.550   4.3142 -0.1493683 6.143973 
1 1 1   22   11   25 o   54.392   3.9983   62.773   8.9211   58.054   12.961   67.022   12.298   52.360   6.0017   56.425   5.2843 -4.064617 7.996546 
1 1 1   22   11   26 o   24.186   5.9640   9.8810   7.7752   19.001   11.613   2.4714   10.468   29.218   8.8635   19.153   7.9823 10.06524 11.92808 
1 1 1   22   11   27 o   41.522   9.7160   35.523   11.695   35.469   11.998   36.558   52.366   39.935   7.5611   43.109   17.901 -3.173920 19.43196 
1 1 1   22   11   28 o   42.743   5.3400   41.289   8.9244   27.557   12.701   54.680   12.543   34.766   8.8382   50.721   5.9957 -15.95528 10.67998 
1 1 1   22   11   29 f   44.790   4.9074   45.036   8.5673   35.138   12.616   53.507   11.671   39.426   8.0310   50.154   5.6423 -10.72777 9.814889 
1 1 1   22   11   30 o   20.150   5.9554   3.2118   8.1016   2.0604   13.202   3.9072   10.261   20.751   8.8238   19.549   8.0005 1.202768 11.91077 
1 1 1   22   11   31 o   87.266   3.1876  160.350   11.459  171.188   16.657  150.615   15.787   90.069   4.4840   84.463   4.5318 5.606026 6.375268 
1 1 1   22   11   32 f   46.739   6.6381   55.495   10.785   40.910   21.421   60.447   12.482   40.392   11.990   53.087   5.7006 -12.69490 13.27622 
1 1 1   22   11   33 o   54.344   4.2136   64.553   9.3475   58.404   13.761   69.820   12.737   51.692   6.4544   56.996   5.4184 -5.304169 8.427210 
1 1 1   22   11   34 o   37.434   6.1214   32.351   9.2416   41.856   14.324   25.573   12.096   42.159   8.5307   32.708   8.7815 9.450684 12.24284 
1 1 1   22   11   35 o   65.778   5.1937   89.827   12.740   80.056   14.809  117.656   24.992   60.449   5.9399   71.107   8.5216 -10.65801 10.38746 
1 1 1   22   11   36 o   25.884   7.3153   3.5767   11.087  -6.0559   12.807   32.373   22.144   17.163   7.8904   34.606   12.321 -17.44366 14.63068 
1 1 1   22   11   37 o   34.284   9.5694   24.705   12.632   22.810   13.079   50.976   48.709   30.181   9.4516   38.388   16.642 -8.207470 19.13879 
1 1 1   22   11   38 o   29.094   7.9929   20.514   12.374   20.161   13.983   21.788   26.569   28.206   9.8111   29.981   12.621 -1.775196 15.98571 
1 1 1   22   11   39 o   36.191   8.2937   35.441   12.900   31.899   14.929   45.882   25.634   34.537   9.9425   37.844   13.277 -3.307915 16.58733 
1 1 1   22   11   40 o   40.385   9.9139   57.742   20.902   76.298   30.474   41.257   28.723   46.411   14.409   34.358   13.620 12.05331 19.82776 
1 1 1   22   11   41 o   24.759   8.1506   2.1761   20.095   12.372   30.134  -5.9888   26.966   26.744   12.224   22.775   10.784 3.969770 16.30113 
1 1 1   22   12    0 o  282.680   2.9438  1651.40   48.514  1651.40   48.514  1651.40   48.514  282.680   4.1631  282.680   4.1631 0.000000 0.000000 
1 1 1   22   12    1 o  158.952   2.3378  520.866   15.139  529.328   23.389  514.764   19.862  160.039   3.5434  157.866   3.0504 2.172836 4.675541 
1 1 1   22   12    2 o   78.340   2.7155  124.965   8.6467  137.842   13.673  116.383   11.162   81.640   4.0607   75.039   3.6065 6.600716 5.431013 
1 1 1   22   12    3 o  214.219   2.4619  947.779   21.485  952.055   33.113  944.671   28.234  214.600   3.7411  213.837   3.2013 0.7636566 4.923880 
1 1 1   22   12    4 o  200.377   2.2330  829.405   18.454  835.919   26.256  823.046   25.941  201.154   3.1648  199.600   3.1511 1.553284 4.466019 
1 1 1   22   12    5 o   69.519   2.5848   99.915   7.4104   98.910   10.529  100.902   10.432   69.171   3.6905   69.867   3.6201 -0.6960373 5.169615 
1 1 1   22   12    6 o  173.015   2.1774  618.379   15.538  619.889   21.978  616.869   21.970  173.227   3.0761  172.804   3.0826 0.4230804 4.354886 
1 1 1   22   12    7 o  116.268   2.2014  279.281   10.556  275.710   14.924  282.858   14.933  115.522   3.1322  117.013   3.0943 -1.490585 4.402882 
1 1 1   22   12    8 o   74.319   2.7980  113.261   8.5096  106.950   11.233  121.762   13.037   71.919   3.7868   76.719   4.1200 -4.799942 5.595914 
1 1 1   22   12    9 o  122.812   2.5273  311.562   12.797  301.878   17.818  321.878   18.391  120.842   3.5749  124.781   3.5734 -3.938850 5.054636 
1 1 1   22   12   10 o  181.982   2.5556  684.603   19.178  703.075   27.317  666.650   26.930  184.405   3.5917  179.559   3.6364 4.846237 5.111117 
1 1 1   22   12   11 o  131.990   2.5782  357.203   13.399  350.147   16.557  370.592   22.808  130.171   3.0839  133.809   4.1327 -3.638046 5.156499 
1 1 1   22   12   12 o  211.611   2.6312  925.583   22.952  886.393   31.977  967.229   32.964  206.990   3.7457  216.231   3.6962 -9.241608 5.262317 
1 1 1   22   12   13 o  248.895   2.6637  1282.86   27.165  1273.54   40.739  1290.33   36.453  248.030   3.9824  249.761   3.5387 -1.731018 5.327426 
1 1 1   22   12   14 o  159.916   2.5222  529.783   16.612  500.953   23.604  558.075   23.383  155.583   3.6784  164.249   3.4517 -8.665619 5.044312 
1 1 1   22   12   15 o  151.826   2.8512  478.942   17.670  487.749   23.487  467.458   26.820  153.492   3.7100  150.160   4.3305 3.332199 5.702446 
1 1 1   22   12   16 o  124.841   2.4305  321.581   12.191  326.664   19.666  318.409   15.537  125.592   3.7965  124.090   3.0357 1.502319 4.860931 
1 1 1   22   12   17 o  159.375   2.4365  530.509   15.864  479.178   23.345  574.552   21.625  152.098   3.7214  166.653   3.1461 -14.55476 4.873101 
1 1 1   22   12   18 o  174.224   2.4074  628.977   16.910  627.514   26.897  629.933   21.745  173.975   3.7485  174.473   3.0218 -0.4971771 4.814815 
1 1 1   22   12   19 o   46.112   5.6037   51.154   9.4729   29.980   15.324   64.251   12.051   36.734   9.8932   55.490   5.2657 -18.75592 11.20730 
1 1 1   22   12   20 o  143.055   2.9162  427.325   17.009  411.866   25.829  439.162   22.602  140.665   4.4520  145.443   3.7678 -4.777908 5.832363 
1 1 1   22   12   21 o   96.400   2.8968  193.639   11.500  201.619   16.072  185.266   16.463   98.467   3.9574   94.333   4.2314 4.133850 5.793619 
1 1 1   22   12   22 o   77.678   3.7433  128.212   11.545  133.434   14.660  119.688   18.731   79.975   4.4444   75.381   6.0247 4.593513 7.486681 
1 1 1   22   12   23 o   88.587   3.6667  164.906   13.158  167.148   17.142  161.692   20.527   89.459   4.6460   87.715   5.6739 1.743988 7.333362 
1 1 1   22   12   24 f   66.823   3.5305   94.186   9.6214  111.201   13.703   77.640   13.513   72.904   4.5572   60.743   5.3936 12.16083 7.061065 
1 1 1   22   12   25 o   46.170   4.5112   45.428   8.5762   44.969   12.453   45.841   11.828   45.902   6.5779   46.438   6.1755 -0.5359039 9.022488 
1 1 1   22   12   26 f   58.575   4.0280   73.167   9.5916   58.839   13.469   87.908   13.662   52.570   6.2122   64.580   5.1292 -12.01037 8.056016 
1 1 1   22   12   27 o   46.321   6.2632   52.196   10.850   60.946   13.454   35.918   18.350   53.522   6.0947   39.121   10.944 14.40054 12.52631 
1 1 1   22   12   28 o   20.094   5.8921   3.1267   8.0476   0.9668   11.322   5.3318   11.440   19.074   8.1425   21.113   8.5187 -2.038811 11.78428 
1 1 1   22   12   29 o   68.317   3.4980   98.253   9.8245  109.986   14.385   87.994   13.450   72.162   4.8331   64.473   5.0581 7.688889 6.995951 
1 1 1   22   12   30 o   34.409   6.1519   25.516   8.8108   39.068   14.194   17.020   11.238   41.238   8.6227   27.581   8.7769 13.65748 12.30386 
1 1 1   22   12   31 o   70.918   3.5025  106.717   10.240  108.252   14.742  105.286   14.235   71.389   5.0068   70.447   4.8991 0.9411240 7.005002 
1 1 1   22   12   32 o   59.254   6.0144   89.606   11.705   60.322   21.872  101.357   13.855   49.492   11.000   69.015   4.8676 -19.52271 12.02885 
1 1 1   22   12   33 o   36.240   6.0138   31.549   8.8548   26.394   13.305   35.648   11.864   33.092   9.3403   39.388   7.5779 -6.296295 12.02767 
1 1 1   22   12   34 o   49.119   4.9910   54.004   9.9527   52.394   15.307   55.184   13.100   48.125   7.7118   50.114   6.3379 -1.988815 9.981992 
1 1 1   22   12   35 o   31.675   7.1722   27.053   11.384   33.472   13.267   9.1401   22.164   37.033   8.8135   26.318   11.317 10.71463 14.34443 
1 1 1   22   12   36 o   42.494   6.9879   52.890   12.304   63.847   14.501   24.726   23.249   53.444   6.5786   31.544   12.331 21.89980 13.97576 
1 1 1   22   12   37 o   17.882   6.1069 -14.3375   11.351 -12.7561   12.956 -19.5622   23.549   15.437   7.3568   20.327   9.7495 -4.890330 12.21377 
1 1 1   22   12   38 o   21.755   7.0236   0.1896   12.051   0.8792   13.633  -2.2757   25.777   19.516   8.6225   23.994   11.089 -4.477894 14.04715 
1 1 1   22   12   39 o   19.795   6.6163  -5.8383   12.040  -3.1283   13.449 -16.7817   27.026   17.969   8.1950   21.621   10.390 -3.651512 13.23270 
1 1 1   22   12   40 o   25.998   8.8289  -0.8330   24.926  -1.9659   49.555  -0.4493   28.839   27.695   13.488   24.301   11.396 3.393595 17.65776 
1 1 1   22   13    0 o  359.442   3.3738  2671.31   70.706  2671.31   70.706  2671.31   70.706  359.442   4.7712  359.442   4.7712 0.000000 0.000000 
1 1 1   22   13    1 o  228.301   2.6984  1077.70   25.408  1074.22   35.819  1081.23   36.047  227.931   3.8102  228.671   3.8221 -0.7398834 5.396819 
1 1 1   22   13    2 o  153.578   2.3232  483.126   14.481  510.473   22.859  464.793   18.716  157.154   3.5266  150.002   3.0251 7.151230 4.646339 
1 1 1   22   13    3 o   79.724   2.6922  130.228   8.7042  137.785   13.781  125.213   11.227   81.614   4.0940   77.834   3.4973 3.780029 5.384420 
1 1 1   22   13    4 o  101.910   2.2302  214.658   9.3697  207.849   13.285  221.399   13.217  100.298   3.2114  103.523   3.0955 -3.224663 4.460416 
1 1 1   22   13    5 o  122.045   2.1614  307.616   10.878  314.507   15.523  300.966   15.248  123.388   3.0504  120.701   3.0629 2.686249 4.322731 
1 1 1   22   13    6 o   75.685   2.5122  118.468   7.8364  113.214   11.081  123.723   11.083   74.002   3.6306   77.368   3.4733 -3.366592 5.024460 
1 1 1   22   13    7 o  164.041   2.1594  555.936   14.610  556.003   20.621  555.868   20.702  164.052   3.0477  164.031   3.0600 0.2120972E-01 4.318783 
1 1 1   22   13    8 o  127.201   2.3746  334.324   12.321  333.727   16.256  335.131   18.887  127.089   3.1012  127.313   3.5968 -0.2245331 4.749202 
1 1 1   22   13    9 f  223.961   2.5179  1034.00   22.933  1018.57   29.925  1055.97   35.699  221.989   3.2685  225.932   3.8310 -3.942871 5.035784 
1 1 1   22   13   10 o  135.567   2.3493  378.277   12.970  369.780   16.956  390.260   20.136  133.765   3.0735  137.370   3.5540 -3.605026 4.698628 
1 1 1   22   13   11 o   32.690   5.0821   22.964   6.6152   21.651   8.7409   24.724   10.121   31.623   6.8960   33.757   7.4671 -2.133728 10.16424 
1 1 1   22   13   12 o   88.233   2.7325  166.555   9.5986  133.785   14.681  191.020   12.685   80.346   4.4303   96.120   3.1998 -15.77345 5.464997 
1 1 1   22   13   13 o   43.271   4.5503   41.062   7.5511   33.544   11.872   46.170   9.7857   39.387   7.5833   47.155   5.0315 -7.768078 9.100692 
1 1 1   22   13   14 o  168.495   2.4232  590.477   16.647  565.925   25.243  609.375   22.146  165.331   3.7018  171.658   3.1280 -6.326019 4.846383 
1 1 1   22   13   15 o  120.049   2.9344  298.944   14.052  297.848   22.981  299.598   17.758  119.794   4.6513  120.303   3.5789 -0.5085297 5.868804 
1 1 1   22   13   16 o  131.292   2.4990  354.816   13.371  370.225   20.753  343.881   17.483  133.679   3.7641  128.906   3.2883 4.773605 4.998079 
1 1 1   22   13   17 o   79.954   2.9012  133.623   9.3446  128.127   14.736  137.321   12.086   78.510   4.5507   81.398   3.5999 -2.888901 5.802396 
1 1 1   22   13   18 o  115.330   2.8852  277.191   12.544  273.921   22.918  278.591   14.989  114.675   4.8454  115.985   3.1334 -1.309937 5.770307 
1 1 1   22   13   19 o  106.972   3.1114  240.318   13.259  229.349   21.494  247.056   16.847  104.850   4.9703  109.094   3.7442 -4.244186 6.222809 
1 1 1   22   13   20 f   86.622   3.3510  151.741   11.620  176.458   19.405  137.923   14.509   91.866   5.1215   81.378   4.3229 10.48724 6.702050 
1 1 1   22   13   21 o   40.706   5.0489   35.649   8.1821   44.903   11.990   27.583   11.194   46.129   6.3020   35.282   7.8900 10.84693 10.09786 
1 1 1   22   13   22 o  120.448   2.6591  300.512   13.183  326.441   19.313  277.889   18.040  125.300   3.7371  115.595   3.7838 9.704720 5.318180 
1 1 1   22   13   23 o   24.988   5.5049   10.214   7.9742  -7.6442   11.902   24.761   10.742   16.652   7.6373   33.324   7.9302 -16.67218 11.00986 
1 1 1   22   13   24 o   68.051   3.6229   97.303   10.127   99.719   15.086   95.321   13.664   68.763   5.3193   67.338   4.9199 1.425697 7.245712 
1 1 1   22   13   25 o  143.389   2.6656  428.031   15.734  443.861   23.129  414.396   21.465  145.817   3.8458  140.961   3.6921 4.856094 5.331223 
1 1 1   22   13   26 o  123.298   3.0469  316.948   15.364  307.110   20.313  330.099   23.487  121.180   4.0643  125.416   4.5405 -4.236870 6.093798 
1 1 1   22   13   27 o   21.151   5.6899   3.8856   7.7703   14.895   11.033  -6.9506   10.946   26.375   8.7200   15.926   7.3117 10.44871 11.37977 
1 1 1   22   13   28 o   36.130   8.5697   20.606   11.000   15.967   11.769   52.655   30.932   27.075   9.0090   45.184   14.581 -18.10868 17.13941 
1 1 1   22   13   29 o   79.122   6.2214  148.624   17.966  116.049   31.740  163.981   21.793   70.736   10.879   87.507   6.0383 -16.77173 12.44271 
1 1 1   22   13   30 o   27.259   6.4726   16.399   8.5932   15.786   12.152   17.011   12.153   26.888   9.1547   27.631   9.1527 -0.7434063 12.94530 
1 1 1   22   13   31 o  127.389   2.8144  340.976   14.741  345.602   21.779  337.065   20.026  128.095   4.1223  126.683   3.8328 1.412262 5.628803 
1 1 1   22   13   32 o   60.477   5.8551   82.365   14.552   91.569   21.645   74.774   19.657   63.553   8.2576   57.401   8.3029 6.151802 11.71012 
1 1 1   22   13   33 o   28.399   6.1557   18.893   8.4236   10.063   12.438   26.374   11.449   23.419   9.0563   33.379   8.3400 -9.960142 12.31148 
1 1 1   22   13   34 o   47.153   5.5983   53.671   10.051   30.437   14.210   76.929   14.218   34.996   9.5697   59.309   5.8122 -24.31283 11.19651 
1 1 1   22   13   35 o   45.949   7.3484   51.498   12.748   47.520   15.245   60.744   23.243   44.449   8.6268   47.449   11.898 -3.000240 14.69675 
1 1 1   22   13   36 o   43.238   7.5515   46.867   12.490   43.510   14.826   55.079   23.185   42.161   8.8098   44.315   12.267 -2.154182 15.10297 
1 1 1   22   13   37 o   21.723   9.2108   5.9876   14.317   5.9876   14.317   0.0000   0.0000   21.723   9.2108  ?   ?       ?      ? 
1 1 1   22   13   38 o   46.521   9.5534   55.790   17.717   55.790   17.717   0.0000   0.0000   46.521   9.5534  ?   ?       ?      ? 
1 1 1   22   13   39 o   52.996   7.7351   67.993   14.511   56.436   16.597  105.491   29.895   46.936   8.8993   59.056   12.654 -12.12033 15.47029 
1 1 1   22   13   40 o   26.633   8.5454   12.833   20.340   9.2996   31.197   15.446   26.825   26.362   12.189   26.905   11.980 -0.5430737 17.09082 
1 1 1   22   14    0 o   69.003   3.1608   99.606   12.599   99.606   12.599   99.606   12.599   69.003   4.4701   69.003   4.4701 0.000000 0.000000 
1 1 1   22   14    1 o   35.976   5.1777   27.937   7.4214   30.028   10.529   25.872   10.462   37.377   7.0893   34.575   7.5484 2.802475 10.35548 
1 1 1   22   14    2 o  230.786   2.5219  1102.49   23.764  1090.80   36.168  1111.38   31.522  229.666   3.8183  231.905   3.2957 -2.238922 5.043867 
1 1 1   22   14    3 o  130.832   2.1614  353.413   11.657  337.942   16.285  369.673   16.695  127.895   3.0872  133.769   3.0260 -5.874420 4.322853 
1 1 1   22   14    4 o  314.721   2.6894  2047.77   34.899  2075.63   50.102  2021.51   48.639  316.793   3.8346  312.650   3.7719 4.142792 5.378758 
1 1 1   22   14    5 o   91.842   2.6111  177.458   9.6831  156.549   14.756  193.270   12.832   86.978   4.1134   96.707   3.2173 -9.728523 5.222149 
1 1 1   22   14    6 f   76.069   2.5131  119.653   7.8835  119.351   11.241  119.946   11.059   75.972   3.5876   76.165   3.5203 -0.1928024 5.026277 
1 1 1   22   14    7 o   80.680   2.4715  134.688   8.2185  130.090   11.692  139.178   11.555   79.313   3.5742   82.047   3.4146 -2.733795 4.943069 
1 1 1   22   14    8 o   98.300   2.2818  199.753   9.2501  200.244   12.997  199.249   13.168   98.424   3.2016   98.176   3.2520 0.2484131 4.563557 
1 1 1   22   14    9 o   97.047   2.5068  195.384   9.9287  199.032   13.192  190.617   15.079   98.117   3.2599   95.976   3.8092 2.140938 5.013688 
1 1 1   22   14   10 o  197.983   2.4325  809.693   19.607  804.355   25.707  817.119   30.318  197.249   3.1598  198.716   3.6992 -1.467270 4.865036 
1 1 1   22   14   11 o  189.956   2.5048  744.862   19.509  762.144   29.370  731.217   26.098  191.893   3.7109  188.020   3.3654 3.872925 5.009620 
1 1 1   22   14   12 o  196.460   2.6898  797.942   21.751  780.545   29.702  818.063   31.942  194.174   3.7088  198.745   3.8968 -4.571884 5.379579 
1 1 1   22   14   13 o  164.378   2.4363  560.723   16.428  542.677   24.315  575.878   22.282  161.905   3.6412  166.852   3.2379 -4.946884 4.872591 
1 1 1   22   14   14 o  202.723   2.6609  851.192   22.247  848.987   31.602  853.358   31.323  202.458   3.7845  202.988   3.7414 -0.5305786 5.321705 
1 1 1   22   14   15 o   38.100   5.2103   31.297   7.8221   32.804   12.009   30.186   10.309   38.824   7.7709   37.377   6.9427 1.447548 10.42051 
1 1 1   22   14   16 o   81.279   2.7891  135.843   9.0604  142.059   14.915  132.207   11.406   82.682   4.3737   79.877   3.4622 2.805344 5.578188 
1 1 1   22   14   17 o  103.148   2.6027  227.250   10.670  191.601   16.709  251.799   13.866   96.019   4.2192  110.277   3.0486 -14.25796 5.205320 
1 1 1   22   14   18 o   84.022   3.1206  145.435   9.7424  150.432   18.441  143.500   11.474   84.848   5.2697   83.196   3.3439 1.651947 6.241148 
1 1 1   22   14   19 o  209.643   3.0248  919.088   25.834  888.766   39.384  941.990   34.227  206.423   4.6259  212.863   3.8986 -6.439560 6.049606 
1 1 1   22   14   20 o   68.124   4.9042   80.262   11.298  133.596   26.940   68.880   12.445   78.919   8.2767   57.330   5.2632 21.58877 9.808468 
1 1 1   22   14   21 o   78.694   3.4567  129.876   10.863  128.001   17.652  131.019   13.782   78.095   5.4805   79.293   4.2142 -1.198280 6.913403 
1 1 1   22   14   22 o   80.580   3.2256  135.706   10.719  134.146   15.056  137.310   15.265   80.112   4.5567   81.049   4.5667 -0.9368820 6.451181 
1 1 1   22   14   23 o   78.436   3.2706  129.221   10.542  115.989   14.832  142.731   14.986   74.310   4.8393   82.563   4.4009 -8.252899 6.541183 
1 1 1   22   14   24 o  105.360   2.9518  231.589   12.743  237.521   19.255  226.966   16.998  106.481   4.3843  104.240   3.9536 2.240662 5.903663 
1 1 1   22   14   25 o   82.228   3.2192  141.864   10.915  140.129   15.219  143.701   15.662   81.723   4.5152   82.734   4.5899 -1.011276 6.438449 
1 1 1   22   14   26 o   57.591   5.3676   77.910   11.234   90.801   14.153   55.955   18.471   65.589   5.2319   49.593   9.3739 15.99628 10.73515 
1 1 1   22   14   27 o   70.437   3.3979  104.659   9.8627  105.009   14.257  104.336   13.658   70.518   4.9020   70.356   4.7068 0.1619949 6.795785 
1 1 1   22   14   28 o   45.613   5.4962   47.902   9.7304   58.748   13.203   35.008   14.396   52.368   6.1130   38.859   9.1359 13.50915 10.99240 
1 1 1   22   14   29 o   25.119   6.4805   12.601   8.7735   9.3269   13.686   14.886   11.432   24.036   9.4416   26.203   8.8793 -2.166939 12.96094 
1 1 1   22   14   30 o   25.216   6.2235   12.959   8.1409   17.988   11.732   8.2894   11.306   28.142   8.9691   22.291   8.6303 5.851158 12.44691 
1 1 1   22   14   31 o   27.333   5.8302   16.748   7.9450   5.4729   11.722   26.328   10.805   20.982   8.5651   33.684   7.9122 -12.70208 11.66034 
1 1 1   22   14   32 o   61.342   5.1403   88.507   11.602   71.433   20.474   96.583   14.081   55.562   8.9342   67.121   5.0863 -11.55892 10.28061 
1 1 1   22   14   33 o   47.228   5.2132   50.394   9.7944   61.500   14.392   40.814   13.367   52.704   6.6210   41.752   8.0544 10.95250 10.42643 
1 1 1   22   14   34 o   45.209   7.2912   46.433   13.595   46.433   13.595   0.0000   0.0000   45.209   7.2912  ?   ?       ?      ? 
1 1 1   22   14   35 o   28.908   6.9518   19.943   12.127   33.118   14.608  -9.2796   21.755   36.245   9.6139   21.571   10.044 14.67410 13.90360 
1 1 1   22   14   36 f   42.804   7.5821   43.461   12.549   33.659   14.900   67.383   23.277   36.036   9.7767   49.573   11.592 -13.53662 15.16425 
1 1 1   22   14   37 o   50.623   7.4786   68.039   14.139   68.537   16.900   66.877   25.812   54.030   7.5836   47.215   12.892 6.814884 14.95717 
1 1 1   22   14   38 o   26.810   10.056   18.235   15.044   18.235   15.044   0.0000   0.0000   26.810   10.056  ?   ?       ?      ? 
1 1 1   22   14   39 o   23.216   7.2662   7.3629   12.711   8.4192   14.743   4.3048   25.086   22.213   9.3788   24.220   11.101 -2.006847 14.53235 
1 1 1   22   15    0 o  145.082   2.5377  435.474   21.445  435.474   21.445  435.474   21.445  145.082   3.5889  145.082   3.5889 0.000000 0.000000 
1 1 1   22   15    1 o  135.004   2.5304  376.908   14.089  376.458   19.931  377.358   19.919  134.923   3.5817  135.085   3.5752 -0.1617432 5.060719 
1 1 1   22   15    2 o  173.752   2.3716  626.593   16.842  604.251   25.332  644.293   22.548  170.933   3.5932  176.570   3.0961 -5.637009 4.743122 
1 1 1   22   15    3 o  137.736   2.1481  391.973   12.202  398.515   17.376  385.607   17.140  138.871   3.0337  136.602   3.0421 2.268295 4.296257 
1 1 1   22   15    4 f  162.325   2.1566  544.387   14.436  552.880   20.632  536.239   20.207  163.564   3.0583  161.085   3.0414 2.478455 4.313188 
1 1 1   22   15    5 o   92.215   2.3214  175.776   8.8280  172.028   12.409  179.618   12.562   91.219   3.2983   93.212   3.2675 -1.992813 4.642759 
1 1 1   22   15    6 o   91.618   2.3336  173.508   8.8159  178.883   12.564  168.295   12.374   93.017   3.2748   90.219   3.3253 2.798325 4.667148 
1 1 1   22   15    7 f  121.907   2.1661  307.102   10.889  299.368   15.276  315.093   15.527  120.346   3.0776  123.469   3.0490 -3.122932 4.332250 
1 1 1   22   15    8 o  118.815   2.1869  291.848   10.716  290.209   15.206  293.466   15.105  118.481   3.1116  119.148   3.0737 -0.6667099 4.373787 
1 1 1   22   15    9 o  214.693   2.4763  953.765   21.694  954.248   28.673  953.118   33.178  214.808   3.2363  214.578   3.7489 0.2303925 4.952567 
1 1 1   22   15   10 o  126.221   2.3470  328.551   12.045  323.655   15.708  335.538   18.764  125.114   3.0440  127.327   3.5731 -2.213196 4.693957 
1 1 1   22   15   11 o   72.135   3.1168  109.350   9.1437   96.048   13.554  120.459   12.387   68.014   4.8318   76.255   3.9384 -8.241089 6.233552 
1 1 1   22   15   12 o   62.770   3.4976   81.712   9.0289   90.733   13.047   73.420   12.508   66.104   4.7853   59.436   5.1024 6.668049 6.995244 
1 1 1   22   15   13 o  222.579   2.4697  1026.08   22.122  1023.93   35.371  1027.47   28.352  222.290   3.8580  222.867   3.0845 -0.5768738 4.939397 
1 1 1   22   15   14 o   87.354   2.8560  159.202   10.214  149.670   15.115  167.212   13.857   84.897   4.3166   89.812   3.7407 -4.914879 5.711941 
1 1 1   22   15   15 o  137.187   2.3777  390.966   13.148  385.094   20.858  394.837   16.936  136.260   3.7115  138.115   2.9731 -1.854828 4.755473 
1 1 1   22   15   16 o   99.085   2.5440  204.809   10.086  198.659   16.251  208.661   12.863   97.795   4.0290  100.374   3.1071 -2.578156 5.087907 
1 1 1   22   15   17 o   61.339   3.8657   81.700   8.4610   72.654   16.375   84.994   9.8823   58.700   6.7638   63.979   3.7450 -5.278843 7.731370 
1 1 1   22   15   18 o   83.311   3.1608  145.188   9.6668  143.592   18.448  145.792   11.350   82.788   5.4027   83.835   3.2824 -1.047401 6.321697 
1 1 1   22   15   19 o  103.261   2.8309  222.617   12.015  203.140   17.097  241.620   16.888   98.737   4.1983  107.785   3.7988 -9.047104 5.661881 
1 1 1   22   15   20 o   39.058   6.0500   37.103   9.0634   23.394   16.358   43.175   10.887   32.813   10.605   45.304   5.8265 -12.49140 12.10006 
1 1 1   22   15   21 o   98.442   2.8718  202.113   11.649  191.430   16.437  212.895   16.512   95.801   4.1598  101.083   3.9605 -5.281723 5.743651 
1 1 1   22   15   22 o  113.860   2.6949  270.228   12.650  281.922   18.140  259.158   17.649  116.265   3.7828  111.454   3.8394 4.811470 5.389841 
1 1 1   22   15   23 o   75.638   3.3224  121.479   10.242  105.929   14.972  135.155   14.041   70.910   5.1193   80.365   4.2362 -9.454872 6.644717 
1 1 1   22   15   24 o   34.680   5.6136   28.932   8.3128   13.718   13.006   39.438   10.809   26.305   9.4341   43.055   6.0866 -16.74992 11.22719 
1 1 1   22   15   25 o   36.801   5.5232   29.805   8.3307   40.124   12.194   20.775   11.408   43.256   6.8352   30.347   8.6778 12.90826 11.04644 
1 1 1   22   15   26 o   60.922   4.8825   80.298   12.186   82.082   16.444   78.124   18.150   61.848   6.4463   59.996   7.3349 1.852661 9.765036 
1 1 1   22   15   27 o   56.911   4.2531   68.456   9.7298   73.033   15.819   65.671   12.340   58.218   6.5882   55.605   5.3807 2.613171 8.506196 
1 1 1   22   15   28 o   37.123   5.8562   28.757   9.2095   50.083   14.731   15.073   11.800   47.810   7.4702   26.436   9.0209 21.37455 11.71241 
1 1 1   22   15   29 o   34.688   6.4093   29.478   9.7157   38.046   12.712   17.442   15.066   40.921   7.8170   28.455   10.159 12.46561 12.81854 
1 1 1   22   15   30 o   81.680   3.2677  141.640   10.991  139.708   15.936  143.393   15.178   81.076   4.7655   82.284   4.4724 -1.208214 6.535472 
1 1 1   22   15   31 o   31.399   5.8813   22.748   8.8826   38.424   12.456   6.5238   12.671   40.888   7.6676   21.910   8.9199 18.97808 11.76253 
1 1 1   22   15   32 o   42.178   5.8335   42.946   9.4996   35.114   15.492   47.665   12.026   37.725   9.8500   46.631   6.2529 -8.906170 11.66709 
1 1 1   22   15   33 o  100.825   4.2579  233.133   15.864  248.240   19.115  199.694   28.439  107.870   4.2964   93.779   7.3525 14.09041 8.515766 
1 1 1   22   15   34 o   23.910   7.0781   8.1024   10.847   7.6283   12.830   9.2906   20.311   22.111   8.9857   25.709   10.939 -3.598507 14.15610 
1 1 1   22   15   35 o   31.819   7.7772   26.388   11.847   26.940   13.868   24.898   22.790   32.479   9.6484   31.159   12.200 1.319788 15.55449 
1 1 1   22   15   36 o   20.856   6.6638  -0.6797   12.009   3.3520   14.667  -8.8795   20.916   20.914   9.0995   20.797   9.7378 0.1177139 13.32759 
1 1 1   22   15   37 o   31.498   8.1713   22.409   13.257   12.102   15.805   46.880   24.352   24.429   9.9556   38.566   12.960 -14.13783 16.34251 
1 1 1   22   15   38 o   20.846   9.1593   3.7728   15.186   3.7728   15.186   0.0000   0.0000   20.846   9.1593  ?   ?       ?      ? 
1 1 1   22   15   39 o   24.406   7.3792   11.962   12.955   16.095   14.864  -1.1016   26.423   25.363   9.8746   23.448   10.968 1.915470 14.75836 
1 1 1   22   16    0 o  106.039   2.6747  233.168   16.496  233.168   16.496  233.168   16.496  106.039   3.7826  106.039   3.7826 0.000000 0.000000 
1 1 1   22   16    1 o  156.976   2.5231  509.556   16.332  496.336   22.860  523.339   23.343  154.896   3.5782  159.056   3.5582 -4.160568 5.046270 
1 1 1   22   16    2 o   44.360   3.8997   40.068   7.0335   45.712   11.145   36.332   9.0671   46.889   5.7630   41.831   5.2554 5.057770 7.799435 
1 1 1   22   16    3 o   83.836   2.4000  145.450   8.2894  137.210   11.702  153.748   11.744   81.445   3.4837   86.227   3.3021 -4.782234 4.800027 
1 1 1   22   16    4 o  103.030   2.2393  219.419   9.5133  226.630   13.557  212.425   13.353  104.700   3.1396  101.361   3.1940 3.338913 4.478636 
1 1 1   22   16    5 o  137.237   2.1631  389.287   12.243  382.935   17.191  395.824   17.439  136.101   3.0624  138.373   3.0557 -2.272293 4.326174 
1 1 1   22   16    6 o  211.220   2.2739  922.615   19.809  921.159   27.924  924.092   28.106  211.054   3.2079  211.387   3.2237 -0.3328705 4.547843 
1 1 1   22   16    7 o   36.221   4.1484   27.769   6.0143   31.951   8.6121   23.788   8.4027   39.206   5.3259   33.235   6.3616 5.970566 8.296717 
1 1 1   22   16    8 o  190.400   2.2132  749.455   17.377  736.929   24.276  762.616   24.884  188.771   3.1181  192.029   3.1419 -3.257690 4.426460 
1 1 1   22   16    9 o   71.204   2.5722  104.930   7.5521  108.183   10.774  101.788   10.589   72.290   3.6137   70.117   3.6614 2.172493 5.144388 
1 1 1   22   16   10 o   57.391   4.1815   71.042   9.5439   82.674   12.686   55.872   14.487   63.090   4.8752   51.691   6.7951 11.39923 8.363070 
1 1 1   22   16   11 o   28.728   5.8603   17.785   7.3118   17.766   10.799   17.802   9.9355   28.776   8.5065   28.680   8.0631 0.9661102E-01 11.72066 
1 1 1   22   16   12 o  159.414   2.7806  520.475   18.043  489.100   23.406  566.423   28.326  153.620   3.6942  165.208   4.1570 -11.58817 5.561285 
1 1 1   22   16   13 o  134.743   2.5164  377.573   13.921  361.238   20.419  391.760   19.029  131.973   3.7513  137.514   3.3551 -5.540939 5.032772 
1 1 1   22   16   14 o   50.313   3.9687   54.053   8.0388   46.067   12.181   60.214   10.700   46.861   6.3025   53.765   4.8251 -6.903301 7.937404 
1 1 1   22   16   15 o   34.016   5.0419   23.963   6.6407   30.964   11.225   20.194   8.2367   37.635   7.4948   30.397   6.7461 7.237974 10.08373 
1 1 1   22   16   16 o  100.838   2.5159  211.347   10.183  209.777   16.372  212.337   13.005  100.456   3.9516  101.220   3.1152 -0.7635803 5.031815 
1 1 1   22   16   17 o   88.934   3.1342  173.301   10.265  145.462   18.609  185.477   12.307   83.298   5.4165   94.571   3.1552 -11.27325 6.268436 
1 1 1   22   16   18 o   83.406   2.7488  145.513   9.1255  141.761   14.910  147.760   11.539   82.440   4.3850   84.371   3.3160 -1.930801 5.497657 
1 1 1   22   16   19 o   68.398   3.3252   97.449   9.3621  102.425   13.776   93.178   12.762   70.002   4.7715   66.793   4.6325 3.209198 6.650343 
1 1 1   22   16   20 o  122.542   2.9343  314.453   14.352  308.763   23.335  317.916   18.201  121.461   4.6580  123.623   3.5698 -2.161751 5.868608 
1 1 1   22   16   21 o   67.968   3.3987   96.992   9.5189   97.806   13.783   96.250   13.162   68.216   4.8987   67.719   4.7125 0.4973907 6.797412 
1 1 1   22   16   22 o   55.848   3.9471   67.039   8.9031   52.724   12.762   80.610   12.426   49.777   6.2163   61.920   4.8657 -12.14317 7.894123 
1 1 1   22   16   23 o   20.556   5.7237   4.8694   7.4679  -1.3002   10.883   10.359   10.266   17.853   7.8014   23.259   8.3773 -5.406231 11.44731 
1 1 1   22   16   24 o   87.484   3.2884  161.003   11.843  155.041   17.066  166.541   16.448   85.861   4.8192   89.108   4.4755 -3.246582 6.576789 
1 1 1   22   16   25 o   28.231   6.1624   16.794   9.7457   30.196   12.264  -6.1707   16.054   36.409   8.3455   20.053   9.0695 16.35549 12.32489 
1 1 1   22   16   26 o   82.721   3.2587  143.463   11.088  157.679   16.346  131.345   15.092   86.508   4.5813   78.934   4.6357 7.573715 6.517481 
1 1 1   22   16   27 o   99.446   3.5789  209.710   14.316  209.823   18.347  209.536   22.890   99.785   4.4580   99.107   5.6000 0.6784821 7.157766 
1 1 1   22   16   28 o   91.026   6.2166  215.536   18.423  249.192   21.724  129.357   34.763  108.407   4.8587   73.646   11.445 34.76139 12.43323 
1 1 1   22   16   29 o   41.379   6.1603   39.941   10.186   44.066   14.517   35.942   14.296   43.713   8.3566   39.046   9.0535 4.667614 12.32061 
1 1 1   22   16   30 o   37.245   5.7602   32.394   8.5494   32.138   12.934   32.592   11.394   36.854   8.6563   37.635   7.6018 -0.7807121 11.52034 
1 1 1   22   16   31 o   31.603   6.0098   22.461   8.3452   34.946   12.797   13.223   11.008   38.537   8.2968   24.669   8.6969 13.86808 12.01970 
1 1 1   22   16   32 o   22.907   5.8292   8.2661   8.2909  -5.8512   12.268   20.133   11.248   16.885   7.7478   28.929   8.7114 -12.04436 11.65836 
1 1 1   22   16   33 o   36.643   8.1501   32.936   11.209   39.400   29.706   31.862   12.104   36.849   14.060   36.436   8.2466 0.4130135 16.30012 
1 1 1   22   16   34 o   36.334   8.0747   33.651   13.037   27.346   16.141   45.484   22.111   32.449   10.539   40.218   12.237 -7.769238 16.14939 
1 1 1   22   16   35 o   20.836   6.9436 -11.1035   15.409 -19.1378   24.568  -5.8937   19.783   20.719   9.9431   20.953   9.6948 -0.2333965 13.88720 
1 1 1   22   16   36 o   30.755   7.8082   26.515   13.173   31.863   15.711   13.857   24.171   34.340   10.285   27.170   11.751 7.169926 15.61647 
1 1 1   22   16   37 o   50.406   7.6448   76.509   14.556   85.159   17.316   55.675   26.875   60.345   6.9574   40.468   13.615 19.87713 15.28951 
1 1 1   22   16   38 f   45.027   8.3776   47.324   13.889   33.013   15.661  100.029   30.055   34.086   10.283   55.968   13.229 -21.88186 16.75524 
1 1 1   22   17    0 o   41.995   4.8791   39.396   10.982   39.396   10.982   39.396   10.982   41.995   6.9001   41.995   6.9001 0.000000 0.000000 
1 1 1   22   17    1 o  197.322   2.5969  805.755   21.131  792.158   29.561  819.963   30.219  195.622   3.6638  199.022   3.6814 -3.399994 5.193858 
1 1 1   22   17    2 o   71.603   2.8573  106.705   8.2922  103.511   12.883  108.964   10.835   70.652   4.4211   72.555   3.6207 -1.903152 5.714526 
1 1 1   22   17    3 o   22.337   5.1291   9.6032   5.6515   14.339   8.0498   4.9999   7.9364   25.819   7.2573   18.855   7.2500 6.963255 10.25823 
1 1 1   22   17    4 o   51.057   3.1606   53.895   6.5486   68.027   9.6227   41.704   8.9376   57.297   4.0719   44.818   4.8351 12.47884 6.321273 
1 1 1   22   17    5 o  166.144   2.1638  570.539   14.824  557.055   20.695  584.747   21.244  164.130   3.0572  168.159   3.0631 -4.029144 4.327679 
1 1 1   22   17    6 o  135.258   2.1526  378.309   12.008  379.796   17.010  376.831   16.955  135.523   3.0432  134.993   3.0452 0.5301666 4.305134 
1 1 1   22   17    7 o  113.134   2.1983  264.646   10.255  272.786   14.629  256.779   14.381  114.846   3.0884  111.422   3.1294 3.424873 4.396698 
1 1 1   22   17    8 o   84.904   2.4018  149.159   8.4042  141.207   11.776  157.413   11.998   82.592   3.4570   87.215   3.3353 -4.622192 4.803672 
1 1 1   22   17    9 o  219.476   2.5072  996.363   22.398  1005.62   34.664  989.728   29.347  220.275   3.8154  218.676   3.2538 1.598938 5.014449 
1 1 1   22   17   10 o  114.731   2.6947  272.743   12.745  266.643   17.694  279.319   18.374  113.403   3.7831  116.058   3.8385 -2.655006 5.389389 
1 1 1   22   17   11 o   98.015   2.8293  198.715   11.405  178.830   15.668  221.126   16.634   92.803   4.0935  103.227   3.9069 -10.42402 5.658644 
1 1 1   22   17   12 o   30.621   5.3140   21.168   7.1210   10.980   10.973   28.580   9.3595   24.315   8.6712   36.927   6.1453 -12.61209 10.62803 
1 1 1   22   17   13 o   55.169   4.0168   63.511   9.1214   60.902   12.429   66.557   13.428   53.958   5.5847   56.379   5.7748 -2.421719 8.033559 
1 1 1   22   17   14 o   62.651   3.3413   81.762   8.6090   82.951   12.706   80.753   11.705   63.048   4.8864   62.254   4.5587 0.7932167 6.682697 
1 1 1   22   17   15 o   38.816   4.7738   34.631   6.8339   26.217   11.613   39.088   8.4523   34.359   8.2902   43.273   4.7358 -8.914246 9.547516 
1 1 1   22   17   16 o   71.893   3.4042  107.774   8.9128  108.588   17.297  107.479   10.400   71.852   5.8369   71.935   3.5052 -0.8320618E-01 6.808494 
1 1 1   22   17   17 o   46.572   4.8663   48.680   7.6330   42.694   15.194   50.701   8.8278   43.836   8.7111   49.309   4.3407 -5.473377 9.732646 
1 1 1   22   17   18 o  101.872   2.5880  217.790   10.590  206.398   16.775  225.339   13.655   99.535   4.0863  104.210   3.1771 -4.675735 5.176053 
1 1 1   22   17   19 o   52.686   3.9181   59.400   8.3764   49.609   12.204   68.119   11.517   48.394   6.1145   56.978   4.9010 -8.584103 7.836250 
1 1 1   22   17   20 o   70.720   3.8195  104.911   10.526  107.583   18.221  103.573   12.896   71.130   6.2110   70.310   4.4471 0.8194885 7.638907 
1 1 1   22   17   21 o   53.299   5.2117   67.151   9.7408   49.434   17.191   75.529   11.822   46.646   9.2624   59.953   4.7808 -13.30684 10.42345 
1 1 1   22   17   22 o   35.397   5.4659   27.958   7.7389   30.203   11.450   26.070   10.500   36.701   7.8043   34.092   7.6550 2.608925 10.93188 
1 1 1   22   17   23 o   68.524   3.4414   99.399   9.6283   83.485   13.612  115.333   13.621   62.890   5.2478   74.158   4.4533 -11.26801 6.882703 
1 1 1   22   17   24 o   43.384   5.0435   41.473   8.7425   35.806   12.407   47.062   12.321   39.912   7.8164   46.856   6.3757 -6.944721 10.08694 
1 1 1   22   17   25 f  135.590   4.1831  387.762   21.121  381.022   24.924  404.931   39.780  134.531   4.4919  136.650   7.0581 -2.119202 8.366239 
1 1 1   22   17   26 f   22.761   5.9868   9.0936   7.8533   2.4872   12.037   13.990   10.363   20.101   8.4800   25.422   8.4532 -5.320839 11.97360 
1 1 1   22   17   27 o   25.741   6.2482   14.282   8.0184   12.735   12.038   15.516   10.750   25.060   9.0650   26.422   8.6014 -1.361856 12.49631 
1 1 1   22   17   28 o  103.726   2.9793  225.786   12.691  198.467   17.349  257.237   18.614   96.940   4.3391  110.512   4.0838 -13.57219 5.958594 
1 1 1   22   17   29 o   78.710   3.6251  131.940   11.669  127.311   15.421  138.142   17.849   77.262   4.8392   80.158   5.3988 -2.895744 7.250137 
1 1 1   22   17   30 o   65.512   3.7744   93.644   10.042   78.467   14.562  107.406   13.866   60.087   5.8757   70.936   4.7394 -10.84865 7.548881 
1 1 1   22   17   31 o   52.247   4.6216   61.867   9.6782   50.153   14.405   71.505   13.067   47.113   7.4132   57.382   5.5211 -10.26881 9.243269 
1 1 1   22   17   32 f   35.741   7.0782   32.199   10.244   32.444   19.296   32.103   12.087   34.890   11.532   36.592   8.2108 -1.702343 14.15636 
1 1 1   22   17   33 o   23.617   7.1934   1.8220   13.358 -11.3830   18.393   16.562   19.432   19.374   9.0905   27.860   11.151 -8.486124 14.38686 
1 1 1   22   17   34 o   56.852   6.5538   86.061   12.860   96.124   15.469   63.548   23.138   65.918   5.6899   47.786   11.808 18.13182 13.10763 
1 1 1   22   17   35 o   35.336   7.9827   35.236   17.830 -15.3861   30.170   62.406   22.103   23.294   11.136   47.378   11.440 -24.08342 15.96533 
1 1 1   22   17   36 o   18.669   6.3181 -12.1347   12.503 -11.1846   14.817 -14.4839   23.299   16.810   7.9697   20.528   9.8059 -3.718325 12.63614 
1 1 1   22   17   37 o   36.834   8.3470   35.382   13.142   25.681   15.315   62.487   25.600   30.223   10.277   43.445   13.156 -13.22196 16.69397 
1 1 1   22   18    0 o   96.271   2.7512  192.504   15.391  192.504   15.391  192.504   15.391   96.271   3.8908   96.271   3.8908 0.000000 0.000000 
1 1 1   22   18    1 o  184.657   2.5635  705.979   19.523  700.678   27.485  711.377   27.736  183.958   3.6226  185.356   3.6281 -1.398056 5.126988 
1 1 1   22   18    2 o  125.975   2.3564  329.323   12.114  335.112   16.085  321.739   18.412  127.290   3.0638  124.659   3.5811 2.631859 4.712881 
1 1 1   22   18    3 o  143.167   2.1396  423.909   12.634  424.184   17.913  423.635   17.821  143.213   3.0327  143.122   3.0190 0.9082031E-01 4.279204 
1 1 1   22   18    4 o   88.508   2.3604  162.147   8.6157  160.312   12.220  163.960   12.149   88.008   3.3666   89.009   3.3094 -1.000984 4.720791 
1 1 1   22   18    5 o  150.562   2.1571  468.785   13.392  455.913   18.756  482.175   19.129  148.452   3.0632  152.671   3.0379 -4.219742 4.314188 
1 1 1   22   18    6 o  102.620   2.2411  217.953   9.4850  221.188   13.446  214.749   13.382  103.380   3.1535  101.860   3.1853 1.519501 4.482261 
1 1 1   22   18    7 o  116.301   2.1803  279.931   10.457  273.606   14.725  286.367   14.853  114.973   3.1052  117.629   3.0615 -2.656769 4.360594 
1 1 1   22   18    8 o   85.849   2.5983  151.584   8.9224  157.850   14.645  147.885   11.252   87.195   4.0721   84.503   3.2284 2.691643 5.196603 
1 1 1   22   18    9 o  144.398   2.3218  434.836   13.494  418.264   21.354  445.853   17.411  142.015   3.6457  146.780   2.8761 -4.764648 4.643569 
1 1 1   22   18   10 o   51.975   3.6269   57.055   7.5607   53.126   11.957   59.673   9.7596   50.388   5.7533   53.562   4.4179 -3.173592 7.253805 
1 1 1   22   18   11 o   92.510   2.7415  177.325   10.427  182.623   15.467  172.913   14.116   93.753   4.0001   91.268   3.7500 2.485344 5.482997 
1 1 1   22   18   12 o   31.385   5.0968   18.794   7.0599   36.874   11.315   7.2679   9.0342   41.836   6.5573   20.933   7.8046 20.90349 10.19363 
1 1 1   22   18   13 o  106.709   2.9262  238.171   12.781  248.298   17.283  225.947   18.989  109.294   3.8340  104.123   4.4216 5.170792 5.852337 
1 1 1   22   18   14 o  123.086   2.4261  317.813   12.026  298.427   18.861  331.094   15.611  119.791   3.8176  126.381   2.9949 -6.589951 4.852134 
1 1 1   22   18   15 o  130.903   2.3776  352.103   12.452  370.568   20.474  341.262   15.687  133.501   3.7183  128.305   2.9643 5.196487 4.755282 
1 1 1   22   18   16 o   77.480   3.2102  121.996   9.1690  132.795   17.786  118.087   10.700   79.553   5.4207   75.407   3.4405 4.146790 6.420356 
1 1 1   22   18   17 o  136.435   2.4489  390.530   13.546  365.218   20.790  409.201   17.856  132.446   3.8058  140.424   3.0830 -7.977737 4.897897 
1 1 1   22   18   18 o   98.265   2.6410  204.780   10.361  185.986   16.454  217.127   13.337   94.316   4.2298  102.215   3.1635 -7.898811 5.281989 
1 1 1   22   18   19 f   27.974   5.9111   16.740   7.4774   22.916   11.189   11.757   10.051   31.857   8.3970   24.092   8.3218 7.764990 11.82214 
1 1 1   22   18   20 o   20.843   6.0742   2.2913   7.9422   9.6896   14.312  -1.0009   9.5471   24.845   9.6848   16.840   7.3341 8.005323 12.14845 
1 1 1   22   18   21 o  114.925   3.0571  278.676   14.027  268.641   22.668  284.902   17.856  112.996   4.8640  116.854   3.7048 -3.857574 6.114231 
1 1 1   22   18   22 o   46.126   4.8834   45.635   9.1878   45.350   12.122   46.021   14.085   46.091   6.3766   46.161   7.3980 -0.6954956E-01 9.766830 
1 1 1   22   18   23 o  139.163   3.0166  406.257   17.304  397.968   23.974  415.272   25.001  137.708   4.2210  140.618   4.3108 -2.909637 6.033237 
1 1 1   22   18   24 o   80.444   3.9684  144.965   12.368  167.152   15.895  110.922   19.690   89.173   4.3219   71.715   6.6568 17.45802 7.936709 
1 1 1   22   18   25 o   57.629   4.8224   72.598   11.299   76.498   15.063   67.579   17.088   59.688   6.1186   55.570   7.4554 4.117825 9.644719 
1 1 1   22   18   26 o   28.362   6.1198   18.553   8.1929   10.979   12.488   24.277   10.856   24.272   9.1508   32.452   8.1282 -8.180159 12.23952 
1 1 1   22   18   27 o   28.448   6.3926   19.002   8.5399   12.832   14.573   22.230   10.539   25.917   9.8576   30.980   8.1417 -5.063585 12.78512 
1 1 1   22   18   28 o   88.822   3.2470  168.147   11.856  159.763   17.180  175.771   16.383   86.573   4.8114   91.071   4.3615 -4.498474 6.494056 
1 1 1   22   18   29 o   29.230   7.0189   19.843   9.6810   19.265   17.521   20.097   11.615   29.314   10.881   29.147   8.8693 0.1674023 14.03771 
1 1 1   22   18   30 o   95.772   3.3675  196.048   13.095  193.984   17.056  199.010   20.436   95.468   4.3317   96.076   5.1572 -0.6076202 6.735056 
1 1 1   22   18   31 o   53.671   4.2445   63.331   9.3833   67.532   13.671   59.589   12.902   55.359   5.9875   51.984   6.0177 3.374413 8.488997 
1 1 1   22   18   32 o   34.285   6.2713   29.208   9.2202   20.431   13.170   37.645   12.913   28.871   9.5261   39.699   8.1590 -10.82809 12.54261 
1 1 1   22   18   33 o   33.810   7.4980   24.567   14.068  -0.7878   18.803   56.802   21.202   21.860   9.8576   45.759   11.301 -23.89902 14.99592 
1 1 1   22   18   34 o   18.206   5.9630  -7.9395   11.021   1.6645   13.066 -31.6225   20.517   19.473   8.5275   16.939   8.3373 2.534361 11.92602 
1 1 1   22   18   35 o   48.844   7.3866   65.757   13.844   69.563   16.880   57.936   24.196   54.229   7.5468   43.459   12.700 10.76972 14.77329 
1 1 1   22   18   36 f   28.934   7.3975   22.017   13.881   38.001   17.275  -7.1032   23.317   36.319   10.764   21.549   10.150 14.76967 14.79507 
1 1 1   22   18   37 o   39.735   8.2398   47.991   13.902   47.169   16.622   49.905   25.359   41.544   9.8506   37.926   13.211 3.617950 16.47956 
1 1 1   22   19    0 o  230.497   2.7312  1099.79   36.697  1099.79   36.697  1099.79   36.697  230.497   3.8626  230.497   3.8626 0.000000 0.000000 
1 1 1   22   19    1 o  151.626   2.5205  476.428   15.761  469.039   22.125  484.040   22.457  150.432   3.5660  152.819   3.5629 -2.387375 5.040910 
1 1 1   22   19    2 o   88.963   2.5414  163.272   9.2145  159.121   12.066  169.081   14.273   87.644   3.3378   90.281   3.8331 -2.637009 5.082733 
1 1 1   22   19    3 o   56.856   2.9042   67.182   6.8045   64.904   9.7073   69.383   9.5409   55.898   4.2106   57.815   4.0011 -1.917233 5.808437 
1 1 1   22   19    4 o  111.710   2.1809  258.383   10.048  255.765   14.218  260.995   14.202  111.143   3.1016  112.278   3.0668 -1.135765 4.361779 
1 1 1   22   19    5 o   15.487   4.6393  -0.0814   5.2179   2.6764   7.4191  -2.7806   7.3399   16.930   6.8499   14.043   6.2586 2.887653 9.278541 
1 1 1   22   19    6 o  115.816   2.1683  277.753   10.357  276.366   14.672  279.131   14.623  115.526   3.0793  116.106   3.0537 -0.5803986 4.336673 
1 1 1   22   19    7 o   28.406   4.8244   17.536   5.6717   22.945   8.2138   12.606   7.8412   32.529   6.3502   24.284   7.2646 8.245045 9.648793 
1 1 1   22   19    8 o  120.920   2.3552  303.037   11.460  303.389   18.340  302.812   14.679  120.909   3.6777  120.931   2.9431 -0.2217102E-01 4.710343 
1 1 1   22   19    9 o  119.374   2.4526  293.746   11.950  308.207   18.450  283.294   15.686  121.847   3.6712  116.901   3.2532 4.945595 4.905205 
1 1 1   22   19   10 o   75.289   2.8415  117.266   8.7169  121.762   13.521  114.068   11.403   76.474   4.2869   74.103   3.7308 2.370239 5.682986 
1 1 1   22   19   11 o   39.766   4.5290   33.111   7.3876   35.641   11.176   31.148   9.8451   41.079   6.5965   38.454   6.2074 2.624859 9.057918 
1 1 1   22   19   12 o   62.879   3.3944   84.573   8.5909   69.101   12.783   97.316   11.601   57.399   5.3997   68.358   4.1148 -10.95808 6.788820 
1 1 1   22   19   13 o  113.048   2.8632  266.719   13.255  271.471   17.812  260.821   19.844  114.249   3.7801  111.847   4.3016 2.402588 5.726480 
1 1 1   22   19   14 o   36.310   5.1138   29.757   7.3589   22.060   11.226   35.556   9.7447   31.498   8.4613   41.123   5.7453 -9.625034 10.22753 
1 1 1   22   19   15 o  157.173   2.7703  519.947   16.749  498.803   29.270  530.241   20.424  154.486   4.5938  159.861   3.0976 -5.374802 5.540619 
1 1 1   22   19   16 o   57.391   3.8499   65.067   7.9999   78.786   16.317   60.725   9.1788   60.859   6.5003   53.923   4.1271 6.935616 7.699834 
1 1 1   22   19   17 o   72.081   3.0442  110.512   8.6069  102.733   14.332  114.900   10.764   69.888   4.9722   74.275   3.5137 -4.386940 6.088387 
1 1 1   22   19   18 o   65.221   3.4024   90.412   9.0026   82.724   13.669   96.302   11.964   62.616   5.2930   67.826   4.2767 -5.210087 6.804798 
1 1 1   22   19   19 o  107.460   2.9016  244.032   12.675  224.245   19.149  259.459   16.908  103.394   4.4905  111.527   3.6758 -8.133560 5.803108 
1 1 1   22   19   20 o   58.926   4.3057   73.933   9.8521   73.637   17.034   74.081   12.077   58.528   7.0563   59.324   4.9360 -0.7954292 8.611350 
1 1 1   22   19   21 o   35.613   5.6718   34.667   9.0958   3.5241   16.443   48.397   10.918   23.431   9.8994   47.794   5.5388 -24.36393 11.34359 
1 1 1   22   19   22 o  117.009   2.7001  286.535   13.019  286.173   18.800  286.869   18.047  116.901   3.8991  117.116   3.7360 -0.2149811 5.400124 
1 1 1   22   19   23 o   38.010   5.5298   32.436   8.3664   36.731   12.365   28.810   11.362   40.412   7.6999   35.608   7.9389 4.804085 11.05956 
1 1 1   22   19   24 o   27.937   6.9440   16.744   9.8208   17.398   12.646   15.751   15.589   28.014   9.3392   27.860   10.279 0.1534958 13.88796 
1 1 1   22   19   25 o   43.224   5.3488   40.592   8.9916   46.086   15.105   37.576   11.190   44.806   8.4846   41.642   6.5152 3.163586 10.69754 
1 1 1   22   19   26 o   57.688   4.5751   73.813   10.320   67.026   17.084   77.714   12.951   55.034   7.5265   60.342   5.2036 -5.308350 9.150143 
1 1 1   22   19   27 o   72.368   3.5914  112.159   10.617  111.301   16.116  112.816   14.112   71.935   5.4319   72.801   4.6998 -0.8661957 7.182888 
1 1 1   22   19   28 f   54.423   4.1440   65.048   9.1813   56.694   13.437   72.364   12.574   50.839   6.4085   58.008   5.2557 -7.169048 8.287968 
1 1 1   22   19   29 o   42.194   5.2667   40.771   8.8839   39.569   13.302   41.739   11.936   41.013   8.1512   43.376   6.6717 -2.363194 10.53347 
1 1 1   22   19   30 o   44.453   5.6089   46.261   9.9815   47.411   13.471   44.861   14.863   45.774   7.1354   43.132   8.6559 2.641628 11.21781 
1 1 1   22   19   31 o   53.719   4.4683   64.761   9.7614   54.661   14.065   74.148   13.558   49.247   6.9246   58.190   5.6493 -8.943417 8.936692 
1 1 1   22   19   32 o   46.468   6.5696   46.043   11.761   31.720   13.978   80.763   21.763   35.329   9.4203   57.608   9.1595 -22.27858 13.13915 
1 1 1   22   19   33 o   29.397   7.7177   19.358   14.004   0.7511   19.892   37.641   19.718   22.503   10.144   36.291   11.634 -13.78795 15.43545 
1 1 1   22   19   34 o   27.042   7.5976   17.477   12.453   18.620   15.418   15.333   21.122   27.244   10.188   26.841   11.273 0.4026604 15.19511 
1 1 1   22   19   35 o   24.331   7.1764  -3.6755   12.584 -21.8991   15.212   35.824   22.396   14.988   7.3365   33.673   12.336 -18.68529 14.35272 
1 1 1   22   19   36 o   30.106   8.1965   25.285   13.854   19.181   17.217   36.500   23.336   26.916   10.585   33.296   12.518 -6.380077 16.39307 
1 1 1   22   20    0 o   12.388   5.6514   0.0518   9.4877   0.0518   9.4877   0.0518   9.4877   12.388   7.9923   12.388   7.9923 0.000000 0.000000 
1 1 1   22   20    1 o   86.614   2.8199  155.968   10.064  148.346   14.256  163.539   14.208   84.487   4.0911   88.742   3.8819 -4.255173 5.639727 
1 1 1   22   20    2 o  112.646   2.3969  261.927   10.992  256.087   14.360  270.190   17.083  111.181   3.1315  114.112   3.6296 -2.930756 4.793800 
1 1 1   22   20    3 o  146.837   2.1360  446.568   12.936  446.478   18.347  446.656   18.241  146.820   3.0299  146.853   3.0116 -0.3311157E-01 4.271960 
1 1 1   22   20    4 f   38.415   3.7625   30.978   5.9338   28.032   8.4829   33.800   8.3033   36.590   5.6211   40.241   5.0029 -3.651302 7.525008 
1 1 1   22   20    5 f  140.464   2.1451  408.749   12.428  408.633   17.566  408.864   17.584  140.445   3.0325  140.484   3.0348 -0.3923035E-01 4.290287 
1 1 1   22   20    6 o   49.411   3.1028   50.846   6.3215   50.953   9.0481   50.745   8.8357   49.456   4.4358   49.366   4.3396 0.9054184E-01 6.205506 
1 1 1   22   20    7 o   53.440   3.4151   61.192   7.1885   53.834   11.664   65.699   9.1279   50.671   5.5812   56.210   3.9373 -5.538807 6.830223 
1 1 1   22   20    8 o   97.171   2.4725  194.109   9.6831  205.035   15.617  187.286   12.342   99.308   3.8129   95.034   3.1487 4.273407 4.944937 
1 1 1   22   20    9 o   33.539   4.8590   22.409   6.5397   35.810   10.792   14.633   8.2208   41.191   6.3526   25.887   7.3543 15.30416 9.718090 
1 1 1   22   20   10 o   71.579   2.8652  106.600   8.2525  107.105   13.217  106.277   10.565   71.642   4.4731   71.516   3.5817 0.1261826 5.730385 
1 1 1   22   20   11 o   66.697   3.0089   93.251   7.9682   90.710   13.087   94.749   10.045   65.871   4.8172   67.523   3.6067 -1.651817 6.017783 
1 1 1   22   20   12 o   94.071   3.0427  184.889   11.732  188.083   15.817  180.981   17.492   95.039   4.0350   93.104   4.5552 1.934853 6.085303 
1 1 1   22   20   13 o   61.500   3.8586   80.264   9.6825   86.897   13.154   72.421   14.304   64.402   4.9522   58.597   5.9187 5.805237 7.717188 
1 1 1   22   20   14 o   48.730   3.9077   49.372   7.7752   55.084   12.078   45.329   10.160   51.061   5.7352   46.399   5.3093 4.661953 7.815413 
1 1 1   22   20   15 o   97.062   3.1737  200.053   11.980  189.225   20.401  205.752   14.800   94.758   5.2199   99.366   3.6112 -4.608376 6.347319 
1 1 1   22   20   16 o   72.036   3.3453  113.656   8.9384   97.684   16.105  120.766   10.745   67.910   5.7500   76.161   3.4207 -8.250328 6.690602 
1 1 1   22   20   17 o   53.928   3.5731   61.013   7.5246   62.064   12.948   60.477   9.2461   54.095   5.8034   53.760   4.1700 0.3350601 7.146176 
1 1 1   22   20   18 o   76.924   2.9344  125.432   8.8253  118.576   14.868  129.162   10.966   75.091   4.8005   78.757   3.3760 -3.666077 5.868768 
1 1 1   22   20   19 o   73.090   3.1710  112.214   9.5437  108.689   13.748  115.491   13.259   71.939   4.6336   74.241   4.3301 -2.302025 6.341928 
1 1 1   22   20   20 o   62.279   4.0386   81.477   9.9828   86.171   16.728   78.880   12.441   63.417   6.3955   61.141   4.9335 2.275604 8.077272 
1 1 1   22   20   21 o   69.512   4.0401  102.107   10.800  105.569   19.196  100.504   13.064   69.962   6.6523   69.062   4.5865 0.9001236 8.080141 
1 1 1   22   20   22 o   40.745   6.0129   36.600   9.1988   39.781   16.925   35.266   10.959   41.045   10.073   40.446   6.5692 0.5982056 12.02571 
1 1 1   22   20   23 o   25.442   6.1896   13.262   7.7768   17.195   12.242   10.601   10.070   27.788   9.1853   23.096   8.2991 4.691639 12.37923 
1 1 1   22   20   24 o   26.687   6.5440   15.093   9.3489   21.578   12.139   5.6378   14.657   30.490   9.0200   22.883   9.4835 7.607304 13.08810 
1 1 1   22   20   25 f   76.723   3.3104  125.121   10.424  122.580   15.425  127.258   14.143   75.888   4.9281   77.558   4.4213 -1.670372 6.620708 
1 1 1   22   20   26 o   95.406   3.9255  197.771   13.701  192.483   26.023  199.800   16.116   93.530   6.7458   97.282   4.0166 -3.751984 7.851031 
1 1 1   22   20   27 o   56.681   4.2038   69.461   9.7887   74.951   14.662   65.046   13.148   58.629   6.0632   54.733   5.8245 3.896538 8.407590 
1 1 1   22   20   28 o   71.262   3.4750  109.245   10.186  105.870   14.805  112.278   14.036   70.093   5.1212   72.430   4.6985 -2.336990 6.950044 
1 1 1   22   20   29 o   22.424   6.0263   7.7503   7.8645   17.144   12.560   1.6923   10.086   26.956   9.3031   17.892   7.6627 9.064054 12.05256 
1 1 1   22   20   30 o   65.728   4.0870   95.257   11.002   99.352   14.947   90.415   16.254   67.553   5.3648   63.903   6.1671 3.649673 8.174026 
1 1 1   22   20   31 o   29.669   6.3080   21.065   8.7991   31.300   12.930   12.238   12.008   35.473   8.8631   23.865   8.9783 11.60761 12.61606 
1 1 1   22   20   32 o   26.480   7.0359   16.971   10.832   21.874   12.895   5.2183   19.964   29.234   9.4122   23.726   10.461 5.507639 14.07183 
1 1 1   22   20   33 f   24.645   7.4392   10.035   13.380   11.410   18.642   8.5737   19.215   25.014   10.553   24.275   10.488 0.7388210 14.87848 
1 1 1   22   20   34 o   28.892   7.5863   19.397   12.439   7.7183   15.931   37.631   19.907   22.537   9.6406   35.247   11.716 -12.71004 15.17255 
1 1 1   22   20   35 o   25.804   7.3012   16.334   12.549   23.185   15.100   1.0319   22.565   28.857   10.185   22.750   10.464 6.107288 14.60241 
1 1 1   22   21    0 o  109.041   2.6213  246.982   16.628  246.982   16.628  246.982   16.628  109.041   3.7070  109.041   3.7070 0.000000 0.000000 
1 1 1   22   21    1 o   73.669   3.0120  113.000   9.1479  108.531   12.791  117.680   13.088   72.172   4.2971   75.166   4.2217 -2.994011 6.023912 
1 1 1   22   21    2 o   48.991   3.4211   49.225   6.8335   44.322   8.8810   56.342   10.699   46.076   4.6732   51.905   4.9978 -5.828072 6.842294 
1 1 1   22   21    3 o  137.036   2.1369  389.270   12.078  392.745   17.133  385.837   17.027  137.645   3.0180  136.427   3.0261 1.217911 4.273822 
1 1 1   22   21    4 o  117.224   2.1620  284.912   10.453  286.410   14.816  283.428   14.749  117.531   3.0565  116.918   3.0586 0.6138229 4.324010 
1 1 1   22   21    5 o  109.255   2.2154  247.483   9.9796  238.542   13.974  256.791   14.257  107.237   3.1594  111.274   3.1065 -4.037148 4.430810 
1 1 1   22   21    6 o  125.727   2.3352  326.889   11.804  333.480   19.023  322.762   15.053  126.667   3.6412  124.788   2.9247 1.878922 4.670373 
1 1 1   22   21    7 o  117.317   2.4115  289.451   11.395  267.163   17.768  305.025   14.852  113.334   3.8010  121.301   2.9686 -7.966583 4.822910 
1 1 1   22   21    8 o   66.832   3.0206   91.095   8.1893  104.082   13.090   82.744   10.497   70.623   4.4941   63.041   4.0373 7.582191 6.041245 
1 1 1   22   21    9 o  174.632   2.5154  634.154   18.099  620.132   25.997  647.343   25.214  172.723   3.6493  176.541   3.4628 -3.818298 5.030740 
1 1 1   22   21   10 o   48.580   3.9975   51.210   7.7299   41.822   11.880   58.102   10.179   44.446   6.4809   52.715   4.6818 -8.268940 7.995077 
1 1 1   22   21   11 o   81.117   2.7156  135.249   8.7284  143.749   14.719  130.639   10.840   82.949   4.3023   79.285   3.3150 3.664703 5.431244 
1 1 1   22   21   12 o   69.758   3.5729  105.356   9.7745   91.394   15.921  113.802   12.383   65.700   5.8753   73.815   4.0675 -8.115013 7.145826 
1 1 1   22   21   13 o   29.881   5.6433   20.375   7.1097   16.824   11.063   22.874   9.2799   27.710   8.6949   32.052   7.1961 -4.341988 11.28652 
1 1 1   22   21   14 o   34.309   5.0668   33.802   7.9760  -2.6970   14.659   49.153   9.5064   20.247   8.9434   48.372   4.7650 -28.12422 10.13358 
1 1 1   22   21   15 o   52.772   4.1306   63.397   8.3114   42.588   12.944   77.997   10.842   44.520   7.0492   61.023   4.3076 -16.50354 8.261132 
1 1 1   22   21   16 o   18.828   5.1903   4.8633   6.0214  -4.0262   11.107   8.5630   7.1657   17.036   7.6381   20.619   7.0298 -3.583071 10.38068 
1 1 1   22   21   17 o   71.983   3.0416  109.891   8.6101  103.837   14.325  113.316   10.773   70.231   4.9452   73.734   3.5426 -3.502815 6.083167 
1 1 1   22   21   18 o   26.917   4.9928   18.909   6.9026 -10.1028   15.002   26.700   7.7744   18.304   8.4598   35.531   5.3052 -17.22668 9.985599 
1 1 1   22   21   19 o   46.113   4.3912   44.417   8.2400   55.577   12.810   36.541   10.762   50.961   6.0948   41.264   6.3233 9.696785 8.782394 
1 1 1   22   21   20 o   49.413   5.5537   61.366   9.4996   37.639   16.491   73.150   11.622   39.962   10.023   58.864   4.7869 -18.90190 11.10736 
1 1 1   22   21   21 o   81.284   3.6642  146.180   11.482  121.105   19.040  160.510   14.394   75.101   6.1470   87.468   3.9899 -12.36642 7.328369 
1 1 1   22   21   22 o   21.997   5.6624   7.3319   7.5836  -4.1358   11.446   16.305   10.125   17.110   7.7056   26.884   8.2990 -9.773588 11.32479 
1 1 1   22   21   23 o   52.599   4.1376   59.712   8.8891   57.297   13.361   61.631   11.907   51.474   6.2932   53.724   5.3736 -2.249630 8.275229 
1 1 1   22   21   24 o   87.662   3.0796  162.932   11.103  157.441   16.145  167.860   15.293   86.159   4.5433   89.165   4.1586 -3.005440 6.159188 
1 1 1   22   21   25 o   20.386   5.7291   5.1196   7.7155  -3.7745   12.099   11.215   10.016   17.570   7.9168   23.202   8.2834 -5.631292 11.45821 
1 1 1   22   21   26 o   64.659   3.9864   91.189   10.282   87.684   16.586   93.377   13.104   63.221   6.3609   66.097   4.8067 -2.876030 7.972805 
1 1 1   22   21   27 o   58.396   4.1547   73.000   9.8676   92.379   15.111   58.593   13.029   65.152   5.6234   51.640   6.1174 13.51186 8.309345 
1 1 1   22   21   28 o   29.837   6.2048   22.125   8.3572   16.322   12.841   26.389   11.008   26.519   9.3883   33.155   8.1153 -6.636278 12.40963 
1 1 1   22   21   29 o   38.163   5.5705   36.652   8.6166   20.607   12.965   49.347   11.532   28.986   9.4465   47.339   5.9064 -18.35299 11.14095 
1 1 1   22   21   30 o   25.009   6.2674   14.231   8.0567   17.006   12.210   12.091   10.722   26.589   9.1728   23.430   8.5428 3.159485 12.53472 
1 1 1   22   21   31 o   52.909   5.0700   62.684   10.866   49.814   14.093   81.551   17.063   46.247   7.3885   59.572   6.9448 -13.32501 10.14004 
1 1 1   22   21   32 o   21.223   6.6061   3.0285   10.698   2.2650   13.149   4.5233   18.398   19.657   8.5827   22.788   10.045 -3.131283 13.21225 
1 1 1   22   21   33 f   26.300   8.1663   8.5696   15.933   30.389   28.419  -1.4326   19.241   31.365   13.119   21.235   9.7287 10.13041 16.33264 
1 1 1   22   21   34 o   33.479   8.0978   31.509   13.218   22.423   16.542   47.555   21.984   28.374   10.564   38.584   12.275 -10.21084 16.19555 
1 1 1   22   22    0 o   54.199   3.7351   62.765   11.550   62.765   11.550   62.765   11.550   54.199   5.2822   54.199   5.2822 0.000000 0.000000 
1 1 1   22   22    1 o  138.740   2.3439  400.966   13.252  409.430   17.548  389.733   20.216  140.524   3.0277  136.955   3.5788 3.568253 4.687728 
1 1 1   22   22    2 o   60.172   3.0315   73.732   7.4044   66.241   9.4997   85.326   11.819   56.398   4.0839   63.946   4.4813 -7.547287 6.063033 
1 1 1   22   22    3 o   25.352   4.9925   14.052   5.4119   13.944   7.5461   14.165   7.7659   25.251   7.0016   25.454   7.1189 -0.2028160 9.985030 
1 1 1   22   22    4 o   39.355   3.6378   32.537   5.8693   36.843   8.3452   28.322   8.2565   41.977   4.8202   36.733   5.4497 5.243336 7.275504 
1 1 1   22   22    5 o   73.487   2.9895  112.554   9.0546  113.560   13.079  111.628   12.548   73.789   4.2974   73.185   4.1571 0.6038666 5.979015 
1 1 1   22   22    6 o   99.170   2.6783  205.346   10.917  193.105   15.787  216.564   15.112   96.282   3.9754  102.057   3.5903 -5.774849 5.356646 
1 1 1   22   22    7 o   36.623   5.3276   33.105   7.1860   20.254   13.193   38.525   8.5685   30.367   9.4899   42.879   4.8450 -12.51161 10.65513 
1 1 1   22   22    8 o  140.596   2.4309  413.934   13.973  386.106   20.747  437.039   18.904  136.148   3.6947  145.044   3.1600 -8.895889 4.861710 
1 1 1   22   22    9 o   73.554   2.8276  111.807   8.3321  117.791   13.651  108.254   10.519   75.008   4.4125   72.101   3.5373 2.907211 5.655255 
1 1 1   22   22   10 o   37.199   4.6497   30.883   6.4940   27.459   11.113   32.658   8.0027   34.986   7.8894   39.412   4.9231 -4.426090 9.299477 
1 1 1   22   22   11 o  129.557   2.3857  351.980   12.436  336.850   19.664  362.064   16.053  127.078   3.7518  132.035   2.9479 -4.957397 4.771385 
1 1 1   22   22   12 o   45.595   4.0909   42.990   7.5868   50.887   12.007   37.742   9.7885   48.960   5.9461   42.229   5.6200 6.731026 8.181709 
1 1 1   22   22   13 f  182.866   2.6381  697.820   19.892  678.390   28.069  717.427   28.196  180.283   3.7749  185.449   3.6863 -5.166046 5.276213 
1 1 1   22   22   14 o   45.674   4.7768   40.953   8.2039   54.230   15.950   36.177   9.5663   50.017   7.7318   41.331   5.6118 8.686012 9.553683 
1 1 1   22   22   15 o   65.208   4.3377   91.039   11.587   83.785   16.920   97.445   15.902   62.605   6.5528   67.812   5.6855 -5.207493 8.675433 
1 1 1   22   22   16 o   25.038   5.8394   12.622   6.8398   16.986   11.253   10.066   8.6137   27.752   8.7774   22.324   7.7041 5.427664 11.67887 
1 1 1   22   22   17 o   51.219   3.6697   55.261   7.3195   56.489   12.674   54.646   8.9660   51.423   5.9756   51.014   4.2613 0.4096680 7.339404 
1 1 1   22   22   18 o   68.522   3.3717  100.312   9.3856   90.159   14.082  108.426   12.589   65.202   5.2366   71.842   4.2487 -6.640663 6.743395 
1 1 1   22   22   19 o   35.183   5.4823   28.329   7.6740   26.190   11.801   29.895   10.101   33.742   8.4877   36.624   6.9412 -2.882305 10.96459 
1 1 1   22   22   20 o   49.368   5.2221   56.136   9.3570   48.354   16.468   59.847   11.371   45.685   9.0595   53.051   5.1968 -7.366138 10.44423 
1 1 1   22   22   21 o  115.009   4.4941  293.299   20.664  243.749   31.469  330.862   27.399  105.459   7.2348  124.558   5.3334 -19.09911 8.988215 
1 1 1   22   22   22 o  107.319   2.8316  242.721   12.418  239.841   18.810  244.947   16.534  106.601   4.2782  108.037   3.7105 -1.435776 5.663114 
1 1 1   22   22   23 o   61.007   4.2747   80.059   10.617   76.474   13.823   85.217   16.580   59.559   5.6270   62.454   6.4367 -2.895233 8.549484 
1 1 1   22   22   24 o   21.758   5.8407   8.5436   7.4415   2.7755   11.969   12.178   9.5009   19.865   8.4223   23.652   8.0944 -3.787821 11.68140 
1 1 1   22   22   25 o   24.288   6.2018   8.0945   8.0428   23.569   14.248   0.8582   9.7436   31.147   9.8796   17.429   7.4996 13.71772 12.40366 
1 1 1   22   22   26 o   23.364   5.9605   11.502   7.6983   4.8811   12.138   15.957   9.9572   20.639   8.5981   26.089   8.2573 -5.450106 11.92098 
1 1 1   22   22   27 o   29.533   6.3226   21.660   8.4638   17.335   13.383   24.544   10.927   27.162   9.5879   31.903   8.2445 -4.740860 12.64512 
1 1 1   22   22   28 o   55.634   4.1034   67.544   9.3801   75.395   13.959   61.078   12.666   58.575   5.7778   52.693   5.8281 5.882439 8.206720 
1 1 1   22   22   29 o   57.794   4.1951   75.743   9.7308   60.834   14.346   88.446   13.243   51.834   6.7106   63.754   5.0362 -11.92035 8.390172 
1 1 1   22   22   30 o   20.650   5.9693   6.3184   8.3069   0.2120   13.022   10.509   10.787   18.955   8.3980   22.346   8.4854 -3.391260 11.93851 
1 1 1   22   22   31 f   37.232   8.5236   42.136   13.249   43.361   13.872   29.408   44.708   41.919   8.3171   32.545   14.881 9.374115 17.04730 
1 1 1   22   22   32 o   20.549   6.3620   2.3735   10.806   9.9227   13.229 -12.7597   18.730   22.487   9.1298   18.611   8.8628 3.876554 12.72407 
1 1 1   22   22   33 o   37.057   8.2094   46.794   17.219   12.050   29.646   64.482   21.153   26.685   12.169   47.430   11.023 -20.74594 16.41890 
1 1 1   22   23    0 o  159.314   2.5355  526.731   23.534  526.731   23.534  526.731   23.534  159.314   3.5857  159.314   3.5857 0.000000 0.000000 
1 1 1   22   23    1 o   47.787   3.5536   46.408   6.8732   40.018   8.7514   56.695   11.104   43.664   4.8594   51.909   5.1863 -8.245045 7.107188 
1 1 1   22   23    2 o   85.063   2.7445  150.975   9.6108  151.628   13.212  150.240   14.007   85.290   3.7557   84.837   4.0030 0.4527893 5.489055 
1 1 1   22   23    3 o   82.031   2.3905  139.988   8.0837  145.975   11.502  134.144   11.364   83.775   3.3288   80.287   3.4316 3.488106 4.780910 
1 1 1   22   23    4 o  151.948   2.3648  483.391   14.662  456.734   22.054  504.506   19.628  148.059   3.6115  155.837   3.0538 -7.777481 4.729558 
1 1 1   22   23    5 o   80.388   2.6607  135.156   8.5860  133.107   13.768  136.460   10.983   79.781   4.1841   80.995   3.2879 -1.213837 5.321334 
1 1 1   22   23    6 o  106.581   2.4279  239.161   10.417  223.227   16.324  250.105   13.529  103.431   3.8266  109.731   2.9893 -6.300438 4.855800 
1 1 1   22   23    7 o   57.010   3.3398   69.291   7.6525   62.930   11.928   73.741   9.9765   54.621   5.2946   59.398   4.0723 -4.777473 6.679540 
1 1 1   22   23    8 o   64.081   2.9453   83.728   7.5437   94.543   12.596   77.679   9.4197   67.139   4.5488   61.023   3.7427 6.116333 5.890598 
1 1 1   22   23    9 o   39.363   4.1586   31.462   6.4928   38.092   11.162   28.071   7.9824   42.259   6.4038   36.467   5.3072 5.791664 8.317207 
1 1 1   22   23   10 o   67.443   3.4004   90.030   8.4125  108.221   16.788   83.930   9.7211   71.462   5.6958   63.424   3.7162 8.037842 6.800880 
1 1 1   22   23   11 o   87.884   3.3168  160.947   11.893  153.689   15.566  171.123   18.432   85.619   4.4081   90.150   4.9572 -4.530685 6.633626 
1 1 1   22   23   12 o   78.679   2.9795  130.059   9.5633  126.175   14.514  133.038   12.713   77.544   4.5382   79.815   3.8620 -2.270889 5.959008 
1 1 1   22   23   13 o   56.285   3.9975   67.276   7.9251   66.834   16.067   67.418   9.1106   55.764   6.9857   56.807   3.8885 -1.042740 7.994999 
1 1 1   22   23   14 o  112.651   2.6598  266.078   12.242  257.963   18.466  272.441   16.351  111.003   4.0334  114.299   3.4686 -3.295555 5.319690 
1 1 1   22   23   15 o   66.080   3.2894   93.241   8.8056   84.127   13.363  100.238   11.707   63.031   5.1401   69.130   4.1060 -6.098576 6.578721 
1 1 1   22   23   16 o   15.570   4.9134  -2.6012   6.3238  -7.6645   10.802   0.0390   7.8002   15.511   7.1723   15.629   6.7173 -0.1181126 9.826699 
1 1 1   22   23   17 o   79.151   2.8539  133.826   8.8056  123.638   14.821  139.384   10.947   76.544   4.6946   81.759   3.2464 -5.214874 5.707765 
1 1 1   22   23   18 o  101.419   2.8097  216.027   11.701  214.865   17.353  216.996   15.844  101.081   4.1624  101.757   3.7752 -0.6750107 5.619441 
1 1 1   22   23   19 o   74.886   3.1510  118.944   9.6813  110.580   14.083  126.438   13.331   72.270   4.7246   77.502   4.1705 -5.231094 6.301976 
1 1 1   22   23   20 o   20.968   5.8903   6.0878   7.8873  -6.7126   15.037   10.946   9.2639   18.985   8.6610   22.952   7.9857 -3.966749 11.78064 
1 1 1   22   23   21 o   33.039   6.2761   20.547   8.6396   43.441   16.018   11.155   10.260   42.741   9.3470   23.336   8.3781 19.40483 12.55221 
1 1 1   22   23   22 o   21.751   5.6567   8.1949   7.3214  -1.0762   11.297   14.909   9.6135   17.905   7.8829   25.596   8.1148 -7.690128 11.31332 
1 1 1   22   23   23 o   24.270   6.5076   10.985   8.9745   7.5454   11.969   15.403   13.564   21.969   8.7658   26.570   9.6206 -4.600733 13.01519 
1 1 1   22   23   24 o   65.399   4.0652   92.938   10.466   93.534   17.606   92.612   13.015   65.040   6.5631   65.757   4.7988 -0.7168045 8.130324 
1 1 1   22   23   25 o   19.723   5.7180   2.1624   7.6067   12.111   12.199  -4.1664   9.7299   24.097   9.0526   15.348   6.9881 8.749807 11.43606 
1 1 1   22   23   26 o   22.159   5.6334   7.5944   7.8547  -6.8307   11.819   19.006   10.512   16.204   7.4959   28.115   8.4115 -11.91113 11.26685 
1 1 1   22   23   27 o   18.564   5.6654  -1.7672   7.9638   9.2391   13.004  -8.3727   10.074   22.836   9.1283   14.291   6.7128 8.544839 11.33084 
1 1 1   22   23   28 o   37.755   5.6581   34.435   8.4836   34.641   12.825   34.274   11.312   37.518   8.4868   37.992   7.4853 -0.4745941 11.31619 
1 1 1   22   23   29 o   23.301   6.0025   11.023   8.4208  -0.8707   12.979   19.669   11.066   18.561   8.2937   28.041   8.6796 -9.479374 12.00509 
1 1 1   22   23   30 o   34.379   6.1602   31.027   9.0399   21.565   13.559   38.599   12.129   28.774   9.6705   39.983   7.6336 -11.20874 12.32037 
1 1 1   22   23   31 o   34.300   9.5864   28.060   13.051   24.444   13.573   72.354   47.505   30.087   9.6532   38.513   16.565 -8.425720 19.17289 
1 1 1   22   23   32 o   37.625   7.5317   43.785   13.045   52.107   16.289   28.902   21.783   44.563   9.1680   30.687   11.952 13.87605 15.06334 
1 1 1   22   24    0 o   45.137   4.3057   44.835   10.755   44.835   10.755   44.835   10.755   45.137   6.0892   45.137   6.0892 0.000000 0.000000 
1 1 1   22   24    1 o   45.189   3.6775   41.995   6.7226   37.973   8.5588   48.474   10.862   42.492   4.8836   47.885   5.4998 -5.392387 7.355084 
1 1 1   22   24    2 o   81.150   2.6553  136.133   8.7410  130.727   11.282  144.251   13.826   79.226   3.4526   83.074   4.0352 -3.847862 5.310648 
1 1 1   22   24    3 o   55.970   3.5195   66.852   8.0039   58.207   11.843   74.121   10.859   52.474   5.4721   59.466   4.4277 -6.991905 7.039032 
1 1 1   22   24    4 o   93.112   2.6733  181.574   10.195  175.048   15.184  186.932   13.757   91.510   4.0229   94.714   3.5217 -3.204300 5.346622 
1 1 1   22   24    5 o  114.035   2.4095  271.791   11.039  266.397   17.641  275.263   14.152  112.972   3.7862  115.099   2.9812 -2.127739 4.818986 
1 1 1   22   24    6 o  126.047   3.0224  333.309   15.661  301.580   22.082  365.421   22.215  119.913   4.4649  132.182   4.0748 -12.26846 6.044743 
1 1 1   22   24    7 o  151.935   2.7916  470.429   17.155  425.503   21.830  542.969   27.739  142.805   3.7063  161.065   4.1756 -18.25987 5.583211 
1 1 1   22   24    8 o   55.708   3.2564   65.073   7.1202   65.435   12.094   64.880   8.8087   55.674   5.2667   55.742   3.8314 -0.6761551E-01 6.512899 
1 1 1   22   24    9 o   69.016   2.8955   96.470   7.8830  110.379   13.621   89.464   9.6663   72.523   4.5537   65.509   3.5776 7.013382 5.790980 
1 1 1   22   24   10 o   41.315   3.9630   33.314   6.4033   45.681   11.522   27.787   7.7024   46.338   6.0285   36.292   5.1458 10.04617 7.925994 
1 1 1   22   24   11 o   39.963   4.6055   32.634   7.2129   45.944   11.935   24.976   9.0534   46.374   6.2399   33.552   6.7756 12.82131 9.211077 
1 1 1   22   24   12 o   95.889   2.6338  196.499   9.9283  177.058   16.301  207.964   12.518   91.815   4.3045   99.963   3.0363 -8.147781 5.267586 
1 1 1   22   24   13 f   64.185   4.3540  106.080   8.9162   57.426   16.989  124.576   10.475   51.078   8.0642   77.292   3.2858 -26.21405 8.707920 
1 1 1   22   24   15 o   63.372   3.4063   86.099   8.6919   78.373   13.479   91.599   11.372   60.711   5.3830   66.032   4.1757 -5.320568 6.812697 
1 1 1   22   24   16 o   46.828   4.0739   46.751   7.6507   47.780   12.394   46.118   9.7247   47.046   6.3873   46.611   5.0585 0.4355278 8.147786 
1 1 1   22   24   17 o   41.162   4.7710   38.288   7.5271   33.595   12.151   41.210   9.5881   38.349   7.9439   43.975   5.2864 -5.626629 9.542049 
1 1 1   22   24   18 o   63.789   3.4272   86.776   8.9368   82.553   13.356   90.200   12.025   62.240   5.2029   65.339   4.4623 -3.098442 6.854398 
1 1 1   22   24   19 o   46.880   4.3481   48.381   8.2314   42.778   12.485   52.689   10.948   44.164   6.8540   49.595   5.3521 -5.431053 8.696099 
1 1 1   22   24   20 o   21.985   5.7918   5.7551   7.5779   17.747   11.882  -2.4658   9.8382   27.743   9.0436   16.228   7.2382 11.51518 11.58351 
1 1 1   22   24   21 o   23.660   6.0300   11.184   8.4617  -6.0040   15.721   18.194   10.040   19.407   8.8545   27.913   8.1879 -8.506081 12.05999 
1 1 1   22   24   22 o   58.935   4.4229   75.055   10.598   69.994   13.705   82.582   16.716   56.713   5.8593   61.157   6.6270 -4.443302 8.845835 
1 1 1   22   24   23 o   25.553   6.0332   12.787   7.8802   24.300   12.367   4.9171   10.225   31.551   9.0396   19.555   7.9927 11.99628 12.06640 
1 1 1   22   24   24 o   34.728   6.2696   30.093   8.8127   27.103   14.973   31.678   10.901   32.670   10.093   36.787   7.4404 -4.116898 12.53930 
1 1 1   22   24   25 o   54.877   4.0921   66.552   9.1238   63.054   13.904   69.197   12.091   53.276   6.3275   56.477   5.1908 -3.200996 8.184228 
1 1 1   22   24   26 o   58.854   3.8569   75.816   9.2780   76.000   14.074   75.675   12.339   58.683   5.8149   59.024   5.0685 -0.3407478 7.713770 
1 1 1   22   24   27 o   30.046   6.2615   22.960   8.3107   20.282   12.965   24.827   10.828   28.353   9.4567   31.738   8.2097 -3.384409 12.52309 
1 1 1   22   24   28 o   18.610   5.7532   1.4469   8.2666  -0.0444   13.171   2.4162   10.619   18.937   8.4152   18.284   7.8472 0.6530228 11.50633 
1 1 1   22   24   29 o   57.941   4.1181   75.191   9.8193   77.553   14.453   73.165   13.382   58.662   5.9736   57.220   5.6702 1.442692 8.236261 
1 1 1   22   24   30 o   27.783   7.1846   20.700   10.615   21.664   13.183   18.922   17.901   28.469   9.5360   27.096   10.749 1.372360 14.36912 
1 1 1   22   24   31 o   32.563   6.7652   31.813   11.583   44.359   14.339   8.2536   19.649   41.503   8.6571   23.623   10.398 17.87999 13.53030 
1 1 1   22   25    0 o   25.819   7.4477   19.814   11.031   19.814   11.031   19.814   11.031   25.819   10.533   25.819   10.533 0.000000 0.000000 
1 1 1   22   25    1 o   40.033   5.4549   43.662   7.8900   54.881   9.4427   17.713   14.361   51.153   4.4757   28.912   9.9494 22.24176 10.90976 
1 1 1   22   25    2 o   36.748   5.6215   31.141   8.3303   36.685   10.884   23.302   12.943   41.468   6.3638   32.028   9.2686 9.440144 11.24298 
1 1 1   22   25    3 o  103.882   2.4182  223.342   10.101  231.114   16.323  218.518   12.860  105.230   3.7609  102.534   3.0409 2.695732 4.836466 
1 1 1   22   25    4 o   79.940   2.7009  135.555   8.5563  125.277   13.907  141.816   10.854   77.313   4.3613   82.567   3.1872 -5.254662 5.401765 
1 1 1   22   25    5 o  113.357   2.4711  267.385   11.429  270.710   17.537  264.930   15.069  113.884   3.7336  112.830   3.2381 1.054337 4.942147 
1 1 1   22   25    6 o  114.709   2.4705  274.592   11.543  272.503   17.738  276.126   15.202  114.230   3.7650  115.187   3.1998 -0.9572601 4.941055 
1 1 1   22   25    7 o   81.068   2.7587  139.104   8.9306  130.456   14.311  144.619   11.429   78.824   4.4020   83.312   3.3261 -4.488136 5.517302 
1 1 1   22   25    8 o  105.832   2.5756  236.123   11.113  216.656   16.595  251.950   14.963  101.718   3.9556  109.945   3.2997 -8.226486 5.151213 
1 1 1   22   25    9 o   40.304   4.5533   38.171   6.6539   27.940   11.281   43.630   8.2399   35.058   7.9809   45.551   4.3859 -10.49316 9.106624 
1 1 1   22   25   10 o   79.071   2.9710  133.916   9.4826  113.119   14.182  150.731   12.752   73.231   4.6955   84.912   3.6413 -11.68134 5.941981 
1 1 1   22   25   11 o   53.585   3.9221   65.195   8.0536   45.433   12.610   78.808   10.466   45.894   6.6620   61.276   4.1413 -15.38271 7.844241 
1 1 1   22   25   12 o   96.458   3.0238  193.827   10.593  199.369   20.732  191.869   12.322   96.951   5.1848   95.965   3.1132 0.9863129 6.047667 
1 1 1   22   25   13 o   25.926   5.1878   16.595   6.2241   4.4561   11.657   21.435   7.3613   20.688   8.5041   31.163   5.9442 -10.47506 10.37556 
1 1 1   22   25   14 o   37.745   4.8799   33.523   6.7326   26.392   11.872   36.903   8.1741   33.737   8.5279   41.754   4.7466 -8.016930 9.759821 
1 1 1   22   25   15 o   30.639   5.3211   19.024   6.4217   30.368   11.479   13.857   7.7474   36.442   7.8678   24.837   7.1661 11.60547 10.64212 
1 1 1   22   25   16 o   59.452   3.5463   76.121   8.4610   70.590   13.317   79.865   10.957   57.384   5.6267   61.520   4.3181 -4.135738 7.092671 
1 1 1   22   25   17 f   26.054   5.7888   13.740   6.7433   21.798   11.641   9.6710   8.2726   30.478   8.7813   21.630   7.5452 8.847515 11.57760 
1 1 1   22   25   18 o   27.566   6.4218   17.189   8.4967   14.176   11.580   20.702   12.506   25.500   8.9252   29.631   9.2358 -4.131287 12.84367 
1 1 1   22   25   19 o   20.199   5.4911   1.3585   7.1896   16.249   11.487  -8.2330   9.2188   26.691   8.9010   13.707   6.4329 12.98374 10.98226 
1 1 1   22   25   20 o   22.909   5.7776   9.7777   7.7124  -0.9237   11.799   17.761   10.191   18.268   8.0486   27.550   8.2910 -9.282515 11.55512 
1 1 1   22   25   21 o   56.830   4.4846   67.570   9.8527   82.133   17.901   61.241   11.801   60.478   7.1765   53.183   5.3800 7.295769 8.969191 
1 1 1   22   25   22 o   21.764   6.2714   6.3809   8.9431   2.2808   12.089   11.337   13.291   19.477   8.3664   24.050   9.3448 -4.573700 12.54277 
1 1 1   22   25   23 o   90.658   3.4672  181.715   12.393  159.428   19.952  195.715   15.813   85.348   5.6680   95.968   3.9951 -10.62048 6.934441 
1 1 1   22   25   24 o   20.928   5.6813   6.4994   7.7862  -5.9554   12.416   14.572   9.9960   16.861   7.7582   24.994   8.3019 -8.133213 11.36267 
1 1 1   22   25   25 o   36.386   5.6700   31.723   8.2552   35.603   12.351   28.590   11.099   38.409   8.0536   34.364   7.9833 4.044960 11.33993 
1 1 1   22   25   26 o   45.511   4.9087   48.731   8.7378   43.139   13.369   52.901   11.545   42.240   7.9661   48.783   5.7379 -6.543457 9.817432 
1 1 1   22   25   27 o   60.707   3.9094   80.778   9.6862   88.051   15.032   75.614   12.667   62.801   5.8034   58.612   5.2397 4.189068 7.818827 
1 1 1   22   25   28 o   26.981   6.4693   18.956   8.9329   12.093   14.380   23.269   11.399   23.881   9.5805   30.081   8.6961 -6.199942 12.93862 
1 1 1   22   25   29 o   33.522   6.2446   28.666   8.6885   35.300   13.566   24.052   11.314   36.645   9.0331   30.399   8.6244 6.245646 12.48910 
1 1 1   22   25   30 o   25.759   7.0983   16.694   10.630   16.525   13.268   16.996   17.761   25.435   9.4632   26.082   10.582 -0.6475353 14.19652 
1 1 1   22   26    0 o   9.6650   4.7165  -6.5164   8.9164  -6.5164   8.9164  -6.5164   8.9164   9.6650   6.6702   9.6650   6.6702 0.000000 0.000000 
1 1 1   22   26    1 o   65.086   3.2288   88.832   8.6442   98.358   12.660   80.513   11.831   68.363   4.4902   61.809   4.6409 6.553783 6.457536 
1 1 1   22   26    2 o   90.744   2.7276  172.397   10.187  172.453   14.898  172.348   13.960   90.713   3.9819   90.775   3.7286 -0.6164551E-01 5.455131 
1 1 1   22   26    3 o   50.538   3.5090   55.856   6.8405   48.249   11.499   60.022   8.5100   47.535   5.8653   53.541   3.8537 -6.006607 7.018015 
1 1 1   22   26    4 o   30.181   5.8351   19.069   6.4537   23.733   14.103   17.834   7.2583   32.065   9.7768   28.297   6.3725 3.768684 11.67023 
1 1 1   22   26    5 o   77.424   3.4486  133.184   9.8176  111.281   17.764  142.816   11.780   72.139   5.9705   82.709   3.4533 -10.57066 6.897213 
1 1 1   22   26    6 o   70.255   2.9016  103.286   8.1775  104.736   13.230  102.390   10.403   70.515   4.5489   69.995   3.6034 0.5203171 5.803223 
1 1 1   22   26    7 o   70.733   2.8902  106.736   7.9926   99.112   13.391  110.955   9.9614   68.530   4.7378   72.936   3.3114 -4.405968 5.780309 
1 1 1   22   26    8 o   33.065   4.8983   24.632   6.1240   22.627   10.970   25.540   7.3812   31.423   8.3298   34.707   5.1564 -3.284304 9.796572 
1 1 1   22   26    9 o   67.068   3.0069   95.903   7.9077   90.141   13.211   99.120   9.8714   65.260   4.9083   68.876   3.4749 -3.615593 6.013834 
1 1 1   22   26   10 o   93.092   2.6055  184.440   9.6552  169.242   15.488  194.101   12.348   89.697   4.1865   96.487   3.1029 -6.790085 5.211036 
1 1 1   22   26   11 o   27.597   6.2757   15.617   7.3598   21.261   14.430   13.633   8.5563   30.443   9.9682   24.750   7.6273 5.692904 12.55149 
1 1 1   22   26   12 o   97.354   3.0529  204.232   10.819  190.062   20.540  209.673   12.728   94.442   5.2733  100.266   3.0779 -5.823967 6.105797 
1 1 1   22   26   13 o   57.991   3.4293   73.015   7.5870   66.696   13.238   76.106   9.2583   55.744   5.7579   60.237   3.7265 -4.492447 6.858574 
1 1 1   22   26   14 o   23.999   5.0808   13.665   6.2244  -0.2111   11.287   19.729   7.4616   18.330   7.9787   29.668   6.2928 -11.33876 10.16164 
1 1 1   22   26   15 o   48.682   3.8688   50.756   7.2163   51.406   12.834   50.456   8.7266   48.542   6.4101   48.822   4.3337 -0.2798462 7.737606 
1 1 1   22   26   16 o   40.646   4.4969   35.984   6.7621   38.036   12.262   35.087   8.1062   40.742   7.5759   40.550   4.8469 0.1920776 8.993713 
1 1 1   22   26   17 o   13.525   4.6213 -15.7410   7.7801 -17.7423   10.659 -13.4593   11.381   12.753   6.2207   14.296   6.8358 -1.542904 9.242610 
1 1 1   22   26   18 o   21.808   5.8130   5.5686   8.5326   17.377   11.104 -11.4570   13.333   27.306   8.7281   16.310   7.6803 10.99672 11.62609 
1 1 1   22   26   19 o   56.213   4.9326   65.308   10.834   55.013   13.028   88.401   19.511   49.961   6.3222   62.466   7.5730 -12.50456 9.865135 
1 1 1   22   26   20 o   17.824   5.5025  -5.5704   8.4388 -18.4531   11.682   8.4898   12.204   13.388   6.5262   22.260   8.8610 -8.872484 11.00490 
1 1 1   22   26   21 o   55.766   5.0706   70.856   11.538   66.209   17.186   74.669   15.568   53.660   7.7654   57.871   6.5225 -4.210941 10.14121 
1 1 1   22   26   22 o   24.033   6.5572   9.4464   10.235  -4.2357   15.479   20.076   13.643   19.399   8.8255   28.667   9.7003 -9.268841 13.11435 
1 1 1   22   26   23 o   48.199   5.0502   48.186   9.3328   75.146   16.492   35.484   11.320   57.511   6.9527   38.887   7.3265 18.62345 10.10035 
1 1 1   22   26   24 o   70.110   3.5415  107.832   10.152  101.291   15.063  113.275   13.742   67.853   5.3825   72.366   4.6041 -4.512428 7.083058 
1 1 1   22   26   25 o   68.654   3.7076  104.470   10.387   90.737   14.985  117.172   14.411   63.900   5.6860   73.409   4.7598 -9.509068 7.415221 
1 1 1   22   26   26 o   32.991   6.1310   27.643   8.3713   27.661   13.079   27.630   10.896   32.561   9.2849   33.421   8.0091 -0.8595734 12.26193 
1 1 1   22   26   27 o   23.408   5.4898   10.598   7.9497  -7.8198   12.160   24.345   10.506   15.769   7.3967   31.047   8.1141 -15.27784 10.97950 
1 1 1   22   26   28 o   15.924   5.1347  -4.8380   7.8954 -16.2608   12.654   2.4443   10.103   14.182   6.8859   17.665   7.6188 -3.482511 10.26945 
1 1 1   22   27    0 o   27.238   6.7243   20.635   9.6653   20.635   9.6653   20.635   9.6653   27.238   9.5096   27.238   9.5096 0.000000 0.000000 
1 1 1   22   27    1 o   38.883   4.6115   33.349   7.1555   29.794   10.431   36.510   9.8346   36.439   7.1957   41.328   5.7695 -4.889927 9.223098 
1 1 1   22   27    2 o   59.767   3.3354   75.692   8.1821   72.929   12.043   78.062   11.151   58.670   4.9768   60.865   4.4420 -2.195004 6.670811 
1 1 1   22   27    3 o   40.498   3.9093   33.701   6.3138   40.022   10.676   30.301   7.8297   43.194   5.9927   37.802   5.0219 5.391533 7.818681 
1 1 1   22   27    4 o   32.316   4.9494   24.419   6.3800   17.903   10.278   28.504   8.1375   28.055   8.3001   36.577   5.3941 -8.522299 9.898867 
1 1 1   22   27    5 o   31.102   5.1140   20.216   6.2677   29.449   10.692   15.383   7.7363   36.085   7.4317   26.120   7.0273 9.964973 10.22807 
1 1 1   22   27    6 o   36.534   4.5400   29.182   6.3667   29.664   10.744   28.921   7.9039   36.198   7.4450   36.869   5.1978 -0.6709480 9.079913 
1 1 1   22   27    7 o   46.815   3.6023   45.288   6.6579   51.116   11.445   42.307   8.1855   48.858   5.6796   44.773   4.4326 4.084412 7.204593 
1 1 1   22   27    8 o   80.188   2.6806  132.383   8.5209  143.904   14.416  126.197   10.564   82.654   4.2289   77.723   3.2953 4.930710 5.361205 
1 1 1   22   27    9 o  110.242   2.5444  260.446   11.268  220.919   17.151  290.464   14.946  102.479   4.0578  118.004   3.0709 -15.52509 5.088858 
1 1 1   22   27   10 o   93.710   2.7562  183.375   10.525  192.038   16.343  177.236   13.758   95.471   4.1505   91.948   3.6278 3.522873 5.512469 
1 1 1   22   27   11 o   68.997   3.7936  105.036   9.0528   95.890   18.366  107.971   10.405   66.225   6.7240   71.770   3.5149 -5.544899 7.587261 
1 1 1   22   27   12 o   82.861   3.2812  144.560   9.9116  148.766   19.254  143.044   11.561   83.105   5.6174   82.617   3.3928 0.4882584 6.562486 
1 1 1   22   27   13 o   54.657   3.5401   64.690   7.5399   61.192   12.755   66.569   9.3479   53.167   5.8167   56.147   4.0366 -2.980206 7.080184 
1 1 1   22   27   14 o   25.223   5.7100   13.720   6.2025   16.082   11.872   12.833   7.2742   26.657   9.0487   23.789   6.9670 2.867558 11.42003 
1 1 1   22   27   15 o   37.474   4.7244   30.184   6.5428   34.710   12.165   28.341   7.7609   38.630   7.9015   36.318   5.1812 2.312263 9.448769 
1 1 1   22   27   16 o   50.338   3.6968   51.959   7.0066   61.217   13.302   48.404   8.2428   52.905   6.0961   47.771   4.1835 5.134201 7.393569 
1 1 1   22   27   17 o   30.410   5.6723   19.487   7.3296   34.001   12.300   11.496   9.1271   37.901   8.1133   22.919   7.9292 14.98289 11.34451 
1 1 1   22   27   18 o   29.245   6.5923   21.063   9.0916   24.259   12.173   17.030   13.672   31.432   8.9559   27.058   9.6760 4.373985 13.18455 
1 1 1   22   27   19 o   20.653   5.7428   1.6301   8.4773   16.709   12.000 -13.3923   11.977   26.642   9.0970   14.663   7.0118 11.97865 11.48565 
1 1 1   22   27   20 o   24.143   5.9626   10.446   7.6650   22.230   12.311   2.9867   9.7951   30.033   9.1295   18.253   7.6723 11.77959 11.92524 
1 1 1   22   27   21 o   42.830   6.4688   45.186   10.982   47.538   16.869   43.455   14.468   43.394   9.6726   42.266   8.5921 1.127819 12.93762 
1 1 1   22   27   22 o   25.295   7.4171   6.2655   9.6761   29.474   24.237   1.8650   10.554   32.499   12.621   18.091   7.7946 14.40850 14.83413 
1 1 1   22   27   23 o   31.034   5.9707   25.051   8.3285   14.933   12.795   32.490   10.971   25.231   9.3115   36.838   7.4762 -11.60764 11.94145 
1 1 1   22   27   24 o   65.669   3.8051   96.160   10.180   82.048   14.647  109.348   14.159   60.552   5.8647   70.786   4.8498 -10.23462 7.610184 
1 1 1   22   27   25 o   37.753   5.6840   35.881   8.6495   29.543   13.200   40.650   11.450   33.510   9.2484   41.996   6.6105 -8.485573 11.36802 
1 1 1   22   27   26 o   75.131   3.4572  125.277   10.609  116.662   15.747  132.437   14.357   72.348   5.2774   77.914   4.4676 -5.565659 6.914443 
1 1 1   22   27   27 o   14.811   4.9490  -9.2855   7.8532  -4.0633   11.969 -13.2335   10.406   16.564   7.6197   13.058   6.3173 3.505825 9.897927 
1 1 1   22   28    0 o   44.799   4.4516   44.666   10.973   44.666   10.973   44.666   10.973   44.799   6.2955   44.799   6.2955 0.000000 0.000000 
1 1 1   22   28    1 o   38.899   4.5057   32.703   7.2207   33.909   10.519   31.629   9.9295   39.554   6.4480   38.244   6.2951 1.309731 9.011336 
1 1 1   22   28    2 f   86.206   2.8013  156.410   9.9337  153.270   14.497  159.188   13.639   85.323   4.1195   87.089   3.7971 -1.765778 5.602519 
1 1 1   22   28    3 o   20.740   5.2386   8.5401   5.7748   3.7519   9.8413   11.055   7.1316   19.053   7.8207   22.427   6.9720 -3.374332 10.47722 
1 1 1   22   28    4 o   81.592   2.7790  143.089   9.0893  123.565   14.013  157.269   11.942   76.462   4.4435   86.722   3.3388 -10.25924 5.558077 
1 1 1   22   28    5 f  100.689   2.5112  214.223   10.080  205.305   16.321  219.722   12.816   98.761   4.0069  102.617   3.0280 -3.855850 5.022326 
1 1 1   22   28    6 o   67.305   3.0267   97.786   7.9265   88.902   13.314  102.664   9.8656   64.594   4.9973   70.016   3.4163 -5.421646 6.053456 
1 1 1   22   28    7 o   39.675   4.1243   31.274   6.4232   43.589   11.448   25.617   7.7596   44.804   6.1951   34.545   5.4461 10.25904 8.248590 
1 1 1   22   28    8 o   31.366   5.1494   21.408   6.1694   26.197   11.098   19.266   7.4220   33.496   8.1178   29.236   6.3378 4.259672 10.29886 
1 1 1   22   28    9 o   19.047   4.8395   6.1569   5.7017  -8.2853   10.587   12.057   6.7669   14.965   6.9811   23.129   6.7042 -8.163551 9.678994 
1 1 1   22   28   10 o   45.669   5.2778   49.974   8.2502   41.103   15.760   53.322   9.6830   41.305   9.4553   50.032   4.6924 -8.727505 10.55558 
1 1 1   22   28   11 o   41.316   5.5177   41.982   7.3127   33.857   15.918   44.155   8.2330   37.023   10.130   45.609   4.3767 -8.585960 11.03530 
1 1 1   22   28   12 o   37.209   5.1114   35.469   6.7888   22.401   12.540   40.886   8.0744   30.572   9.1962   43.846   4.4649 -13.27441 10.22278 
1 1 1   22   28   13 o   20.144   5.4922   7.0741   6.0264   5.6977   11.554   7.5884   7.0632   20.820   8.5017   19.467   6.9554 1.353321 10.98439 
1 1 1   22   28   14 o   18.645   5.2845   5.1452   5.9978  -0.9456   11.710   7.3114   6.9834   18.116   7.9980   19.175   6.9091 -1.059343 10.56898 
1 1 1   22   28   15 o   30.613   5.5377   19.655   6.3790   29.372   12.580   16.292   7.4011   34.710   8.7809   26.516   6.7499 8.193226 11.07544 
1 1 1   22   28   16 o   22.895   5.5596   7.2553   5.8961   22.082   12.103   2.6419   6.7513   30.003   9.0369   15.788   6.4787 14.21484 11.11929 
1 1 1   22   28   17 o   28.383   5.9452   19.676   7.5122   16.325   11.775   21.977   9.7557   26.381   9.0111   30.385   7.7576 -4.004944 11.89040 
1 1 1   22   28   18 o   33.085   5.8590   27.290   8.1677   19.503   12.303   33.426   10.921   28.295   9.2014   37.874   7.2556 -9.579733 11.71793 
1 1 1   22   28   19 o   22.924   6.4390   9.5836   9.1129   7.5820   12.624   11.761   13.168   21.841   8.8990   24.007   9.3087 -2.165537 12.87802 
1 1 1   22   28   21 o   26.754   7.1754   17.091   12.134  -9.2636   24.936   25.268   13.890   22.415   10.539   31.094   9.7404 -8.678997 14.35084 
1 1 1   22   28   22 o   58.193   6.4623   81.770   11.906   88.062   26.346   80.155   13.347   56.136   11.756   60.251   5.3708 -4.115116 12.92452 
1 1 1   22   28   23 o   23.513   6.2731   12.525   8.7200   3.2911   15.144   17.104   10.665   20.887   9.1629   26.140   8.5702 -5.252968 12.54619 
1 1 1   22   28   24 o   22.088   5.7659   8.2692   8.1709  -5.4501   11.982   20.195   11.171   16.258   7.5304   27.919   8.7337 -11.66083 11.53187 
1 1 1   22   28   25 o   36.986   5.7676   35.083   8.7374   28.051   12.989   40.895   11.808   32.275   9.2692   41.696   6.8662 -9.421528 11.53528 
1 1 1   22   29    0 o   73.864   3.1234  115.310   13.347  115.310   13.347  115.310   13.347   73.864   4.4172   73.864   4.4172 0.000000 0.000000 
1 1 1   22   29    1 o   71.570   3.0893  108.797   9.0926  105.767   13.257  111.488   12.494   70.542   4.5566   72.599   4.1727 -2.057205 6.178513 
1 1 1   22   29    2 o   96.698   2.7504  196.175   10.925  207.655   16.360  186.937   14.676   99.178   3.9995   94.218   3.7767 4.959373 5.500804 
1 1 1   22   29    3 o   36.976   4.9855   30.979   7.3922   24.549   10.414   37.511   10.495   32.450   7.8632   41.502   6.1313 -9.052166 9.971069 
1 1 1   22   29    4 o   52.892   3.3966   59.497   7.1933   60.511   11.689   58.879   9.1263   53.044   5.3427   52.741   4.1955 0.3029747 6.793153 
1 1 1   22   29    5 o   74.285   2.9006  119.519   8.5323  105.207   13.654  128.687   10.929   70.252   4.7125   78.318   3.3833 -8.065933 5.801188 
1 1 1   22   29    6 o   57.298   3.2767   70.454   7.4426   67.931   12.213   71.944   9.3870   56.209   5.2680   58.388   3.8980 -2.178860 6.553315 
1 1 1   22   29    7 o   48.066   3.8286   51.154   6.9908   46.030   12.203   53.657   8.5293   45.780   6.4626   50.352   4.1070 -4.572289 7.657245 
1 1 1   22   29    8 o   99.777   2.5103  205.002   9.9311  225.271   16.828  194.170   12.302  103.248   3.9516   96.305   3.0971 6.942993 5.020666 
1 1 1   22   29    9 o   44.940   4.1432   45.269   6.9126   40.627   12.510   47.310   8.2939   42.672   7.1078   47.207   4.2597 -4.535442 8.286465 
1 1 1   22   29   10 o   37.679   5.8386   39.059   8.1624   20.447   16.302   45.285   9.4295   29.451   10.562   45.908   4.9801 -16.45741 11.67724 
1 1 1   22   29   11 o   31.132   5.4496   22.994   6.5499   21.894   12.134   23.446   7.7809   30.028   9.0490   32.236   6.0751 -2.208258 10.89918 
1 1 1   22   29   12 o   18.052   5.2101   4.2344   6.0230  -2.9706   11.737   6.8102   7.0176   17.346   7.8082   18.757   6.9002 -1.411146 10.42021 
1 1 1   22   29   13 o   23.359   5.5876   7.1398   6.1159   24.052   12.411   1.7159   7.0285   31.228   9.0872   15.490   6.5045 15.73802 11.17523 
1 1 1   22   29   14 o   44.028   4.9857   50.757   7.2635   31.008   13.448   58.890   8.6306   35.405   9.1452   52.651   3.9744 -17.24586 9.971444 
1 1 1   22   29   15 o   37.157   5.1231   33.908   6.6098   27.503   13.027   36.128   7.6704   33.268   9.1900   41.046   4.5309 -7.777233 10.24620 
1 1 1   22   29   16 o   52.336   4.0613   59.049   8.5866   66.379   13.881   54.505   10.928   54.669   6.1561   50.004   5.2989 4.665043 8.122567 
1 1 1   22   29   17 f   24.251   5.8916   10.652   7.6995   23.687   12.138   1.8757   9.9598   30.752   8.9977   17.749   7.6084 13.00224 11.78328 
1 1 1   22   29   18 o   22.172   5.7972   10.151   7.5282   1.9149   12.009   15.483   9.6627   19.001   8.2503   25.344   8.1463 -6.342871 11.59435 
1 1 1   22   29   19 f   41.037   5.1417   39.511   8.3722   39.554   12.953   39.480   10.972   40.298   8.0745   41.776   6.3681 -1.477634 10.28349 
1 1 1   22   29   20 o   28.872   7.4150   22.470   11.419   26.129   12.720   7.2758   25.920   31.812   9.1833   25.933   11.645 5.879181 14.83004 
1 1 1   22   29   21 o   30.996   7.2520   26.255   10.804   25.058   15.866   27.290   14.752   30.282   10.456   31.710   10.052 -1.428349 14.50396 
1 1 1   22   29   22 o   18.842   5.8889   2.0432   8.3384  -1.4497   16.111   3.3212   9.7452   19.782   9.0013   17.903   7.5957 1.878265 11.77787 
1 1 1   22   29   23 o   17.678   5.4061   0.8798   7.7172  -9.0622   12.314   7.3101   9.9033   15.488   7.3199   19.868   7.9576 -4.380254 10.81222 
1 1 1   22   29   24 o   32.258   5.6836   27.673   8.4131   13.700   12.693   38.620   11.236   23.918   9.1754   40.597   6.7102 -16.67883 11.36725 
1 1 1   22   30    0 o   35.866   5.7620   31.396   10.508   31.396   10.508   31.396   10.508   35.866   8.1486   35.866   8.1486 0.000000 0.000000 
1 1 1   22   30    1 o   78.261   2.9439  130.349   9.4699  121.738   13.629  138.387   13.167   75.644   4.3685   80.879   3.9473 -5.235222 5.887731 
1 1 1   22   30    2 o  111.368   2.7425  263.972   12.484  300.120   17.522  226.703   17.792  119.381   3.5587  103.355   4.1737 16.02540 5.484905 
1 1 1   22   30    3 o   43.110   4.6385   41.647   7.9892   35.724   11.234   47.707   11.364   39.475   7.1640   46.745   5.8941 -7.269646 9.277012 
1 1 1   22   30    4 o   73.202   3.0166  113.856   9.1028  117.145   13.137  110.818   12.625   74.204   4.2924   72.200   4.2395 2.004349 6.033126 
1 1 1   22   30    5 o   30.872   5.1593   21.411   6.1645   24.908   10.808   19.724   7.5049   32.341   8.1157   29.403   6.3725 2.938091 10.31863 
1 1 1   22   30    6 o   88.402   2.6989  168.502   9.3424  154.798   15.535  176.265   11.693   85.143   4.4239   91.661   3.0930 -6.518044 5.397892 
1 1 1   22   30    7 o  112.123   2.6381  269.470   12.013  239.059   17.943  294.173   16.172  106.017   4.1036  118.230   3.3165 -12.21308 5.276234 
1 1 1   22   30    8 o   68.125   3.1416  102.212   8.1649   90.884   14.112  107.912   10.010   64.689   5.2892   71.560   3.3917 -6.871071 6.283264 
1 1 1   22   30    9 o   51.692   4.6508   55.407   7.7677   67.001   18.367   52.882   8.5720   53.567   8.3134   49.816   4.1720 3.751160 9.301571 
1 1 1   22   30   10 o   80.462   3.5686  137.435   10.597  145.870   20.294  134.272   12.425   81.313   6.0513   79.611   3.7842 1.701195 7.137132 
1 1 1   22   30   11 o   55.773   3.8610   73.742   7.6506   54.386   13.897   82.159   9.1643   49.184   6.8508   62.363   3.5629 -13.17875 7.721939 
1 1 1   22   30   12 o   72.080   3.1946  115.840   8.8478   97.531   14.819  125.983   11.030   66.902   5.3704   77.257   3.4614 -10.35477 6.389276 
1 1 1   22   30   13 o   33.558   4.9992   19.634   6.2928   44.559   13.065   12.106   7.1805   44.222   7.1634   22.893   6.9752 21.32853 9.998361 
1 1 1   22   30   14 o   49.281   4.4463   59.703   7.4558   43.260   13.525   66.881   8.9362   42.506   8.0087   56.055   3.8652 -13.54910 8.892597 
1 1 1   22   30   15 o   86.171   2.9088  162.012   9.5492  150.653   16.767  167.466   11.618   83.237   4.8839   89.105   3.1612 -5.868042 5.817673 
1 1 1   22   30   16 o   64.472   3.5220   90.410   9.2767   93.363   14.205   88.214   12.250   65.161   5.2854   63.784   4.6564 1.377285 7.043961 
1 1 1   22   30   17 o   54.828   4.1809   68.916   9.1506   54.535   13.596   80.823   12.372   48.810   6.7539   60.846   4.9299 -12.03616 8.361735 
1 1 1   22   30   18 o   83.763   3.1309  153.701   10.660  134.456   15.733  170.036   14.495   78.448   4.8625   89.077   3.9453 -10.62907 6.261722 
1 1 1   22   30   19 o   34.817   5.8021   29.687   8.0597   34.452   12.875   26.616   10.335   36.796   8.6322   32.837   7.7551 3.959515 11.60420 
1 1 1   22   30   20 o   25.053   6.3656   14.699   8.9888   23.245   12.589   5.8109   12.838   29.547   9.2761   20.558   8.7200 8.988951 12.73123 
1 1 1   22   30   21 o   25.072   6.4650   14.140   10.017  -1.2954   15.194   26.007   13.323   19.251   8.7528   30.893   9.5170 -11.64160 12.93002 
1 1 1   22   30   22 o   24.447   6.8459   14.198   10.230   12.472   15.958   15.402   13.330   24.031   9.9222   24.863   9.4348 -0.8318214 13.69182 
1 1 1   22   31    0 o   14.188   6.1829   4.2372   9.9935   4.2372   9.9935   4.2372   9.9935   14.188   8.7440   14.188   8.7440 0.000000 0.000000 
1 1 1   22   31    1 o  119.250   2.9777  305.571   14.443  320.478   19.220  286.238   21.889  122.989   3.7891  115.511   4.5945 7.477386 5.955403 
1 1 1   22   31    2 o   38.537   4.9680   34.096   7.6471   27.314   10.697   41.186   10.936   33.910   7.8094   43.164   6.1432 -9.253929 9.936091 
1 1 1   22   31    3 o  127.708   2.8980  345.719   15.154  335.903   20.138  358.536   23.012  125.832   3.8802  129.584   4.3055 -3.752480 5.795984 
1 1 1   22   31    4 o   41.199   4.7069   38.870   7.6752   33.028   11.200   44.042   10.539   37.555   7.4934   44.843   5.6982 -7.288521 9.413862 
1 1 1   22   31    5 o   61.442   3.4681   81.868   8.7111   70.064   12.341   93.590   12.298   56.795   5.2684   66.089   4.5117 -9.293476 6.936196 
1 1 1   22   31    6 o   44.900   4.2001   44.373   7.7657   45.099   11.337   43.731   10.659   45.175   6.0847   44.625   5.7914 0.5499878 8.400218 
1 1 1   22   31    7 o   23.819   5.1315   14.060   6.1279   1.9722   11.345   19.040   7.2815   18.835   8.0982   28.802   6.3045 -9.967331 10.26294 
1 1 1   22   31    8 o   44.693   4.0982   43.187   6.8631   45.882   12.798   42.099   8.1313   45.075   6.8837   44.311   4.4492 0.7641068 8.196342 
1 1 1   22   31    9 o   62.615   4.3007   87.675   9.4825   85.369   18.945   88.446   10.953   60.861   7.5474   64.368   4.1258 -3.507298 8.601433 
1 1 1   22   31   10 o   15.276   4.8692  -2.1263   6.2456  -9.1128   11.687   0.6664   7.3892   15.372   7.2237   15.179   6.5311 0.1933451 9.738445 
1 1 1   22   31   11 o   43.962   5.3461   49.713   7.4718   37.492   15.588   53.358   8.5136   38.004   9.8602   49.920   4.1350 -11.91611 10.69214 
1 1 1   22   31   12 o   78.002   3.4846  138.085   9.5034  121.068   18.687  144.021   11.037   73.437   6.1697   82.566   3.2411 -9.128517 6.969257 
1 1 1   22   31   13 o   27.804   5.5635   21.036   6.7426   9.0034   14.456   24.381   7.6226   22.925   9.4523   32.682   5.8707 -9.756918 11.12702 
1 1 1   22   31   14 o   58.049   3.6472   76.046   7.7381   68.829   14.367   78.995   9.1841   55.180   6.3125   60.918   3.6554 -5.737408 7.294489 
1 1 1   22   31   15 o   43.984   5.1225   48.238   8.3043   36.293   13.666   55.231   10.456   37.790   8.9125   50.178   5.0524 -12.38802 10.24494 
1 1 1   22   31   16 o   33.726   5.9063   28.270   8.0562   30.969   12.719   26.461   10.411   34.711   8.8555   32.740   7.8176 1.970200 11.81250 
1 1 1   22   31   17 o   82.790   3.1313  151.168   10.517  128.700   15.431  170.657   14.371   76.490   4.8912   89.090   3.9111 -12.59972 6.262612 
1 1 1   22   31   18 o   20.505   6.0850   3.6540   9.0696  -4.7457   12.132   14.295   13.655   16.525   7.6271   24.486   9.4835 -7.960272 12.17003 
1 1 1   22   31   19 o   24.650   6.7500   14.654   9.7852   12.637   13.467   16.909   14.243   23.580   9.3327   25.720   9.7544 -2.140907 13.49992 
1 1 1   22   32    0 o   80.032   3.0808  135.892   14.284  135.892   14.284  135.892   14.284   80.032   4.3570   80.032   4.3570 0.000000 0.000000 
1 1 1   22   32    1 o   50.820   3.9329   56.946   8.2103   54.010   11.931   59.587   11.316   49.401   5.8557   52.239   5.2519 -2.837566 7.865897 
1 1 1   22   32    2 o   42.985   4.4598   41.200   7.8916   38.672   10.768   44.132   11.599   41.582   6.2788   44.389   6.3354 -2.807293 8.919666 
1 1 1   22   32    3 o   41.547   4.5232   38.791   7.7419   37.405   11.058   40.123   10.843   40.718   6.5842   42.377   6.2038 -1.658428 9.046476 
1 1 1   22   32    4 o   23.297   5.8630   12.228   7.0816   11.751   10.529   12.623   9.5696   23.130   8.4606   23.465   8.1191 -0.3350468 11.72606 
1 1 1   22   32    5 o   47.059   4.2157   50.021   8.0331   42.401   11.807   56.587   10.961   43.269   6.6162   50.848   5.2264 -7.579063 8.431437 
1 1 1   22   32    6 o   30.636   4.8921   23.457   7.3404   2.7248   11.019   40.000   9.8425   18.735   8.0160   42.536   5.6102 -23.80114 9.784187 
1 1 1   22   32    7 o   28.808   5.7365   20.867   7.2582   15.886   11.165   24.512   9.5519   25.644   8.7748   31.973   7.3913 -6.329378 11.47291 
1 1 1   22   32    8 o   25.891   5.5883   18.604   6.7908  -4.1110   18.438   22.169   7.3043   20.664   9.4880   31.118   5.9072 -10.45414 11.17663 
1 1 1   22   32    9 o   24.084   6.6349   12.054   7.3163   5.9433   23.108   12.735   7.7131   24.938   11.111   23.230   7.2555 1.708473 13.26975 
1 1 1   22   32   10 o   39.772   5.3537   38.523   7.0833   35.655   14.920   39.357   8.0481   36.922   9.6791   42.621   4.5783 -5.698982 10.70733 
1 1 1   22   32   11 o   67.734   3.6212  100.536   8.7231  100.950   17.367  100.397   10.088   66.762   6.3071   68.706   3.5599 -1.944832 7.242378 
1 1 1   22   32   12 o   26.616   5.9058   17.369   6.5495   16.292   14.275   17.657   7.3712   25.948   9.7835   27.284   6.6181 -1.336109 11.81169 
1 1 1   22   32   13 o   28.037   5.9934   14.842   6.6960   33.358   14.304   9.6458   7.5775   35.405   9.5679   20.670   7.2206 14.73533 11.98678 
1 1 1   22   32   14 o   33.277   6.2335   28.237   8.2392   30.103   14.991   27.430   9.8624   33.001   10.083   33.552   7.3317 -0.5510521 12.46707 
1 1 1   22   32   15 o   36.640   6.8744   36.506   10.551   36.937   15.340   36.118   14.534   36.664   9.9087   36.615   9.5313 0.4937744E-01 13.74873 
1 1 1   22   32   16 o   39.742   6.8524   41.870   11.194   32.302   14.787   54.715   17.132   34.085   9.9192   45.400   9.4567 -11.31462 13.70471 
1 1 1   22   32   17 o   24.003   6.6012   12.862   9.6017   19.418   13.988   7.0201   13.203   26.951   9.7682   21.055   8.8818 5.896547 13.20243 
1 1 1   22   33    0 o   14.819   6.3986   5.4243   10.483   5.4243   10.483   5.4243   10.483   14.819   9.0490   14.819   9.0490 0.000000 0.000000 
1 1 1   22   33    1 o   54.492   4.0464   66.189   9.0604   72.375   12.825   60.025   12.802   57.236   5.4327   51.748   5.9982 5.487637 8.092772 
1 1 1   22   33    2 o   24.498   6.0352   14.259   7.4815   13.916   10.426   14.623   10.742   24.257   8.4698   24.738   8.5998 -0.4807720 12.07036 
1 1 1   22   33    3 o   32.306   5.5353   25.151   7.4534   34.329   11.070   17.540   10.081   37.948   7.3381   26.665   8.2892 11.28348 11.07066 
1 1 1   22   33    4 o   59.837   3.5606   78.822   8.7344   72.395   12.665   84.652   12.062   57.264   5.3625   62.410   4.6858 -5.146210 7.121293 
1 1 1   22   33    5 o   51.264   4.0205   59.428   8.3363   49.515   12.193   68.127   11.423   46.733   6.3261   55.795   4.9638 -9.061768 8.041098 
1 1 1   22   33    6 o   66.885   3.4034   99.518   9.1770   81.772   13.526  114.654   12.492   60.776   5.3960   72.994   4.1493 -12.21819 6.806898 
1 1 1   22   33    7 o   19.105   5.6627   4.6726   7.2890   3.4928   12.388   5.2972   9.0145   19.632   8.4519   18.577   7.5385 1.055302 11.32535 
1 1 1   22   33    8 o   58.570   5.0756   79.611   10.212   81.277   21.135   79.104   11.665   56.947   8.9983   60.193   4.6985 -3.245296 10.15111 
1 1 1   22   33    9 o   71.758   3.7758  114.431   11.172  117.158   16.000  111.837   15.607   72.587   5.3445   70.928   5.3351 1.658226 7.551589 
1 1 1   22   33   10 o   19.797   5.7224   6.3985   7.5227  -0.4666   13.242   9.6700   9.1411   18.560   8.3292   21.034   7.8490 -2.474533 11.44479 
1 1 1   22   33   11 o   21.959   5.8957   4.8715   7.5493   23.078   13.604  -3.2304   9.0749   29.176   9.6846   14.742   6.7265 14.43349 11.79142 
1 1 1   22   33   12 o   26.266   6.2814   18.066   8.0337   14.880   14.164   19.577   9.7546   24.794   9.6430   27.738   8.0520 -2.943605 12.56273 
1 1 1   22   33   13 o   20.200   5.6761   7.1950   7.7084  -5.2398   13.731   12.917   9.3146   17.354   8.0463   23.046   8.0081 -5.692005 11.35223 
1 1 1   22   33   14 o   26.128   6.3987   16.628   7.8658   21.853   14.416   14.413   9.3861   28.202   9.9515   24.053   8.0463 4.149094 12.79745 
1 1 1   22   34    0 o   18.546   7.0719   11.979   10.627   11.979   10.627   11.979   10.627   18.546   10.001   18.546   10.001 0.000000 0.000000 
1 1 1   22   34    1 o   33.675   5.8166   28.560   8.0138   25.317   10.933   32.327   11.782   31.508   8.2979   35.843   8.1534 -4.335245 11.63324 
1 1 1   22   34    2 o   23.756   6.0352   13.633   7.5315   13.776   10.588   13.487   10.715   23.837   8.5159   23.676   8.5542 0.1616287 12.07041 
1 1 1   22   34    3 o   29.095   5.9121   21.516   7.4414   23.945   11.182   19.585   9.9695   30.429   8.5537   27.761   8.1636 2.667641 11.82411 
1 1 1   22   34    4 o   18.231   5.4535   3.0420   7.3238  -2.5264   10.871   7.6698   9.9104   16.352   7.4228   20.111   7.9914 -3.758121 10.90691 
1 1 1   22   34    5 o   22.673   5.9997   11.958   7.7649   5.8925   13.278   15.111   9.5724   20.732   8.8331   24.615   8.1216 -3.882753 11.99932 
1 1 1   22   34    6 o   32.242   5.3693   30.141   8.5249   4.1376   14.619   43.540   10.494   20.658   9.0340   43.825   5.8056 -23.16671 10.73863 
1 1 1   22   34    7 o   54.403   4.5652   68.628   9.5063   68.138   16.677   68.864   11.570   53.083   7.6170   55.724   5.0342 -2.641502 9.130312 
1 1 1   22   34    8 o   49.797   7.0555   74.203   10.587   55.073   25.634   78.137   11.624   40.009   13.295   59.585   4.7301 -19.57635 14.11109 
1 1 1   22   34    9 o   26.060   6.4802   17.818   8.8911   12.593   13.774   21.551   11.641   23.601   9.4076   28.519   8.9147 -4.918459 12.96050 
1 1 1   23    0    1 o  233.395   2.3427  1124.97   31.878  1124.97   31.878  1124.97   31.878  233.395   3.3130  233.395   3.3130 0.000000 0.000000 
1 1 1   23    0    2 o  301.858   2.6231  1881.86   46.169  1881.86   46.169  1881.86   46.169  301.858   3.7097  301.858   3.7097 0.000000 0.000000 
1 1 1   23    0    3 o  286.464   2.5549  1694.77   42.675  1694.77   42.675  1694.77   42.675  286.464   3.6132  286.464   3.6132 0.000000 0.000000 
1 1 1   23    0    4 o  181.130   2.1942  677.661   23.166  677.661   23.166  677.661   23.166  181.130   3.1030  181.130   3.1030 0.000000 0.000000 
1 1 1   23    0    5 o  187.075   2.1961  722.848   23.948  722.848   23.948  722.848   23.948  187.075   3.1057  187.075   3.1057 0.000000 0.000000 
1 1 1   23    0    6 o   16.248   6.1783   7.7904   8.0898   7.7904   8.0898   7.7904   8.0898   16.248   8.7374   16.248   8.7374 0.000000 0.000000 
1 1 1   23    0    7 o   79.276   2.5061  130.508   11.536  130.508   11.536  130.508   11.536   79.276   3.5442   79.276   3.5442 0.000000 0.000000 
1 1 1   23    0    8 o  113.579   2.2334  266.860   14.770  266.860   14.770  266.860   14.770  113.579   3.1586  113.579   3.1586 0.000000 0.000000 
1 1 1   23    0    9 o  151.176   2.1689  472.247   19.107  472.247   19.107  472.247   19.107  151.176   3.0673  151.176   3.0673 0.000000 0.000000 
1 1 1   23    0   10 o   46.919   3.5039   46.986   9.3446   46.986   9.3446   46.986   9.3446   46.919   4.9553   46.919   4.9553 0.000000 0.000000 
1 1 1   23    0   11 o  108.136   2.3101  242.019   14.540  242.019   14.540  242.019   14.540  108.136   3.2669  108.136   3.2669 0.000000 0.000000 
1 1 1   23    0   12 o   36.491   4.8886   30.332   9.3173   30.332   9.3173   30.332   9.3173   36.491   6.9135   36.491   6.9135 0.000000 0.000000 
1 1 1   23    0   13 o   47.060   3.7461   47.491   9.9475   47.491   9.9475   47.491   9.9475   47.060   5.2978   47.060   5.2978 0.000000 0.000000 
1 1 1   23    0   14 o  198.804   2.2554  816.447   26.138  816.447   26.138  816.447   26.138  198.804   3.1896  198.804   3.1896 0.000000 0.000000 
1 1 1   23    0   15 o  242.409   2.7798  1214.56   39.282  1214.56   39.282  1214.56   39.282  242.409   3.9313  242.409   3.9313 0.000000 0.000000 
1 1 1   23    0   16 o   14.382   6.4095   1.9623   11.376   1.9623   11.376   1.9623   11.376   14.382   9.0644   14.382   9.0644 0.000000 0.000000 
1 1 1   23    0   17 o   47.405   4.0150   48.463   10.680   48.463   10.680   48.463   10.680   47.405   5.6781   47.405   5.6781 0.000000 0.000000 
1 1 1   23    0   18 f  406.181   3.2648  3412.80   77.327  3412.80   77.327  3412.80   77.327  406.181   4.6171  406.181   4.6171 0.000000 0.000000 
1 1 1   23    0   19 o   38.627   6.0150   35.127   11.857   35.127   11.857   35.127   11.857   38.627   8.5065   38.627   8.5065 0.000000 0.000000 
1 1 1   23    0   20 o  333.937   3.2863  2308.36   63.984  2308.36   63.984  2308.36   63.984  333.937   4.6476  333.937   4.6476 0.000000 0.000000 
1 1 1   23    0   21 o  109.101   2.8519  247.140   18.092  247.140   18.092  247.140   18.092  109.101   4.0332  109.101   4.0332 0.000000 0.000000 
1 1 1   23    0   22 o   89.538   3.6550  167.871   18.943  167.871   18.943  167.871   18.943   89.538   5.1689   89.538   5.1689 0.000000 0.000000 
1 1 1   23    0   23 o   89.789   2.9673  168.006   15.463  168.006   15.463  168.006   15.463   89.789   4.1964   89.789   4.1964 0.000000 0.000000 
1 1 1   23    0   24 o  104.428   2.6940  226.643   16.360  226.643   16.360  226.643   16.360  104.428   3.8099  104.428   3.8099 0.000000 0.000000 
1 1 1   23    0   25 o   38.721   5.9199   35.410   11.726   35.410   11.726   35.410   11.726   38.721   8.3720   38.721   8.3720 0.000000 0.000000 
1 1 1   23    0   26 o  166.173   2.7080  572.844   26.216  572.844   26.216  572.844   26.216  166.173   3.8297  166.173   3.8297 0.000000 0.000000 
1 1 1   23    0   27 o   46.109   4.7420   47.186   11.967   47.186   11.967   47.186   11.967   46.109   6.7062   46.109   6.7062 0.000000 0.000000 
1 1 1   23    0   28 o   75.149   3.2965  118.815   14.322  118.815   14.322  118.815   14.322   75.149   4.6620   75.149   4.6620 0.000000 0.000000 
1 1 1   23    0   29 o   22.800   9.2857   15.347   19.832   15.347   19.832   15.347   19.832   22.800   13.132   22.800   13.132 0.000000 0.000000 
1 1 1   23    0   30 o   94.479   6.6688  196.273   35.910  196.273   35.910  196.273   35.910   94.479   9.4310   94.479   9.4310 0.000000 0.000000 
1 1 1   23    0   31 o   12.477   5.9042  -3.5800   11.912  -3.5800   11.912  -3.5800   11.912   12.477   8.3498   12.477   8.3498 0.000000 0.000000 
1 1 1   23    0   32 o   20.385   7.7650   13.198   12.800   13.198   12.800   13.198   12.800   20.385   10.981   20.385   10.981 0.000000 0.000000 
1 1 1   23    0   33 o   19.528   7.7830   11.695   13.520   11.695   13.520   11.695   13.520   19.528   11.007   19.528   11.007 0.000000 0.000000 
1 1 1   23    0   34 f   80.707   4.9668  141.558   22.974  141.558   22.974  141.558   22.974   80.707   7.0242   80.707   7.0242 0.000000 0.000000 
1 1 1   23    0   35 o   51.327   4.7318   58.692   13.500   58.692   13.500   58.692   13.500   51.327   6.6918   51.327   6.6918 0.000000 0.000000 
1 1 1   23    0   36 o   41.657   6.1036   41.758   13.086   41.758   13.086   41.758   13.086   41.657   8.6317   41.657   8.6317 0.000000 0.000000 
1 1 1   23    0   37 o   14.054   6.8836 -12.0987   19.433 -12.0987   19.433 -12.0987   19.433   14.054   9.7349   14.054   9.7349 0.000000 0.000000 
1 1 1   23    0   38 o   15.195   7.5043 -17.2110   24.404 -17.2110   24.404 -17.2110   24.404   15.195   10.613   15.195   10.613 0.000000 0.000000 
1 1 1   23    0   39 o   24.952   10.826   22.743   30.331   22.743   30.331   22.743   30.331   24.952   15.310   24.952   15.310 0.000000 0.000000 
1 1 1   23    0   40 o   58.970   11.163  101.659   33.179  101.659   33.179  101.659   33.179   58.970   15.787   58.970   15.787 0.000000 0.000000 
1 1 1   23    1    0 f  288.442   2.5631  1718.26   43.108  1718.26   43.108  1718.26   43.108  288.442   3.6248  288.442   3.6248 0.000000 0.000000 
1 1 1   23    1    1 o  260.109   2.4391  1397.60   26.165  1386.71   36.743  1408.80   37.267  259.082   3.4385  261.135   3.4602 -2.052307 4.878133 
1 1 1   23    1    2 o  181.991   2.1827  683.977   16.383  680.719   23.057  687.299   23.283  181.554   3.0791  182.428   3.0944 -0.8740692 4.365345 
1 1 1   23    1    3 o  138.953   2.1511  398.532   12.325  387.978   17.214  409.633   17.655  137.066   3.0449  140.840   3.0392 -3.773636 4.302171 
1 1 1   23    1    4 o  256.150   2.4265  1355.31   25.633  1369.33   36.561  1341.75   35.946  257.452   3.4432  254.849   3.4199 2.603012 4.852914 
1 1 1   23    1    5 o  215.585   2.2741  959.946   20.220  954.023   28.499  965.950   28.694  214.916   3.2151  216.255   3.2171 -1.339035 4.548245 
1 1 1   23    1    6 o   61.963   2.8066   79.334   7.1710   81.464   10.264   77.303   10.023   62.775   3.9644   61.151   3.9739 1.624615 5.613196 
1 1 1   23    1    7 o  173.789   2.1805  623.654   15.627  616.380   21.887  631.219   22.320  172.756   3.0717  174.821   3.0955 -2.065125 4.360931 
1 1 1   23    1    8 f  106.291   2.2429  232.828   9.8183  216.226   13.555  251.152   14.241  102.312   3.2122  110.270   3.1312 -7.958466 4.485842 
1 1 1   23    1    9 o  158.749   2.1606  520.494   14.146  518.707   19.965  522.296   20.047  158.476   3.0545  159.023   3.0565 -0.5471497 4.321126 
1 1 1   23    1   10 o  211.140   2.2728  920.852   19.792  914.039   27.872  927.782   28.110  210.352   3.2125  211.927   3.2160 -1.575104 4.545641 
1 1 1   23    1   11 o   54.120   3.1809   60.601   7.0858   55.560   9.9114   65.870   10.134   51.812   4.6381   56.428   4.3543 -4.615139 6.361753 
1 1 1   23    1   12 o  116.779   2.2339  281.709   10.759  282.562   15.317  280.878   15.115  116.952   3.1755  116.605   3.1428 0.3470840 4.467733 
1 1 1   23    1   13 o   66.080   2.7789   90.310   7.5629   96.730   10.781   84.090   10.612   68.397   3.8217   63.762   4.0353 4.634789 5.557762 
1 1 1   23    1   14 o  156.954   2.5537  508.786   16.500  553.447   23.716  466.884   22.972  163.635   3.5140  150.275   3.7063 13.35989 5.107342 
1 1 1   23    1   15 o   67.047   3.0715   93.136   8.3717   93.605   10.966   92.479   12.962   67.271   3.9523   66.824   4.7028 0.4476166 6.143095 
1 1 1   23    1   16 o  133.397   2.8016  367.647   15.262  364.392   20.172  372.005   23.340  132.737   3.6846  134.056   4.2213 -1.319244 5.603200 
1 1 1   23    1   17 o   67.566   2.8736   94.505   7.9932   94.526   11.665   94.486   10.975   67.566   4.1858   67.567   3.9383 -0.1350403E-02 5.747268 
1 1 1   23    1   18 o   33.930   5.7079   24.990   7.9209   30.064   11.425   20.295   10.991   37.240   7.6932   30.620   8.4342 6.619995 11.41579 
1 1 1   23    1   19 o  179.180   2.4664  664.300   18.226  652.728   25.663  676.077   25.888  177.603   3.5035  180.757   3.4725 -3.154144 4.932786 
1 1 1   23    1   20 o   31.348   5.6481   21.518   7.8793   9.7948   11.356   32.401   10.942   23.932   8.7817   38.765   7.1053 -14.83303 11.29618 
1 1 1   23    1   21 o   64.409   3.5375   86.182   9.3283   72.762   12.892  100.930   13.515   59.120   5.2871   69.698   4.7014 -10.57810 7.075036 
1 1 1   23    1   22 o   76.752   3.9048  122.971   12.340  123.737   18.009  122.293   16.941   76.950   5.6744   76.553   5.3656 0.3971176 7.809511 
1 1 1   23    1   23 o  150.619   3.7106  495.440   20.703  528.044   24.880  422.053   37.328  159.496   3.7822  141.742   6.3851 17.75381 7.421260 
1 1 1   23    1   24 o   37.002   5.4637   30.127   8.0685   30.595   11.514   29.675   11.310   37.288   7.7403   36.717   7.7135 0.5707893 10.92747 
1 1 1   23    1   25 o   31.090   6.0869   21.271   8.1305   17.515   11.212   25.436   11.807   28.412   8.7271   33.768   8.4875 -5.356058 12.17373 
1 1 1   23    1   26 o   98.057   2.9232  200.267   11.813  210.927   16.854  189.971   16.564  100.639   4.0603   95.475   4.2063 5.164169 5.846326 
1 1 1   23    1   27 o   34.907   5.8491   26.260   8.4978   16.304   11.211   39.706   13.028   27.456   8.7693   42.359   7.7426 -14.90353 11.69822 
1 1 1   23    1   28 o   86.727   3.8948  159.391   13.387  160.583   16.807  157.321   22.140   87.471   4.6585   85.984   6.2431 1.487328 7.789597 
1 1 1   23    1   29 o   82.258   4.1682  146.773   13.508  132.066   22.017  155.651   17.105   78.489   6.8012   86.027   4.8209 -7.538635 8.336472 
1 1 1   23    1   30 o  120.417   4.0652  307.085   19.900  310.517   30.916  304.657   26.002  120.711   6.2097  120.122   5.2483 0.5891037 8.130494 
1 1 1   23    1   31 o   78.895   3.2790  131.031   10.650  142.412   15.332  120.418   14.806   82.245   4.5199   75.546   4.7517 6.698471 6.558067 
1 1 1   23    1   32 o   58.303   4.1750   72.689   10.036   69.995   14.097   75.457   14.290   57.182   5.9773   59.424   5.8304 -2.241924 8.349938 
1 1 1   23    1   33 o   71.848   3.9975  111.078   11.695  114.596   15.525  106.462   17.783   73.404   5.1281   70.292   6.1338 3.111168 7.995030 
1 1 1   23    1   34 o   22.822   6.2727   8.8040   8.4446   9.4253   12.518   8.2851   11.439   23.371   9.0721   22.273   8.6651 1.097740 12.54542 
1 1 1   23    1   35 o   33.349   6.5213   26.787   9.2904   24.999   13.377   28.454   12.913   32.219   9.4511   34.480   8.9881 -2.261242 13.04260 
1 1 1   23    1   36 o   29.030   6.8915   20.908   10.435   3.9436   20.259   27.033   12.174   24.500   10.677   33.560   8.7168 -9.059643 13.78300 
1 1 1   23    1   37 o   28.711   7.8183   16.909   13.704   5.4962   19.005   29.269   19.778   24.062   10.413   33.359   11.665 -9.296545 15.63665 
1 1 1   23    1   38 o   36.022   9.0724   36.159   17.033   42.193   24.830   30.796   23.411   38.261   13.086   33.783   12.570 4.477898 18.14485 
1 1 1   23    1   39 o   37.471   8.7081   39.394   17.099   18.553   23.726   61.917   24.665   28.827   12.016   46.115   12.607 -17.28855 17.41624 
1 1 1   23    1   40 o   31.107   12.984   26.105   27.756   0.0000   0.0000   26.105   27.756  ?   ?    31.107   12.984      ?      ? 
1 1 1   23    2    0 o   17.556   6.3939   9.3435   8.3730   9.3435   8.3730   9.3435   8.3730   17.556   9.0423   17.556   9.0423 0.000000 0.000000 
1 1 1   23    2    1 o  127.408   2.1703  335.224   11.404  332.841   16.092  337.630   16.165  126.952   3.0732  127.863   3.0653 -0.9104919 4.340592 
1 1 1   23    2    2 o   74.298   2.5764  114.110   7.8920  116.769   11.103  111.397   11.219   75.175   3.5811   73.421   3.7050 1.754539 5.152818 
1 1 1   23    2    3 o  192.314   2.2113  763.639   17.537  754.136   24.514  773.599   25.097  191.090   3.1104  193.538   3.1440 -2.447021 4.422608 
1 1 1   23    2    4 o  288.415   2.5639  1718.28   30.491  1743.50   43.719  1694.39   42.547  290.471   3.6492  286.358   3.6024 4.112946 5.127792 
1 1 1   23    2    5 f  269.215   2.4808  1497.44   27.545  1493.62   38.811  1501.31   39.100  268.871   3.4998  269.560   3.5168 -0.6889954 4.961552 
1 1 1   23    2    6 o  139.680   2.1429  402.923   12.345  403.573   17.504  402.280   17.414  139.792   3.0359  139.568   3.0251 0.2234650 4.285793 
1 1 1   23    2    7 o  228.615   2.3218  1079.03   21.884  1057.13   30.448  1102.42   31.475  226.220   3.2634  231.009   3.3035 -4.789490 4.643544 
1 1 1   23    2    8 o  198.182   2.2288  811.036   18.215  798.614   25.484  824.011   26.045  196.632   3.1423  199.732   3.1617 -3.100052 4.457627 
1 1 1   23    2    9 o  379.093   3.0219  2972.08   47.242  2995.86   67.476  2949.22   66.165  380.573   4.2988  377.613   4.2483 2.960571 6.043785 
1 1 1   23    2   10 o   41.898   3.7626   36.323   6.4879   39.784   9.3487   33.107   9.0113   43.826   5.1719   39.970   5.4663 3.856476 7.525217 
1 1 1   23    2   11 o   48.068   3.5107   47.886   6.9533   45.644   9.8640   50.101   9.8033   46.944   5.0946   49.193   4.8317 -2.249207 7.021434 
1 1 1   23    2   12 o  280.865   2.9228  1631.48   33.853  1643.18   48.344  1620.21   47.421  281.848   4.1587  279.881   4.1080 1.966888 5.845543 
1 1 1   23    2   13 o   52.586   3.2259   57.186   6.9887   61.098   10.042   53.511   9.7328   54.332   4.4811   50.840   4.6416 3.492016 6.451706 
1 1 1   23    2   14 o  169.153   2.2051  591.038   15.383  580.010   21.620  602.345   21.892  167.554   3.1284  170.752   3.1085 -3.197723 4.410163 
1 1 1   23    2   15 o  214.125   2.7816  950.675   23.373  955.918   28.949  940.857   39.612  215.076   3.2635  213.174   4.5053 1.901581 5.563121 
1 1 1   23    2   16 o  203.470   2.9144  852.008   23.995  832.521   30.901  881.608   38.083  200.622   3.7344  206.317   4.4754 -5.695190 5.828843 
1 1 1   23    2   17 o   74.118   3.2637  113.558   9.4103  114.747   16.318  112.966   11.518   74.347   5.3217   73.889   3.7796 0.4579163 6.527326 
1 1 1   23    2   18 o   97.905   2.8194  197.078   10.769  202.784   18.651  194.224   13.190   98.897   4.5725   96.912   3.2998 1.985527 5.638875 
1 1 1   23    2   19 o   59.159   3.6888   72.841   8.9862   70.005   12.907   75.509   12.519   58.024   5.3931   60.294   5.0343 -2.269402 7.377616 
1 1 1   23    2   20 o   22.130   6.0783   6.5102   8.0009   4.2472   11.487   8.6423   11.150   21.098   8.5279   23.162   8.6637 -2.064051 12.15668 
1 1 1   23    2   21 o  140.746   2.8799  407.961   16.489  428.126   25.787  394.013   21.446  143.609   4.3536  137.883   3.7711 5.726608 5.759823 
1 1 1   23    2   22 o   59.934   3.7916   74.524   9.3373   84.158   13.762   66.306   12.710   63.516   5.2535   56.352   5.4687 7.164452 7.583211 
1 1 1   23    2   23 o   68.313   3.7409   96.730   10.393   93.133   13.505  101.954   16.276   66.830   4.8997   69.795   5.6541 -2.965614 7.481752 
1 1 1   23    2   24 o   76.171   3.3346  121.238   10.451  118.423   15.209  123.756   14.385   75.297   4.8974   77.045   4.5270 -1.747955 6.669252 
1 1 1   23    2   25 o   72.079   3.3187  108.538   9.8658  107.693   13.916  109.391   13.989   71.796   4.6996   72.362   4.6871 -0.5663223 6.637393 
1 1 1   23    2   26 o   44.862   4.8945   43.998   8.5123   58.611   12.221   30.228   11.863   52.811   5.6106   36.912   8.0216 15.89897 9.789052 
1 1 1   23    2   27 o  116.613   3.2686  288.652   15.262  268.438   24.222  301.958   19.653  112.936   5.2002  120.290   3.9613 -7.353783 6.537107 
1 1 1   23    2   28 f   83.918   3.7824  153.483   12.294  164.888   15.349  133.077   20.532   88.781   4.1918   79.056   6.2971 9.725151 7.564733 
1 1 1   23    2   29 o  111.436   3.4389  260.930   15.463  262.935   24.575  259.615   19.895  111.563   5.3409  111.310   4.3336 0.2523422 6.877861 
1 1 1   23    2   30 o   56.081   4.2375   67.034   9.7726   64.574   14.204   69.246   13.467   55.024   6.2588   57.138   5.7143 -2.113365 8.475019 
1 1 1   23    2   31 f   39.870   5.5012   35.818   8.7213   35.658   12.283   35.981   12.386   39.784   7.7641   39.956   7.7957 -0.1715317 11.00243 
1 1 1   23    2   32 o   45.601   5.5715   46.678   10.021   44.454   15.556   48.256   13.102   43.963   8.8851   47.240   6.7248 -3.277328 11.14305 
1 1 1   23    2   33 o   42.792   6.9003   35.366   10.637   64.290   22.190   26.736   12.121   51.686   10.759   33.898   8.6431 17.78847 13.80061 
1 1 1   23    2   34 o   97.601   3.0708  201.403   12.362  202.333   17.499  200.477   17.465   97.829   4.3369   97.373   4.3487 0.4561996 6.141674 
1 1 1   23    2   35 o   58.851   4.0055   74.881   9.7119   74.819   14.055   74.939   13.435   58.762   5.7993   58.940   5.5268 -0.1776733 8.011044 
1 1 1   23    2   36 o   25.546   6.3892   14.168   8.4679   10.960   11.631   17.786   12.352   23.491   8.8364   27.601   9.2306 -4.109493 12.77833 
1 1 1   23    2   37 o   25.318   7.6096   2.7053   15.376   22.550   21.166 -19.4709   22.375   30.570   11.816   20.066   9.5917 10.50405 15.21914 
1 1 1   23    2   38 o   30.015   9.0773   17.113   20.628 -31.4051   47.869   28.177   22.859   27.302   13.288   32.728   12.371 -5.426386 18.15466 
1 1 1   23    2   39 o   25.734   8.1555   5.2169   18.046   11.325   24.895  -1.5460   26.196   26.996   11.798   24.472   11.263 2.524454 16.31105 
1 1 1   23    2   40 o   46.044   14.338   70.254   30.145   0.0000   0.0000   70.254   30.145  ?   ?    46.044   14.338      ?      ? 
1 1 1   23    3    0 o  178.753   2.1731  659.989   22.643  659.989   22.643  659.989   22.643  178.753   3.0733  178.753   3.0733 0.000000 0.000000 
1 1 1   23    3    1 o   63.511   2.7582   83.398   7.2155   88.984   10.268   77.950   10.142   65.617   3.7942   61.406   4.0043 4.210579 5.516356 
1 1 1   23    3    2 o  267.548   2.4718  1478.92   27.276  1478.31   38.599  1479.53   38.550  267.492   3.4986  267.603   3.4928 -0.1111755 4.943658 
1 1 1   23    3    3 o  255.774   2.4239  1351.51   25.570  1356.11   36.296  1346.97   36.029  256.206   3.4348  255.343   3.4211 0.8630829 4.847852 
1 1 1   23    3    4 o  127.786   2.1719  336.922   11.437  356.968   16.427  318.064   15.934  131.474   3.0294  124.099   3.1130 7.375877 4.343761 
1 1 1   23    3    5 o   33.402   4.5935   24.286   6.1281   16.097   8.7497   32.171   8.5856   27.392   7.5170   39.412   5.2817 -12.01938 9.187071 
1 1 1   23    3    6 o  127.806   2.1641  337.315   11.407  340.662   16.239  334.056   16.026  128.432   3.0657  127.181   3.0553 1.250885 4.328152 
1 1 1   23    3    7 o  241.674   2.3710  1206.63   23.633  1204.36   33.355  1208.91   33.491  241.447   3.3494  241.901   3.3568 -0.4548035 4.742030 
1 1 1   23    3    8 o  222.861   2.3051  1025.95   21.187  1019.97   29.797  1032.07   30.132  222.204   3.2513  223.517   3.2686 -1.312988 4.610271 
1 1 1   23    3    9 o  175.006   2.1837  631.968   15.754  653.201   22.718  612.296   21.867  177.834   3.0973  172.177   3.0792 5.656586 4.367471 
1 1 1   23    3   10 o  135.396   2.1864  378.539   12.207  384.181   17.466  373.152   17.068  136.381   3.1051  134.411   3.0788 1.970093 4.372743 
1 1 1   23    3   11 o  213.078   2.2857  937.723   20.085  951.599   28.714  924.430   28.104  214.620   3.2438  211.537   3.2212 3.083389 4.571498 
1 1 1   23    3   12 o  190.330   2.2321  748.344   17.521  737.553   24.696  759.280   24.863  188.947   3.1690  191.713   3.1443 -2.765427 4.464228 
1 1 1   23    3   13 o  218.933   2.3124  990.329   20.879  996.307   29.715  984.499   29.344  219.584   3.2810  218.281   3.2594 1.302307 4.624806 
1 1 1   23    3   14 o   27.919   5.2351   16.268   6.3426   10.061   8.6181   23.603   9.3682   22.781   7.7096   33.057   7.0842 -10.27568 10.47018 
1 1 1   23    3   15 o  212.063   2.7830  929.588   23.060  928.137   28.377  932.410   39.571  211.924   3.2465  212.202   4.5212 -0.2776642 5.566088 
1 1 1   23    3   16 o   72.918   3.0236  109.074   9.0480  120.769   13.650   99.907   12.084   76.368   4.3337   69.468   4.2176 6.900887 6.047268 
1 1 1   23    3   17 o  104.340   3.7822  236.640   12.658  209.220   28.392  243.442   14.142  100.160   6.8729  108.521   3.1595 -8.360725 7.564332 
1 1 1   23    3   18 o  234.054   2.8343  1136.31   25.298  1129.65   45.377  1139.32   30.474  233.366   4.7145  234.741   3.1476 -1.375076 5.668630 
1 1 1   23    3   19 o   44.538   5.2013   43.697   8.9716   50.046   11.809   35.030   13.797   49.022   5.8406   40.054   8.6082 8.968296 10.40257 
1 1 1   23    3   20 o   67.291   3.7183   94.052   10.271   95.286   15.326   93.046   13.839   67.665   5.4918   66.916   5.0143 0.7494812 7.436576 
1 1 1   23    3   21 o   86.255   3.8045  154.810   12.707  155.737   22.199  154.358   15.497   86.293   6.2374   86.218   4.3579 0.7408905E-01 7.608957 
1 1 1   23    3   22 o   37.528   5.4391   32.475   8.2739   16.970   12.272   45.398   11.203   28.472   9.1835   46.584   5.8310 -18.11208 10.87824 
1 1 1   23    3   23 o   38.017   5.7060   30.976   8.6514   23.758   11.402   40.770   13.282   32.781   8.3962   43.252   7.7289 -10.47147 11.41192 
1 1 1   23    3   24 o   88.457   2.9529  162.774   10.768  167.227   15.516  158.637   14.957   89.619   4.1977   87.295   4.1543 2.323448 5.905825 
1 1 1   23    3   25 o  107.914   2.7630  242.347   12.297  243.267   17.325  241.413   17.457  108.126   3.8849  107.702   3.9299 0.4239578 5.525980 
1 1 1   23    3   26 o  137.478   2.6569  393.629   15.047  408.456   21.063  378.173   21.505  140.160   3.6435  134.795   3.8681 5.365677 5.313899 
1 1 1   23    3   27 o  102.197   2.8546  218.009   12.022  220.621   17.409  215.628   16.621  102.759   4.1076  101.634   3.9650 1.124298 5.709102 
1 1 1   23    3   28 o   65.771   5.1389   93.672   12.489   94.479   14.771   91.650   23.392   66.900   5.3533   64.643   8.7736 2.256477 10.27786 
1 1 1   23    3   29 o   24.722   6.7325   10.285   9.1470   7.3273   17.218   11.448   10.797   25.292   10.359   24.152   8.6025 1.139406 13.46495 
1 1 1   23    3   30 o   82.581   3.3510  144.599   11.293  133.643   16.833  153.565   15.229   79.575   5.1289   85.587   4.3141 -6.012138 6.701971 
1 1 1   23    3   31 o   68.026   3.6789   98.395   10.261   86.056   14.463  110.900   14.560   63.605   5.5132   72.447   4.8727 -8.842224 7.357848 
1 1 1   23    3   32 o   93.831   3.4077  186.917   12.921  182.142   20.256  190.193   16.779   92.571   5.3053   95.091   4.2781 -2.520073 6.815326 
1 1 1   23    3   33 o   68.726   3.6893  100.468   10.436  102.311   15.314   98.870   14.259   69.253   5.3614   68.199   5.0694 1.053886 7.378592 
1 1 1   23    3   34 o   60.986   4.3340   80.340   10.828   78.118   14.418   83.214   16.397   60.174   5.8093   61.798   6.4333 -1.623940 8.668006 
1 1 1   23    3   35 o   28.698   6.2478   19.225   8.1985   22.865   11.749   15.770   11.446   31.007   8.7862   26.389   8.8850 4.617701 12.49565 
1 1 1   23    3   36 o   32.799   6.3753   29.128   10.937   42.717   13.117  -1.8733   19.813   42.953   7.6864   22.644   10.173 20.30929 12.75058 
1 1 1   23    3   37 o   31.235   6.8342   26.865   10.895   34.459   12.454   2.1118   22.485   37.954   8.1960   24.517   10.938 13.43671 13.66836 
1 1 1   23    3   38 o   34.427   8.4108   28.545   15.793   10.059   21.139   51.900   23.760   26.095   11.132   42.758   12.611 -16.66339 16.82159 
1 1 1   23    3   39 o   35.312   9.5327   38.498   19.839   45.916   26.233   28.586   30.323   38.346   13.433   32.277   13.530 6.069092 19.06534 
1 1 1   23    3   40 o   30.295   9.8275   16.940   25.786   25.004   48.684   13.795   30.400   32.267   15.025   28.324   12.672 3.942957 19.65505 
1 1 1   23    4    0 o  144.248   2.1432  429.964   18.014  429.964   18.014  429.964   18.014  144.248   3.0309  144.248   3.0309 0.000000 0.000000 
1 1 1   23    4    1 o   84.663   2.4249  148.145   8.4503  136.094   11.859  160.579   12.045   81.159   3.5427   88.168   3.3122 -7.009628 4.849867 
1 1 1   23    4    2 o  185.132   2.1938  707.704   16.750  717.220   23.909  698.532   23.472  186.353   3.1107  183.911   3.0944 2.442429 4.387687 
1 1 1   23    4    3 o  238.344   2.3541  1173.03   23.135  1192.76   33.202  1154.41   32.255  240.289   3.3501  236.399   3.3082 3.889572 4.708231 
1 1 1   23    4    4 o   24.391   5.3063   12.339   5.9193   9.9727   8.5378   14.530   8.2139   22.700   7.6737   26.082   7.3308 -3.381855 10.61256 
1 1 1   23    4    5 o  226.012   2.3093  1054.84   21.522  1071.25   30.831  1039.25   30.056  227.724   3.2826  224.301   3.2489 3.423248 4.618540 
1 1 1   23    4    6 o  129.076   2.1734  343.802   11.565  359.017   16.611  329.493   16.110  131.846   3.0548  126.306   3.0924 5.539963 4.346802 
1 1 1   23    4    7 o  172.377   2.1818  613.491   15.509  600.594   21.697  626.965   22.176  170.525   3.0849  174.229   3.0861 -3.703430 4.363554 
1 1 1   23    4    8 o   97.415   2.3211  196.057   9.3233  190.136   13.149  202.043   13.222   95.934   3.3232   98.897   3.2414 -2.962601 4.642211 
1 1 1   23    4    9 o  200.001   2.2451  825.780   18.514  846.260   26.591  806.511   25.793  202.405   3.1853  197.597   3.1648 4.808472 4.490234 
1 1 1   23    4   10 o  157.099   2.1808  509.667   14.129  518.820   20.137  500.791   19.830  158.488   3.0806  155.709   3.0877 2.778748 4.361694 
1 1 1   23    4   11 o  289.176   2.5844  1728.46   30.824  1723.25   43.439  1733.75   43.745  288.738   3.6476  289.613   3.6623 -0.8756409 5.168892 
1 1 1   23    4   12 o  175.996   2.3595  639.444   16.991  644.831   25.756  635.294   22.607  176.630   3.5355  175.362   3.1257 1.267883 4.719060 
1 1 1   23    4   13 o  176.416   2.4204  645.799   17.422  624.464   26.418  662.218   23.176  173.797   3.6855  179.035   3.1386 -5.238129 4.840823 
1 1 1   23    4   14 o  131.694   2.2287  357.197   12.084  339.509   16.497  377.673   17.750  128.190   3.1203  135.198   3.1832 -7.008057 4.457461 
1 1 1   23    4   15 o   32.690   5.8254   24.612   7.7471   28.445   9.1653   15.020   14.498   37.002   6.0057   28.379   9.9835 8.622400 11.65070 
1 1 1   23    4   16 o   79.697   2.9829  130.767   9.5228  134.619   15.533  128.447   12.054   80.596   4.6728   78.799   3.7088 1.797272 5.965774 
1 1 1   23    4   17 o  199.606   3.6154  832.934   23.871  816.767   52.854  837.077   26.755  197.997   6.4722  201.215   3.2238 -3.218323 7.230702 
1 1 1   23    4   18 o   69.492   3.2763   96.385   8.8423  111.334   15.833   89.609   10.660   73.203   5.2441   65.781   3.9289 7.422440 6.552613 
1 1 1   23    4   19 f   86.276   2.9519  154.203   10.498  156.538   15.154  152.049   14.557   86.898   4.2281   85.654   4.1205 1.243843 5.903828 
1 1 1   23    4   20 o   23.357   6.2896   6.0726   8.6979   14.934   13.312  -0.5278   11.489   27.730   9.5772   18.984   8.1555 8.746519 12.57914 
1 1 1   23    4   21 o   62.625   4.0606   81.735   10.285   82.732   16.256   81.070   13.282   62.867   6.2695   62.382   5.1622 0.4856224 8.121209 
1 1 1   23    4   22 o   80.278   3.1740  133.952   10.495  136.169   15.294  131.979   14.429   80.890   4.5841   79.666   4.3913 1.224594 6.348025 
1 1 1   23    4   23 o   75.954   3.5903  121.985   11.071  131.482   14.801  109.921   16.681   79.451   4.5166   72.456   5.5821 6.995316 7.180502 
1 1 1   23    4   24 f   65.726   3.9096   87.652   10.423   72.169   13.422  111.174   16.543   58.649   5.5486   72.802   5.5094 -14.15252 7.819223 
1 1 1   23    4   25 o   48.002   5.9839   60.820   10.191   26.373   17.321   79.059   12.603   34.537   10.886   61.467   4.9714 -26.92980 11.96774 
1 1 1   23    4   26 o   64.676   3.5055   87.805   9.3301   83.896   13.446   91.436   12.957   63.243   5.1547   66.108   4.7522 -2.864548 7.011039 
1 1 1   23    4   27 o   57.857   3.7615   70.600   8.9615   65.498   12.570   75.873   12.779   55.694   5.4723   60.020   5.1623 -4.326374 7.522963 
1 1 1   23    4   28 o   64.392   4.8604   89.060   11.656   89.348   13.831   88.356   21.652   65.106   5.1507   63.677   8.2441 1.429287 9.720868 
1 1 1   23    4   29 o   69.222   4.2450  102.282   11.432  100.494   19.623  103.201   14.066   68.408   6.9548   70.035   4.8694 -1.627304 8.490069 
1 1 1   23    4   30 o   33.108   6.0646   24.742   8.3718   29.327   12.374   20.871   11.369   35.876   8.4939   30.340   8.6586 5.535851 12.12921 
1 1 1   23    4   31 o   35.878   5.7012   30.057   8.6330   17.137   12.654   41.305   11.807   27.961   9.3427   43.796   6.5367 -15.83527 11.40243 
1 1 1   23    4   32 o   20.878   5.7411   3.7938   7.7758   13.953   11.315  -5.2970   10.704   25.624   8.8307   16.131   7.3389 9.492767 11.48224 
1 1 1   23    4   33 o   50.641   4.4941   55.820   9.3097   48.858   13.333   62.443   13.005   47.358   6.8262   53.923   5.8473 -6.564724 8.988231 
1 1 1   23    4   34 o   63.971   4.1518   87.866   10.885   83.393   14.467   93.703   16.526   62.223   5.6372   65.720   6.0969 -3.497280 8.303617 
1 1 1   23    4   35 o   54.107   4.2684   64.140   9.4561   57.407   13.635   70.380   13.125   51.143   6.4641   57.070   5.5762 -5.927387 8.536885 
1 1 1   23    4   36 o   63.615   5.2269   96.574   12.184  105.831   14.792   77.035   21.489   70.071   5.1181   57.159   9.1152 12.91204 10.45378 
1 1 1   23    4   37 o   24.729   7.2416   9.8984   10.922   10.140   12.569   9.1530   22.071   23.188   9.0657   26.269   11.295 -3.081697 14.48321 
1 1 1   23    4   38 o   38.259   8.8336   41.456   16.043   37.620   22.109   45.722   23.317   36.573   12.348   39.946   12.635 -3.373539 17.66721 
1 1 1   23    4   39 o   39.208   11.273   46.962   25.803   96.050   49.864   29.012   30.153   46.128   18.051   32.289   13.510 13.83844 22.54672 
1 1 1   23    4   40 o   44.899   10.902   82.845   27.947   51.020   53.478   94.803   32.779   35.818   16.338   53.980   14.441 -18.16189 21.80490 
1 1 1   23    4   41 o   27.330   12.014   16.297   26.155   0.0000   0.0000   16.297   26.155  ?   ?    27.330   12.014      ?      ? 
1 1 1   23    5    0 o   85.730   2.3753  152.396   11.836  152.396   11.836  152.396   11.836   85.730   3.3591   85.730   3.3591 0.000000 0.000000 
1 1 1   23    5    1 o  236.587   2.3540  1156.25   22.970  1161.52   32.612  1151.06   32.358  237.121   3.3345  236.053   3.3236 1.068039 4.708025 
1 1 1   23    5    2 o  194.343   2.2184  779.728   17.777  795.896   25.490  764.417   24.806  196.302   3.1483  192.383   3.1262 3.919128 4.436800 
1 1 1   23    5    3 o  201.184   2.2306  835.872   18.507  827.409   25.963  844.616   26.390  200.150   3.1450  202.218   3.1641 -2.068604 4.461233 
1 1 1   23    5    4 o   73.757   2.5599  112.440   7.7848  108.970   10.998  115.924   11.021   72.614   3.6721   74.900   3.5676 -2.285515 5.119798 
1 1 1   23    5    5 f   45.239   3.4693   42.364   6.4729   43.005   9.1884   41.733   9.1200   45.579   4.8878   44.898   4.9249 0.6800804 6.938685 
1 1 1   23    5    6 o   91.442   2.3419  172.685   8.8289  179.728   12.602  165.896   12.373   93.274   3.2759   89.610   3.3477 3.664673 4.683804 
1 1 1   23    5    7 o  109.645   2.2510  248.288   10.179  251.823   14.513  244.866   14.279  110.413   3.1870  108.878   3.1797 1.535439 4.501983 
1 1 1   23    5    8 o  129.492   2.1818  346.339   11.652  346.604   16.400  346.070   16.557  129.543   3.0696  129.441   3.1013 0.1018372 4.363533 
1 1 1   23    5    9 f  103.001   2.3032  219.173   9.7844  220.274   13.828  218.069   13.847  103.260   3.2467  102.741   3.2677 0.5193176 4.606419 
1 1 1   23    5   10 o  189.564   2.4125  742.193   18.659  740.236   24.629  744.829   28.585  189.299   3.1545  189.830   3.6509 -0.5314636 4.824991 
1 1 1   23    5   11 o   90.774   2.5894  169.100   9.6361  159.850   12.812  181.148   14.622   87.944   3.5322   93.604   3.7873 -5.659828 5.178854 
1 1 1   23    5   12 o   71.104   2.8101  103.646   8.2046  115.970   12.293   93.745   11.018   74.882   3.9802   67.326   3.9678 7.556068 5.620117 
1 1 1   23    5   13 o  396.764   3.1309  3258.27   51.235  3254.43   72.372  3262.13   72.543  396.531   4.4252  396.998   4.4304 -0.4673157 6.261791 
1 1 1   23    5   14 o  212.956   2.9849  920.029   25.437  866.828   31.889  1013.09   42.178  204.733   3.7765  221.179   4.6235 -16.44537 5.969857 
1 1 1   23    5   15 o  210.368   2.7946  910.796   22.878  901.022   27.973  930.541   39.759  208.788   3.2484  211.949   4.5482 -3.161102 5.589108 
1 1 1   23    5   16 o  110.864   3.0041  257.850   12.135  247.409   23.276  261.747   14.220  109.190   5.1684  112.537   3.0637 -3.346855 6.008198 
1 1 1   23    5   17 o   59.765   4.1661   78.380   8.8758   66.029   16.959   83.039   10.416   56.203   7.3159   63.328   3.9880 -7.125313 8.332247 
1 1 1   23    5   18 o  107.725   2.9963  238.136   13.072  252.779   20.800  228.578   16.805  110.391   4.5685  105.059   3.8783 5.331650 5.992687 
1 1 1   23    5   19 o  100.131   3.0212  210.260   12.297  190.969   18.514  225.488   16.449   95.920   4.6797  104.341   3.8223 -8.421288 6.042305 
1 1 1   23    5   20 o   77.576   3.8818  133.340   11.632   93.755   18.069  161.353   15.200   66.952   6.5433   88.199   4.1784 -21.24741 7.763655 
1 1 1   23    5   21 o  115.974   3.0747  282.912   14.144  266.476   23.083  292.794   17.898  113.114   4.9477  118.834   3.6517 -5.720566 6.149417 
1 1 1   23    5   22 o  111.343   2.7851  257.817   12.758  251.404   18.578  263.540   17.551  110.000   4.0949  112.687   3.7762 -2.686432 5.570257 
1 1 1   23    5   23 o   26.476   5.2590   11.429   7.7053   29.613   10.979  -6.2179   10.816   36.744   7.4988   16.209   7.3755 20.53462 10.51807 
1 1 1   23    5   24 o  113.972   3.0278  273.455   13.951  286.213   18.275  255.637   21.597  117.323   3.7767  110.620   4.7336 6.702957 6.055636 
1 1 1   23    5   25 o   72.182   3.3578  108.956   9.9845  102.764   14.112  115.163   14.128   70.100   4.8810   74.264   4.6126 -4.163895 6.715674 
1 1 1   23    5   26 o   38.567   5.4215   32.699   8.4425   27.250   11.977   38.082   11.903   34.841   8.4268   42.294   6.8234 -7.453533 10.84291 
1 1 1   23    5   27 o   22.457   6.5661   4.1616   9.0890   2.6410   10.767   7.9329   16.955   19.459   8.1016   25.454   10.335 -5.994900 13.13226 
1 1 1   23    5   28 o   65.002   3.7020   89.707   9.8546   95.846   13.488   82.680   14.432   67.508   4.8444   62.497   5.5991 5.011620 7.403912 
1 1 1   23    5   29 o   92.880   2.9879  180.605   11.445  180.205   16.250  180.999   16.123   92.770   4.2470   92.989   4.2039 -0.2182846 5.975748 
1 1 1   23    5   30 o   33.524   6.1762   29.267   9.7354   3.3501   18.875   38.661   11.364   24.607   10.509   42.440   6.4919 -17.83337 12.35238 
1 1 1   23    5   31 o   71.602   4.0804  112.564   11.505   96.754   18.470  122.588   14.707   66.963   6.6875   76.241   4.6771 -9.278458 8.160804 
1 1 1   23    5   32 o  103.006   3.6101  227.340   14.775  233.281   18.715  217.512   24.071  105.238   4.3117  100.773   5.7914 4.464790 7.220185 
1 1 1   23    5   33 o   19.018   5.7724   0.9913   8.1171   1.6104   11.814   0.4376   11.172   19.488   8.3180   18.549   8.0057 0.9387512 11.54473 
1 1 1   23    5   34 o   70.638   3.8276  105.711   11.068   94.360   14.619  120.957   16.943   66.293   5.3468   74.983   5.4784 -8.690056 7.655141 
1 1 1   23    5   35 o  102.948   3.1877  224.595   13.508  208.965   18.451  242.650   19.830   99.099   4.5142  106.797   4.5019 -7.697739 6.375353 
1 1 1   23    5   36 o   45.672   7.1389   56.997   12.109   63.164   14.104   39.709   23.614   53.419   6.4015   37.925   12.762 15.49329 14.27773 
1 1 1   23    5   37 o   29.694   7.6916   11.587   10.791   3.3115   12.078   44.330   24.024   19.872   8.4446   39.515   12.858 -19.64299 15.38323 
1 1 1   23    5   38 o   60.220   7.1019   90.225   17.205   80.655   23.204  101.911   25.642   56.126   10.407   64.315   9.6667 -8.189079 14.20381 
1 1 1   23    5   39 o   27.849   9.4967 -17.6250   22.759   52.019   52.937 -33.4165   25.208   36.672   16.538   19.026   9.3401 17.64593 18.99336 
1 1 1   23    5   40 o   57.135   10.478  126.196   27.822   90.545   52.791  139.906   32.738   42.377   17.812   71.892   11.041 -29.51478 20.95627 
1 1 1   23    5   41 f   24.746   11.372   4.6293   26.558   0.0000   0.0000   4.6293   26.558  ?   ?    24.746   11.372      ?      ? 
1 1 1   23    6    0 o  308.345   2.6575  1963.76   47.780  1963.76   47.780  1963.76   47.780  308.345   3.7583  308.345   3.7583 0.000000 0.000000 
1 1 1   23    6    1 o   71.772   2.6148  106.472   7.7391  108.808   10.946  104.137   10.943   72.561   3.6576   70.983   3.7379 1.577744 5.229698 
1 1 1   23    6    2 o   59.205   2.9119   72.863   7.0663   81.213   9.9146   64.243   10.074   62.681   3.8351   55.729   4.3828 6.952099 5.823809 
1 1 1   23    6    3 o   89.009   2.3609  163.668   8.6659  167.438   12.300  159.953   12.212   90.028   3.3124   87.990   3.3650 2.037781 4.721775 
1 1 1   23    6    4 o  131.116   2.1622  355.063   11.693  356.635   16.529  353.489   16.542  131.407   3.0498  130.825   3.0658 0.5818024 4.324344 
1 1 1   23    6    5 o  127.761   2.1726  337.102   11.448  334.140   16.099  340.132   16.281  127.193   3.0688  128.328   3.0761 -1.134949 4.345136 
1 1 1   23    6    6 o  204.678   2.4423  865.446   20.380  864.476   26.858  866.762   31.292  204.573   3.1831  204.783   3.7049 -0.2101593 4.884512 
1 1 1   23    6    7 f   82.019   2.4931  138.873   8.4295  133.494   11.719  144.640   12.134   80.374   3.5352   83.663   3.5165 -3.288986 4.986266 
1 1 1   23    6    8 o  173.999   2.3444  627.399   16.734  604.912   24.726  646.406   22.732  171.094   3.5039  176.903   3.1156 -5.808533 4.688701 
1 1 1   23    6    9 o  177.269   2.4001  651.403   17.373  633.845   26.313  664.971   23.131  175.119   3.6431  179.420   3.1258 -4.301697 4.800261 
1 1 1   23    6   10 o   91.301   2.3877  172.298   8.9876  178.023   12.713  166.577   12.707   92.821   3.3208   89.781   3.4317 3.039635 4.775390 
1 1 1   23    6   11 o  179.512   2.2059  665.687   16.332  657.690   23.017  673.796   23.177  178.425   3.1277  180.598   3.1116 -2.173141 4.411820 
1 1 1   23    6   12 o   72.886   2.6782  109.786   8.0450  115.954   11.514  103.901   11.246   74.889   3.7276   70.884   3.8467 4.005043 5.356460 
1 1 1   23    6   13 o  116.727   2.2556  281.530   10.859  282.726   15.368  280.338   15.346  116.975   3.1853  116.479   3.1944 0.4957352 4.511168 
1 1 1   23    6   14 o   85.766   2.9462  150.878   10.024  147.390   12.494  157.178   16.792   84.428   3.5880   87.105   4.6741 -2.677185 5.892462 
1 1 1   23    6   15 o   27.028   5.2930   16.121   6.6429   23.189   8.6640   6.0396   10.348   32.793   6.6336   21.262   8.2497 11.53085 10.58599 
1 1 1   23    6   16 o   44.561   5.4855   44.701   8.3764   37.662   16.473   47.155   9.7279   41.446   9.7923   47.676   4.9471 -6.230087 10.97098 
1 1 1   23    6   17 o   70.029   3.7207  101.244   9.4318  103.224   18.550  100.554   10.953   70.365   6.3918   69.693   3.8106 0.6721191 7.441470 
1 1 1   23    6   18 o  208.575   2.6229  897.344   22.395  927.483   34.045  874.354   29.734  211.606   3.9008  205.543   3.5074 6.063538 5.245737 
1 1 1   23    6   19 o  167.107   2.7024  576.542   18.415  590.848   28.405  566.171   24.185  168.837   4.0791  165.376   3.5458 3.461090 5.404803 
1 1 1   23    6   20 o  179.857   2.8065  671.515   20.723  664.681   30.737  677.210   28.059  178.965   4.1641  180.748   3.7638 -1.782928 5.613026 
1 1 1   23    6   21 o   61.296   3.6620   78.453   9.2309   71.163   12.985   85.902   13.125   58.385   5.3922   64.207   4.9564 -5.822575 7.324031 
1 1 1   23    6   22 o   66.143   3.3999   91.483   9.2449   84.629   13.234   98.015   12.920   63.681   5.0387   68.605   4.5660 -4.924026 6.799831 
1 1 1   23    6   23 o   41.585   4.9383   37.104   8.2783   36.995   12.063   37.202   11.381   41.184   7.3724   41.987   6.5722 -0.8033180 9.876534 
1 1 1   23    6   24 o   92.990   4.8276  192.662   14.762  199.728   16.682  167.151   31.697   97.918   4.1307   88.061   8.7271 9.857086 9.655292 
1 1 1   23    6   25 o   79.915   3.0831  133.206   10.162  132.027   14.335  134.398   14.407   79.558   4.3687   80.273   4.3514 -0.7146988 6.166100 
1 1 1   23    6   26 o   65.678   3.5371   90.936   9.5445   83.264   13.650   98.275   13.351   62.893   5.2621   68.462   4.7282 -5.568558 7.074281 
1 1 1   23    6   27 o   74.456   4.6149  122.370   12.263  127.020   14.335  109.687   23.676   77.851   4.4646   71.062   8.0781 6.788628 9.229772 
1 1 1   23    6   28 o   42.316   5.1556   40.145   8.4191   60.352   12.256   22.091   11.585   53.396   5.5652   31.235   8.6804 22.16086 10.31120 
1 1 1   23    6   29 o   30.146   6.0704   20.251   8.2244   12.943   11.616   27.597   11.646   25.359   8.9346   34.933   8.2203 -9.573568 12.14088 
1 1 1   23    6   30 o   53.996   6.1648   75.567   11.246   44.178   20.130   89.810   13.560   42.833   11.250   65.159   5.0457 -22.32629 12.32958 
1 1 1   23    6   31 o   20.481   5.9058   2.7997   8.4662  -7.0768   12.821   10.437   11.274   17.369   7.9518   23.593   8.7339 -6.223248 11.81153 
1 1 1   23    6   32 o   74.412   3.4020  117.830   10.384  110.613   15.187  124.166   14.230   72.138   5.1043   76.685   4.4991 -4.547348 6.804087 
1 1 1   23    6   33 o   65.289   3.7054   90.521   9.9523   97.894   14.718   84.311   13.509   67.713   5.2701   62.864   5.2101 4.848671 7.410730 
1 1 1   23    6   34 o   33.456   6.2648   26.914   8.9222   21.161   12.977   32.072   12.287   29.901   9.4226   37.012   8.2587 -7.110937 12.52964 
1 1 1   23    6   35 o   92.248   3.5048  185.598   13.019  202.434   17.216  163.108   19.897   97.669   4.2737   86.828   5.5560 10.84069 7.009565 
1 1 1   23    6   36 o   42.733   7.3498   34.341   11.362   22.715   12.756   78.985   24.996   30.392   9.3039   55.074   11.380 -24.68204 14.69958 
1 1 1   23    6   37 o   61.355   6.0057   91.227   12.449   94.236   14.492   82.749   24.322   65.820   5.3383   56.890   10.760 8.930244 12.01132 
1 1 1   23    6   38 o   40.565   8.9450   48.723   16.640   51.496   20.827   43.826   27.671   43.368   11.468   37.762   13.731 5.605461 17.88996 
1 1 1   23    6   39 o   36.944   9.9007   44.577   21.419   31.783   31.125   56.086   29.520   32.904   13.743   40.985   14.255 -8.081272 19.80130 
1 1 1   23    6   40 o   29.427   9.8518  -3.4062   24.383   69.050   53.301 -22.5811   27.420   37.849   16.867   21.005   10.184 16.84383 19.70352 
1 1 1   23    6   41 f   33.363   13.639   39.466   29.779   0.0000   0.0000   39.466   29.779  ?   ?    33.363   13.639      ?      ? 
1 1 1   23    7    0 o  109.529   2.2458  248.223   14.321  248.223   14.321  248.223   14.321  109.529   3.1761  109.529   3.1761 0.000000 0.000000 
1 1 1   23    7    1 o   87.566   2.5905  157.120   9.2297  150.685   11.996  166.457   14.449   85.400   3.4057   89.732   3.9042 -4.331688 5.180915 
1 1 1   23    7    2 o   99.734   2.5020  206.180   10.156  209.619   13.383  201.511   15.594  100.735   3.2211   98.734   3.8294 2.001663 5.003960 
1 1 1   23    7    3 o  134.899   2.3311  375.986   12.854  375.645   19.521  376.246   17.078  134.829   3.5104  134.969   3.0679 -0.1398010 4.662103 
1 1 1   23    7    4 f  254.337   2.6103  1336.88   27.125  1337.58   41.287  1336.35   35.979  254.357   3.9355  254.317   3.4301 0.3979492E-01 5.220519 
1 1 1   23    7    5 o  157.922   2.1727  514.949   14.150  504.170   19.819  526.154   20.208  156.237   3.0757  159.607   3.0698 -3.370407 4.345464 
1 1 1   23    7    6 o  116.843   2.2166  281.987   10.682  283.306   15.162  280.688   15.051  117.113   3.1390  116.572   3.1304 0.5417328 4.433153 
1 1 1   23    7    7 o  340.479   2.8264  2396.76   39.686  2379.62   55.634  2414.51   56.629  339.245   3.9761  341.713   4.0180 -2.468292 5.652810 
1 1 1   23    7    8 o  130.642   2.1829  352.296   11.757  365.987   16.866  339.353   16.399  133.111   3.0720  128.174   3.1021 4.936996 4.365788 
1 1 1   23    7    9 o  182.814   2.2116  690.371   16.675  686.913   23.435  693.916   23.731  182.351   3.1160  183.276   3.1393 -0.9248199 4.423197 
1 1 1   23    7   10 o  203.307   2.2619  853.768   18.964  840.509   26.557  867.563   27.089  201.697   3.1923  204.916   3.2051 -3.218887 4.523701 
1 1 1   23    7   11 o   39.965   4.1887   33.768   6.6794   28.434   9.4128   39.178   9.4797   36.455   6.4986   43.475   5.2868 -7.019779 8.377488 
1 1 1   23    7   12 o  164.748   2.3785  561.673   16.005  555.491   24.321  566.396   21.257  163.922   3.5973  165.574   3.1127 -1.652267 4.757034 
1 1 1   23    7   13 f  102.377   2.8370  215.522   11.819  224.766   18.442  209.079   15.396  104.204   4.2910  100.549   3.7125 3.654877 5.674074 
1 1 1   23    7   14 o   95.220   3.7478  190.892   11.784  192.792   13.217  183.527   26.022   96.571   3.3183   93.869   6.7212 2.702011 7.495696 
1 1 1   23    7   15 f  141.546   2.4195  413.434   13.918  419.478   21.685  409.201   18.149  142.391   3.6925  140.700   3.1274 1.690826 4.838940 
1 1 1   23    7   16 o  208.368   2.8457  889.148   21.914  921.593   41.899  876.930   25.712  210.768   4.8198  205.969   3.0267 4.798782 5.691340 
1 1 1   23    7   17 o  118.023   2.8724  277.415   12.371  312.733   24.606  265.468   14.311  122.737   4.8606  113.309   3.0622 9.428093 5.744806 
1 1 1   23    7   18 o  215.966   2.6923  965.515   23.968  920.939   33.532  1012.08   34.272  210.860   3.8556  221.072   3.7588 -10.21198 5.384617 
1 1 1   23    7   19 f   85.072   3.9311  155.671   12.378  139.333   22.690  162.592   14.769   81.589   6.7426   88.556   4.0435 -6.966599 7.862124 
1 1 1   23    7   20 o   46.768   4.4708   45.827   8.6168   45.793   12.437   45.858   11.950   46.736   6.4520   46.800   6.1908 -0.6344986E-01 8.941691 
1 1 1   23    7   21 o   30.748   5.7160   20.427   7.6152   28.724   11.014   12.828   10.540   36.216   7.6154   25.281   8.5263 10.93554 11.43206 
1 1 1   23    7   22 o   98.764   2.8136  202.743   11.451  191.870   16.084  213.919   16.307   96.062   4.0596  101.465   3.8967 -5.402145 5.627153 
1 1 1   23    7   23 o   50.401   4.1789   53.665   8.6350   47.369   12.274   59.834   12.150   47.398   6.2789   53.404   5.5161 -6.006374 8.357727 
1 1 1   23    7   24 o  120.011   2.9684  301.459   14.443  307.819   18.890  292.508   22.409  121.664   3.7646  118.359   4.5905 3.304649 5.936728 
1 1 1   23    7   25 o   33.460   5.8874   25.081   8.0962   23.617   11.745   26.407   11.176   32.492   8.6216   34.428   8.0196 -1.936539 11.77475 
1 1 1   23    7   26 o   77.529   3.1809  125.977   10.169  124.061   14.450  127.857   14.314   76.929   4.5541   78.128   4.4421 -1.198990 6.361823 
1 1 1   23    7   27 o   63.724   5.1242   93.080   11.427   99.477   13.371   75.751   22.008   68.823   4.7105   58.626   9.1016 10.19691 10.24833 
1 1 1   23    7   28 o   83.227   3.1245  145.107   10.720  149.428   15.448  141.093   14.889   84.415   4.4371   82.038   4.4003 2.376808 6.249021 
1 1 1   23    7   29 o   33.483   5.7954   25.562   8.1928   34.616   11.586   16.507   11.587   39.457   7.3909   27.509   8.9286 11.94755 11.59078 
1 1 1   23    7   30 o   85.534   5.3498  167.106   14.341  147.497   32.617  171.805   15.967   80.649   9.8056   90.420   4.2814 -9.771034 10.69953 
1 1 1   23    7   31 o   72.248   3.5295  111.108   10.455   99.108   14.951  122.589   14.625   68.287   5.3086   76.209   4.6528 -7.922447 7.059015 
1 1 1   23    7   32 o   64.104   3.7308   87.754   9.8275   84.952   14.383   90.208   13.459   63.039   5.5319   65.168   5.0075 -2.128860 7.461664 
1 1 1   23    7   33 o   29.282   5.9852   19.723   8.4636   7.5985   12.432   30.196   11.555   22.412   8.9365   36.151   7.9644 -13.73945 11.97049 
1 1 1   23    7   34 o   44.583   5.2422   44.978   9.1913   58.665   13.402   32.824   12.629   51.822   6.2702   37.344   8.4029 14.47870 10.48446 
1 1 1   23    7   35 o   28.251   7.7159   17.176   10.917   19.228   11.713   3.5887   30.136   28.475   8.9485   28.027   12.572 0.4477520 15.43183 
1 1 1   23    7   36 o   48.647   7.0355   65.147   12.147   72.286   14.158   45.237   23.645   57.276   5.9935   40.019   12.731 17.25665 14.07101 
1 1 1   23    7   37 o   23.960   7.1201   8.6088   10.705   9.8124   12.141   4.4056   22.689   22.815   8.9128   25.106   11.106 -2.291323 14.24028 
1 1 1   23    7   38 o   28.276   8.7658   12.353   20.196  -2.1764   30.682   23.462   26.828   25.806   11.987   30.745   12.793 -4.939728 17.53151 
1 1 1   23    7   39 o   33.382   9.4925   33.262   19.815   37.625   30.562   30.098   26.025   34.468   13.918   32.296   12.912 2.172169 18.98498 
1 1 1   23    7   40 o   26.853   11.966 -20.6528   23.838 -146.5864   52.035   12.795   26.817  ?   ?    26.853   11.966      ?      ? 
1 1 1   23    7   41 o   21.598   10.405 -15.2694   27.520   0.0000   0.0000 -15.2694   27.520  ?   ?    21.598   10.405      ?      ? 
1 1 1   23    8    0 o   93.409   2.3962  180.812   13.017  180.812   13.017  180.812   13.017   93.409   3.3888   93.409   3.3888 0.000000 0.000000 
1 1 1   23    8    1 o  257.235   2.6325  1364.21   27.568  1346.53   36.086  1388.98   42.724  255.284   3.4273  259.187   3.9967 -3.903259 5.264941 
1 1 1   23    8    2 o  232.991   2.5317  1122.02   24.092  1123.19   31.933  1120.47   36.705  233.167   3.3205  232.816   3.8225 0.3506622 5.063331 
1 1 1   23    8    3 o  300.132   2.8402  1865.21   34.866  1841.44   52.643  1883.80   46.535  298.372   4.2778  301.891   3.7373 -3.519806 5.680431 
1 1 1   23    8    4 o  228.297   2.5261  1079.36   23.571  1059.60   35.644  1094.72   31.423  226.401   3.8172  230.192   3.3097 -3.790817 5.052250 
1 1 1   23    8    5 o  124.191   2.1870  318.472   11.198  306.842   15.697  330.525   15.980  121.881   3.1227  126.501   3.0629 -4.620064 4.374032 
1 1 1   23    8    6 o  249.064   2.4103  1281.79   24.760  1283.86   35.012  1279.72   35.019  249.266   3.4056  248.862   3.4118 0.4039459 4.820587 
1 1 1   23    8    7 o  112.702   2.2534  262.402   10.474  263.294   14.845  261.518   14.781  112.893   3.1883  112.512   3.1852 0.3813248 4.506707 
1 1 1   23    8    8 o  145.005   2.3387  434.271   13.870  435.957   21.037  432.974   18.448  145.236   3.5118  144.774   3.0895 0.4617462 4.677361 
1 1 1   23    8    9 o  185.424   2.4164  710.690   18.273  711.485   24.113  709.617   28.005  185.576   3.1503  185.273   3.6648 0.3031311 4.832766 
1 1 1   23    8   10 o  116.064   2.4490  278.947   11.546  281.557   15.114  275.289   17.894  116.740   3.1390  115.387   3.7600 1.352448 4.898068 
1 1 1   23    8   11 o  112.527   2.2668  261.629   10.520  264.386   14.917  258.900   14.838  113.118   3.1974  111.937   3.2140 1.180923 4.533542 
1 1 1   23    8   12 f  164.225   2.2031  557.285   14.919  558.135   20.879  556.398   21.325  164.356   3.0801  164.093   3.1509 0.2633972 4.406263 
1 1 1   23    8   13 o   46.830   3.7752   45.811   7.2290   48.384   9.7832   42.717   10.729   48.310   4.9099   45.350   5.7360 2.960384 7.550415 
1 1 1   23    8   14 o  181.932   2.4221  685.690   17.977  693.075   23.806  675.892   27.422  183.112   3.1521  180.752   3.6784 2.360199 4.844197 
1 1 1   23    8   15 o   56.513   3.4911   66.095   7.9639   67.097   12.676   65.441   10.237   56.831   5.4077   56.194   4.4167 0.6372681 6.982180 
1 1 1   23    8   16 o  126.781   2.8385  326.929   13.407  346.983   25.438  319.216   15.776  129.308   4.7698  124.253   3.0785 5.055275 5.676919 
1 1 1   23    8   17 o   28.987   5.4083   20.923   7.4756  -3.3709   15.448   28.352   8.5425   21.065   9.2472   36.909   5.6117 -15.84394 10.81670 
1 1 1   23    8   18 o   97.224   2.6402  195.006   10.289  199.040   16.722  192.549   13.052   97.982   4.1377   96.466   3.2804 1.515976 5.280338 
1 1 1   23    8   19 o  103.622   3.4879  222.467   12.500  225.224   26.234  221.657   14.217  103.783   6.1288  103.461   3.3318 0.3217468 6.975891 
1 1 1   23    8   20 o   89.958   3.1558  169.530   11.616  154.997   17.046  182.130   15.872   86.275   4.7904   93.642   4.1096 -7.366623 6.311596 
1 1 1   23    8   21 o  101.520   2.7671  214.062   11.586  215.746   16.459  212.408   16.311  101.915   3.9157  101.125   3.9108 0.7905350 5.534133 
1 1 1   23    8   22 o   71.371   3.3878  107.274   9.8634   90.396   14.081  123.534   13.821   65.734   5.1936   77.007   4.3515 -11.27364 6.775597 
1 1 1   23    8   23 o  125.321   3.1075  333.720   15.738  371.844   21.109  286.007   23.615  133.702   3.8280  116.940   4.8962 16.76221 6.214997 
1 1 1   23    8   24 f   82.300   3.0845  141.219   10.468  144.238   14.959  138.322   14.655   83.162   4.3613   81.438   4.3630 1.723564 6.168968 
1 1 1   23    8   25 o  142.570   3.8220  440.754   19.746  456.217   23.226  400.429   37.507  147.962   3.8059  137.178   6.6291 10.78362 7.643978 
1 1 1   23    8   26 o   82.023   3.2359  141.371   10.904  144.581   14.886  137.654   16.018   83.098   4.3434   80.948   4.7978 2.149193 6.471780 
1 1 1   23    8   27 o   65.866   4.4015   91.443   11.159   89.734   13.497   95.132   19.834   65.273   5.0137   66.460   7.2358 -1.187752 8.803065 
1 1 1   23    8   28 f   61.872   3.6809   80.690   9.3845   85.740   13.477   75.937   13.075   63.771   5.1241   59.973   5.2859 3.798004 7.361838 
1 1 1   23    8   29 o   49.484   4.5107   53.330   8.9847   40.829   12.798   65.479   12.616   43.431   7.1447   55.536   5.5080 -12.10460 9.021345 
1 1 1   23    8   30 o   28.717   8.1195   12.935   11.031   14.853   30.107   12.638   11.855   32.338   13.513   25.095   9.0062 7.243448 16.23895 
1 1 1   23    8   31 f   33.399   5.3938   25.607   8.4057   6.1962   12.090   43.768   11.694   21.739   8.7621   45.059   6.2926 -23.32022 10.78759 
1 1 1   23    8   32 o   27.070   6.2878   15.908   8.0323   19.553   12.566   13.389   10.445   29.201   9.2796   24.939   8.4873 4.262022 12.57558 
1 1 1   23    8   33 o   38.941   5.5209   34.901   8.5574   36.859   12.235   33.026   11.973   40.099   7.6774   37.783   7.9358 2.316589 11.04172 
1 1 1   23    8   34 o   24.713   6.0768   11.523   8.1045   21.363   12.072   3.4503   10.935   29.961   9.0256   19.465   8.1394 10.49585 12.15363 
1 1 1   23    8   35 o   47.390   9.9077   52.633   12.834   50.699   13.215   84.731   53.826   47.749   6.7103   47.031   18.645 0.7178574 19.81535 
1 1 1   23    8   36 o   27.809   7.6699   13.812   11.230   9.3157   12.923   27.677   22.695   22.934   9.1218   32.685   12.333 -9.750587 15.33971 
1 1 1   23    8   37 o   21.863   6.9101   1.1485   10.720   0.2547   12.117   4.3667   22.992   18.638   8.1857   25.089   11.135 -6.450848 13.82028 
1 1 1   23    8   38 o   33.314   9.4797   31.706   19.639   39.377   31.049   26.589   25.356   35.254   14.101   31.375   12.674 3.878443 18.95942 
1 1 1   23    8   39 o   22.649   7.6748 -17.0621   20.020  -4.9425   31.087 -25.6497   26.168   25.004   11.760   20.295   9.8650 4.708818 15.34964 
1 1 1   23    8   40 f   30.589   9.7232   26.918   25.553   8.3718   51.783   32.888   29.380   29.288   14.151   31.889   13.339 -2.600954 19.44646 
1 1 1   23    8   41 o   24.034   11.229   0.4723   27.558   0.0000   0.0000   0.4723   27.558  ?   ?    24.034   11.229      ?      ? 
1 1 1   23    9    0 o  332.989   2.7829  2290.54   54.035  2290.54   54.035  2290.54   54.035  332.989   3.9356  332.989   3.9356 0.000000 0.000000 
1 1 1   23    9    1 o   98.716   2.3064  201.285   9.3860  210.041   13.372  192.782   13.177  100.834   3.2154   96.598   3.3075 4.236465 4.612807 
1 1 1   23    9    2 o  275.689   2.5168  1570.72   28.618  1568.70   40.421  1572.76   40.523  275.511   3.5572  275.867   3.5615 -0.3556519 5.033669 
1 1 1   23    9    3 o  207.726   2.4337  889.606   20.618  905.096   31.737  878.295   27.120  209.257   3.6773  206.195   3.1890 3.062759 4.867419 
1 1 1   23    9    4 o  186.042   2.3857  715.479   18.150  712.750   27.494  717.587   24.163  185.703   3.5897  186.381   3.1432 -0.6772461 4.771355 
1 1 1   23    9    5 o  141.476   2.3571  415.011   13.595  423.607   18.019  403.652   20.715  143.205   3.0508  139.747   3.5939 3.457977 4.714194 
1 1 1   23    9    6 o   58.693   3.1983   70.314   7.6737   64.272   10.067   78.696   11.856   55.731   4.3795   61.655   4.6624 -5.923531 6.396698 
1 1 1   23    9    7 o  252.182   2.6174  1315.04   26.948  1316.74   35.676  1312.77   41.121  252.417   3.4268  251.947   3.9572 0.4700623 5.234724 
1 1 1   23    9    8 o  105.870   2.4971  232.435   10.771  226.571   16.459  236.828   14.246  104.678   3.8123  107.061   3.2261 -2.383728 4.994142 
1 1 1   23    9    9 o  166.024   2.3858  568.474   16.130  576.899   24.953  562.426   21.141  167.052   3.6217  164.997   3.1066 2.055588 4.771557 
1 1 1   23    9   10 o   89.811   2.4129  166.592   8.9305  176.309   12.802  157.380   12.464   92.363   3.3605   87.258   3.4634 5.104713 4.825748 
1 1 1   23    9   11 o  236.431   2.3698  1155.42   23.109  1160.07   32.699  1150.77   32.663  236.907   3.3465  235.954   3.3563 0.9527893 4.739604 
1 1 1   23    9   12 o  193.742   2.3866  777.011   18.956  785.463   25.524  766.616   28.307  194.946   3.1745  192.538   3.5646 2.408524 4.773192 
1 1 1   23    9   13 f  127.737   2.6255  330.091   13.238  313.126   16.299  362.964   22.689  123.074   3.2110  132.400   4.1549 -9.325485 5.251077 
1 1 1   23    9   14 o  136.913   2.4079  389.413   13.421  399.145   17.741  376.391   20.522  138.956   3.0955  134.869   3.6893 4.086655 4.815879 
1 1 1   23    9   15 o  111.472   2.4826  257.672   11.180  254.286   17.629  259.950   14.460  110.819   3.8569  112.124   3.1268 -1.305054 4.965147 
1 1 1   23    9   16 o  111.700   2.5321  261.878   11.358  241.058   17.851  276.039   14.722  107.865   4.0126  115.536   3.0894 -7.670845 5.064128 
1 1 1   23    9   17 o  195.059   2.8445  801.982   21.600  746.282   36.591  831.772   26.760  189.603   4.6792  200.514   3.2358 -10.91132 5.689009 
1 1 1   23    9   18 o  147.333   2.9879  453.139   17.788  436.529   27.839  464.600   23.125  144.938   4.6570  149.727   3.7447 -4.788605 5.975805 
1 1 1   23    9   19 o   90.965   3.1907  172.856   10.802  170.241   20.146  173.912   12.798   90.314   5.4083   91.616   3.3869 -1.301857 6.381308 
1 1 1   23    9   20 o  111.870   2.8221  259.269   12.847  263.981   19.942  255.927   16.796  112.674   4.2912  111.065   3.6666 1.608757 5.644298 
1 1 1   23    9   21 o   72.865   3.2668  110.945   9.7907  102.609   13.945  119.049   13.750   70.124   4.8215   75.606   4.4093 -5.481422 6.533628 
1 1 1   23    9   22 o  116.639   2.6889  282.848   12.934  276.675   18.177  289.177   18.407  115.346   3.8209  117.933   3.7843 -2.586601 5.377720 
1 1 1   23    9   23 f  108.872   2.8141  247.212   12.603  238.749   18.303  254.842   17.381  107.054   4.1454  110.690   3.8070 -3.636749 5.628276 
1 1 1   23    9   24 o   85.607   3.0255  152.853   10.679  155.088   15.347  150.754   14.868   86.204   4.3165   85.009   4.2407 1.195511 6.051084 
1 1 1   23    9   25 o  105.829   4.5304  248.829   15.783  256.593   17.819  220.561   34.001  110.880   3.8965  100.777   8.1802 10.10330 9.060814 
1 1 1   23    9   26 o   31.138   7.0044   22.665   10.129   26.864   11.752   10.528   19.979   34.462   8.3546   27.813   11.245 6.649328 14.00889 
1 1 1   23    9   27 o   70.279   3.4717  103.897   10.060  106.874   14.435  101.085   14.028   71.257   4.9117   69.301   4.9078 1.955864 6.943492 
1 1 1   23    9   28 o   20.797   5.7139   4.5236   7.4743   12.360   10.864  -2.5175   10.299   24.718   8.6454   16.877   7.4734 7.841103 11.42775 
1 1 1   23    9   29 o   68.009   3.5930   97.988   10.070   94.508   14.334  101.379   14.150   66.773   5.2048   69.246   4.9546 -2.472618 7.185973 
1 1 1   23    9   30 o   55.822   7.7287   80.127   12.790   62.615   31.265   83.646   14.016   48.928   14.476   62.717   5.4186 -13.78888 15.45732 
1 1 1   23    9   31 o  132.144   4.3170  404.985   19.051  323.350   38.921  430.707   21.847  120.927   7.8035  143.362   3.6949 -22.43551 8.634069 
1 1 1   23    9   32 o   64.540   3.9051   88.231   10.305   97.109   15.887   81.783   13.539   67.217   5.7308   61.864   5.3064 5.352852 7.810206 
1 1 1   23    9   33 o   49.467   4.6759   54.197   9.4373   48.433   13.831   59.218   12.909   46.716   7.1783   52.218   5.9941 -5.502293 9.351815 
1 1 1   23    9   34 o   54.774   4.4111   65.141   9.8424   80.339   14.586   52.435   13.337   60.801   5.8164   48.747   6.6333 12.05390 8.822207 
1 1 1   23    9   35 f   32.602   10.236   3.7411   12.410  -0.7194   12.737   87.256   55.113   18.816   8.3226   46.389   18.704 -27.57250 20.47226 
1 1 1   23    9   36 o   58.670   6.8571   93.581   13.274  105.000   15.618   63.875   25.192   69.401   5.4564   47.939   12.582 21.46187 13.71420 
1 1 1   23    9   37 o   34.518   7.9829   30.653   12.024   28.681   13.932   36.410   23.809   33.501   9.5933   35.535   12.762 -2.034195 15.96579 
1 1 1   23    9   38 o   19.171   6.4295 -11.0722   11.792 -13.9516   13.824  -3.3784   22.597   15.712   7.5185   22.629   10.432 -6.916675 12.85898 
1 1 1   23    9   39 o   56.570   9.5008   99.788   21.997   87.332   31.778  111.246   30.478   51.201   14.429   61.940   12.364 -10.73907 19.00160 
1 1 1   23    9   40 o   24.609   8.5729 -17.5023   24.203   5.6218   51.480 -24.0640   27.423   28.720   13.932   20.498   9.9940 8.222071 17.14576 
1 1 1   23   10    0 o  193.914   2.5843  777.195   29.207  777.195   29.207  777.195   29.207  193.914   3.6547  193.914   3.6547 0.000000 0.000000 
1 1 1   23   10    1 o  268.992   3.0423  1489.50   31.680  1475.35   38.549  1518.94   55.604  267.183   3.4982  270.801   4.9784 -3.617645 6.084534 
1 1 1   23   10    2 o  196.956   2.3952  800.590   19.265  794.479   25.468  808.763   29.453  196.106   3.1488  197.806   3.6102 -1.700165 4.790432 
1 1 1   23   10    3 o  102.131   2.2695  215.539   9.5564  222.607   13.535  208.512   13.495  103.803   3.1614  100.458   3.2570 3.345367 4.538986 
1 1 1   23   10    4 o  321.297   2.7271  2133.11   36.116  2094.80   50.034  2174.80   52.185  318.297   3.8112  324.297   3.9015 -6.000458 5.454107 
1 1 1   23   10    5 o   84.130   2.4391  146.311   8.4610  149.823   11.944  142.775   11.987   85.146   3.4012   83.114   3.4968 2.032043 4.878153 
1 1 1   23   10    6 o  156.417   2.1662  505.438   13.974  506.865   19.678  503.986   19.848  156.642   3.0458  156.193   3.0810 0.4486084 4.332377 
1 1 1   23   10    7 o   35.225   4.4939   26.761   6.2683   19.799   8.9322   33.516   8.7988   30.240   7.2546   40.209   5.3056 -9.969429 8.987711 
1 1 1   23   10    8 o   68.067   2.7693   95.857   7.7664   90.383   10.938  101.423   11.029   66.102   4.0119   70.033   3.8184 -3.930687 5.538561 
1 1 1   23   10    9 o  115.997   2.2353  277.614   10.684  261.646   14.819  294.900   15.418  112.526   3.1930  119.468   3.1291 -6.941780 4.470626 
1 1 1   23   10   10 o   73.684   2.6147  112.273   7.9456  113.189   11.327  111.385   11.148   73.979   3.7124   73.389   3.6831 0.5902100 5.229486 
1 1 1   23   10   11 o  109.135   2.6860  248.156   11.538  252.414   14.385  240.475   19.321  110.511   3.1559  107.759   4.3472 2.752365 5.371956 
1 1 1   23   10   12 o  203.411   2.7355  855.783   21.757  854.706   26.797  857.866   37.272  203.337   3.1952  203.484   4.4410 -0.1472626 5.471044 
1 1 1   23   10   13 o  144.941   2.5669  434.289   15.338  448.418   22.090  421.135   21.314  147.215   3.6382  142.668   3.6221 4.546738 5.133821 
1 1 1   23   10   14 o  136.975   2.5356  389.046   14.286  375.878   20.770  400.869   19.681  134.750   3.7371  139.200   3.4280 -4.449493 5.071214 
1 1 1   23   10   15 o  116.241   2.4491  280.518   11.526  274.773   18.019  284.496   14.994  115.190   3.7928  117.291   3.0994 -2.101219 4.898135 
1 1 1   23   10   16 o  224.771   2.4975  1051.35   22.705  1016.30   35.472  1075.68   29.552  221.493   3.8829  228.049   3.1419 -6.555832 4.994904 
1 1 1   23   10   17 o   83.253   3.6562  158.739   10.555  116.481   20.127  174.767   12.396   74.614   6.5402   91.891   3.2707 -17.27672 7.312443 
1 1 1   23   10   18 o  129.118   2.8088  345.561   13.642  347.032   25.124  344.946   16.246  129.145   4.7167  129.090   3.0513 0.5455017E-01 5.617682 
1 1 1   23   10   19 o  113.680   2.5500  272.035   11.688  246.467   18.060  290.461   15.331  108.936   4.0195  118.423   3.1388 -9.486778 5.099903 
1 1 1   23   10   20 o   45.414   4.5343   43.384   8.4389   43.463   12.669   43.321   11.314   45.401   6.7657   45.428   6.0387 -0.2717590E-01 9.068671 
1 1 1   23   10   21 f  119.306   2.6311  295.845   12.939  283.131   18.236  308.737   18.363  116.708   3.7884  121.905   3.6522 -5.197296 5.262193 
1 1 1   23   10   22 o   34.845   5.4939   26.568   8.0822   38.821   11.632   15.132   11.238   42.838   6.5837   26.852   8.7969 15.98569 10.98772 
1 1 1   23   10   23 o   24.921   5.9156   11.137   7.5722   19.767   11.358   4.2324   10.160   29.928   8.6886   19.914   8.0302 10.01367 11.83117 
1 1 1   23   10   24 o   94.749   2.8912  187.436   11.297  187.592   16.116  187.285   15.839   94.778   4.1228   94.720   4.0544 0.5817413E-01 5.782323 
1 1 1   23   10   25 o  151.636   2.8824  473.710   17.627  449.549   22.429  512.736   28.506  146.829   3.7036  156.444   4.4178 -9.615005 5.764869 
1 1 1   23   10   26 o   48.212   6.3160   49.115   10.832   45.997   12.510   58.457   21.652   46.393   6.5380   50.032   10.808 -3.639347 12.63204 
1 1 1   23   10   27 o   87.189   3.0759  159.239   11.055  166.965   15.784  151.800   15.488   89.285   4.2863   85.094   4.4129 4.190468 6.151866 
1 1 1   23   10   28 o   22.359   5.5499   4.9106   7.6286   19.956   11.180  -8.1968   10.435   29.670   8.6224   15.048   6.9900 14.62227 11.09979 
1 1 1   23   10   29 o   70.472   7.0130  117.354   17.746  103.578   31.754  123.610   21.400   65.343   12.232   75.601   6.8631 -10.25810 14.02598 
1 1 1   23   10   30 o   84.524   3.9398  149.315   12.797  161.486   23.019  143.872   15.395   86.473   6.4542   82.575   4.5202 3.898125 7.879675 
1 1 1   23   10   31 o   39.165   5.4251   33.526   8.5321   48.010   13.082   22.805   11.255   46.971   6.7528   31.358   8.4928 15.61287 10.85027 
1 1 1   23   10   32 o   17.761   5.6085  -2.6924   8.3317  -5.1642   12.936  -0.9400   10.892   17.821   8.0923   17.700   7.7676 0.1205978 11.21702 
1 1 1   23   10   33 o   26.651   5.9546   15.274   8.2747   3.4451   12.020   25.930   11.408   20.172   8.4901   33.131   8.3514 -12.95862 11.90914 
1 1 1   23   10   34 o   30.341   7.7900   20.385   11.587   17.872   13.621   26.964   22.041   27.770   9.6822   32.911   12.206 -5.141239 15.58008 
1 1 1   23   10   35 o   40.694   6.5364   51.448   11.938   66.348   13.866   8.7781   23.465   54.782   6.1369   26.607   11.543 28.17503 13.07276 
1 1 1   23   10   36 o   38.004   9.2998   36.886   13.216   36.273   13.758   44.208   47.534   38.469   8.8550   37.539   16.356 0.9296036 18.59951 
1 1 1   23   10   37 o   32.275   8.3722   26.277   13.064   23.534   14.946   35.164   26.899   30.138   10.153   34.412   13.315 -4.274776 16.74446 
1 1 1   23   10   38 o   22.133   7.0350 -13.4788   11.409 -24.7204   12.906   26.721   24.406   13.114   6.4842   31.153   12.487 -18.03889 14.07007 
1 1 1   23   10   39 o   29.433   9.0106   22.133   19.909   27.911   30.643   17.912   26.189   30.867   13.291   27.998   12.170 2.869516 18.02111 
1 1 1   23   10   40 o   26.277   8.3474   4.4552   19.638   34.814   29.627 -19.3364   26.228   31.955   13.383   20.598   9.9805 11.35779 16.69474 
1 1 1   23   11    0 o  182.646   2.1945  689.150   23.363  689.150   23.363  689.150   23.363  182.646   3.1034  182.646   3.1034 0.000000 0.000000 
1 1 1   23   11    1 o   95.116   2.3173  186.942   9.0885  181.335   12.806  192.631   12.900   93.677   3.3146   96.555   3.2393 -2.878014 4.634606 
1 1 1   23   11    2 o  164.549   2.1619  559.318   14.672  564.130   20.813  554.565   20.685  165.253   3.0537  163.845   3.0610 1.407623 4.323748 
1 1 1   23   11    3 o  182.804   2.1967  690.366   16.563  689.996   23.450  690.733   23.396  182.754   3.1111  182.853   3.1023 -0.9846497E-01 4.393491 
1 1 1   23   11    4 o  129.723   2.3451  346.806   12.420  354.168   19.057  341.371   16.375  130.898   3.5298  128.547   3.0886 2.351807 4.690299 
1 1 1   23   11    5 o  215.070   2.4674  956.877   21.695  949.843   32.870  962.305   28.878  214.336   3.7182  215.804   3.2444 -1.468185 4.934741 
1 1 1   23   11    6 o  164.881   2.3203  559.053   15.599  544.422   20.447  579.430   24.129  162.335   3.0538  167.427   3.4942 -5.091934 4.640628 
1 1 1   23   11    7 o  220.054   2.3103  1000.26   20.960  986.134   29.145  1015.39   30.163  218.450   3.2348  221.658   3.2994 -3.207840 4.620605 
1 1 1   23   11    8 o  224.791   2.3272  1043.79   21.568  1023.26   29.993  1065.76   31.037  222.508   3.2682  227.074   3.3140 -4.566406 4.654397 
1 1 1   23   11    9 o  217.567   2.3039  978.230   20.671  967.075   28.945  989.840   29.531  216.303   3.2445  218.830   3.2719 -2.526779 4.607801 
1 1 1   23   11   10 o  164.704   2.1999  560.257   14.939  543.970   20.795  577.627   21.474  162.232   3.1078  167.175   3.1145 -4.942703 4.399795 
1 1 1   23   11   11 o   99.795   2.4298  205.130   9.9651  196.735   13.432  215.406   14.861   97.541   3.3389  102.049   3.5309 -4.507378 4.859528 
1 1 1   23   11   12 o   78.391   2.6059  127.595   8.3807  131.984   11.403  122.440   12.359   79.878   3.4612   76.904   3.8964 2.973763 5.211713 
1 1 1   23   11   13 o  130.166   2.5326  351.450   13.565  330.664   19.431  371.214   18.946  126.384   3.7276  133.949   3.4294 -7.564735 5.065181 
1 1 1   23   11   14 o  231.664   2.4930  1112.25   23.256  1103.82   37.071  1117.72   29.864  230.847   3.8935  232.481   3.1146 -1.633698 4.986006 
1 1 1   23   11   15 o   95.571   2.6688  191.442   10.328  175.656   15.819  203.167   13.634   92.051   4.1667   99.090   3.3359 -7.039101 5.337612 
1 1 1   23   11   16 o  138.920   2.5927  400.952   14.782  354.494   20.862  447.794   20.948  130.779   3.8677  147.061   3.4537 -16.28114 5.185306 
1 1 1   23   11   17 o  122.291   4.1479  320.945   16.513  298.928   36.775  326.506   18.481  119.073   7.4882  125.510   3.5702 -6.436241 8.295724 
1 1 1   23   11   18 o   52.577   4.6130   59.007   9.3797   55.225   16.095   60.952   11.542   51.103   7.6363   54.051   5.1776 -2.948124 9.226032 
1 1 1   23   11   19 o   58.235   3.5161   71.955   8.0849   66.424   13.247   75.238   10.206   56.314   5.7036   60.157   4.1135 -3.843407 7.032173 
1 1 1   23   11   20 o   31.216   5.9571   20.008   8.0002   31.099   12.674   12.663   10.315   37.429   8.4146   25.004   8.4346 12.42477 11.91420 
1 1 1   23   11   21 o   48.061   4.9133   51.485   9.0886   39.199   13.684   61.182   12.157   42.127   8.1706   53.995   5.4591 -11.86807 9.826556 
1 1 1   23   11   22 o  193.749   2.6204  779.715   20.870  789.040   30.878  771.873   28.316  194.755   3.8441  192.743   3.5620 2.011810 5.240711 
1 1 1   23   11   23 o  123.982   2.7250  319.503   13.904  331.499   20.482  309.249   18.936  126.107   3.9379  121.856   3.7678 4.250427 5.450039 
1 1 1   23   11   24 o   63.060   3.6445   83.550   9.3672  101.853   13.679   67.390   12.854   69.644   4.7623   56.476   5.5182 13.16835 7.289039 
1 1 1   23   11   25 f   71.587   3.6480  107.332   10.730   95.764   14.572  121.035   15.859   67.375   5.2439   75.800   5.0728 -8.424728 7.295972 
1 1 1   23   11   26 o  112.586   4.4486  282.344   16.647  291.891   18.871  248.862   35.340  118.216   3.8704  106.956   8.0113 11.26003 8.897217 
1 1 1   23   11   27 o   39.601   5.3358   36.086   8.3188   25.246   12.414   44.921   11.207   33.243   8.8842   45.960   5.9124 -12.71715 10.67168 
1 1 1   23   11   28 o  105.778   2.8684  234.950   12.496  227.647   17.973  241.784   17.387  104.128   4.1849  107.428   3.9240 -3.299911 5.736879 
1 1 1   23   11   29 o   23.159   5.4047   5.0929   8.3630 -20.1406   12.888   23.446   10.991   14.339   6.9590   31.979   8.2713 -17.64004 10.80934 
1 1 1   23   11   30 o   85.003   3.8511  154.001   12.657  154.936   22.113  153.545   15.436   84.687   6.3310   85.319   4.3865 -0.6323013 7.702112 
1 1 1   23   11   31 o   58.852   4.0181   74.620   9.6995   71.629   14.299   77.170   13.201   57.614   6.0176   60.090   5.3264 -2.476044 8.036243 
1 1 1   23   11   32 o   50.280   4.4524   54.613   9.1814   63.064   13.746   47.806   12.337   53.801   6.1945   46.759   6.3971 7.041264 8.904778 
1 1 1   23   11   33 o   53.101   4.6356   62.069   10.090   62.388   15.124   61.813   13.544   53.034   6.9144   53.168   6.1764 -0.1341553 9.271276 
1 1 1   23   11   34 o   27.614   7.4709   16.935   11.606   19.361   13.782   11.019   21.519   28.431   9.7488   26.796   11.323 1.634317 14.94176 
1 1 1   23   11   35 o   24.016   6.9380   9.5211   11.020   14.858   12.807  -5.6951   21.626   25.707   9.3422   22.325   10.260 3.381737 13.87593 
1 1 1   23   11   36 o   41.563   8.4142   54.336   13.853   57.367   14.390   15.989   51.192   50.282   6.9388   32.843   15.331 17.43885 16.82841 
1 1 1   23   11   37 o   29.581   7.9821   21.868   12.665   20.617   14.921   25.092   23.952   28.436   10.115   30.725   12.351 -2.289581 15.96411 
1 1 1   23   11   38 o   25.196   7.3767  -5.9013   11.934 -20.2031   13.635   40.904   24.667   14.337   7.0025   36.054   12.986 -21.71754 14.75350 
1 1 1   23   11   39 o   27.680   8.3976   14.485   19.177 -14.4828   29.902   34.723   24.994   22.631   10.889   32.728   12.787 -10.09711 16.79517 
1 1 1   23   11   40 o   30.805   12.876   30.539   27.350   0.0000   0.0000   30.539   27.350  ?   ?    30.805   12.876      ?      ? 
1 1 1   23   12    0 o  123.991   2.1801  317.916   15.745  317.916   15.745  317.916   15.745  123.991   3.0831  123.991   3.0831 0.000000 0.000000 
1 1 1   23   12    1 f  129.391   2.1574  345.699   11.510  357.308   16.473  334.625   16.088  131.514   3.0369  127.269   3.0650 4.244911 4.314740 
1 1 1   23   12    2 o  219.329   2.2905  993.256   20.710  1018.85   29.860  969.535   28.749  222.046   3.2605  216.611   3.2179 5.434464 4.581038 
1 1 1   23   12    3 o  166.089   2.1661  569.890   14.838  566.886   20.865  572.964   21.105  165.648   3.0540  166.531   3.0727 -0.8837433 4.332284 
1 1 1   23   12    4 o  331.977   2.7786  2278.82   38.030  2248.38   52.932  2311.30   54.676  329.696   3.8926  334.258   3.9660 -4.561920 5.557112 
1 1 1   23   12    5 o  167.463   2.1865  579.462   15.102  583.175   21.364  575.753   21.349  168.000   3.0833  166.926   3.1010 1.074387 4.372954 
1 1 1   23   12    6 o  182.440   2.1991  687.630   16.545  677.278   23.159  698.421   23.645  181.039   3.1016  183.842   3.1184 -2.802078 4.398170 
1 1 1   23   12    7 o   92.878   2.3495  178.237   8.9937  168.828   12.575  188.089   12.868   90.367   3.3739   95.390   3.2708 -5.022896 4.699057 
1 1 1   23   12    8 o   95.832   2.3336  189.738   9.2160  200.933   13.206  179.111   12.867   98.590   3.2477   93.075   3.3519 5.514740 4.667183 
1 1 1   23   12    9 o   42.978   3.8689   38.162   6.8170   40.138   10.318   36.631   9.0816   43.948   5.6921   42.008   5.2416 1.939613 7.737868 
1 1 1   23   12   10 o   59.017   3.2773   72.125   7.9707   74.312   11.566   70.147   11.000   59.864   4.6842   58.169   4.5849 1.694946 6.554677 
1 1 1   23   12   11 o   81.873   2.5905  139.234   8.7041  144.835   11.883  132.750   12.785   83.673   3.4434   80.073   3.8713 3.600136 5.181080 
1 1 1   23   12   12 o   66.719   2.9039   92.328   7.9530   93.218   10.765   91.258   11.800   67.089   3.8905   66.348   4.3122 0.7412186 5.807848 
1 1 1   23   12   13 o  141.710   2.5084  415.970   14.612  411.766   21.505  419.575   19.915  141.022   3.6973  142.398   3.3909 -1.376236 5.016755 
1 1 1   23   12   14 o  188.775   2.4053  734.000   18.238  752.753   29.512  722.413   23.198  190.644   3.7533  186.906   3.0092 3.737885 4.810688 
1 1 1   23   12   15 o  105.786   2.5653  236.857   10.863  207.851   16.945  257.098   14.155  100.100   4.1042  111.472   3.0787 -11.37135 5.130614 
1 1 1   23   12   16 f   61.659   3.3234   79.489   8.0967   77.710   13.468   80.495   10.132   61.036   5.3499   62.282   3.9444 -1.246040 6.646726 
1 1 1   23   12   17 o   30.112   7.5108   12.705   7.9000   28.219   24.441   10.895   8.3481   37.107   12.968   23.116   7.5824 13.99113 15.02168 
1 1 1   23   12   18 o   41.679   4.5531   36.634   7.2109   38.327   12.497   35.789   8.8290   41.964   7.4954   41.394   5.1714 0.5699921 9.106290 
1 1 1   23   12   19 o   30.287   5.5756   19.515   6.7442   22.834   11.655   17.844   8.2691   32.086   8.6225   28.487   7.0710 3.599421 11.15111 
1 1 1   23   12   20 o   94.678   2.8642  186.719   11.179  183.034   15.949  190.279   15.675   93.743   4.1250   95.614   3.9749 -1.871300 5.728467 
1 1 1   23   12   21 o   99.126   3.0278  204.781   12.302  205.261   18.458  204.397   16.501   99.172   4.5127   99.081   4.0380 0.9153748E-01 6.055528 
1 1 1   23   12   22 o   99.490   3.4040  210.727   13.201  218.678   16.390  196.047   22.273  102.469   3.8782   96.511   5.5954 5.958275 6.808019 
1 1 1   23   12   23 o   60.981   4.3681   78.509   10.707   76.788   13.630   81.282   17.302   60.305   5.4801   61.657   6.8037 -1.351566 8.736243 
1 1 1   23   12   24 o   28.504   6.3572   18.243   9.2968   26.376   11.441   2.4316   15.952   34.181   8.2167   22.827   9.7027 11.35398 12.71438 
1 1 1   23   12   25 o  124.958   3.4429  324.920   16.310  319.413   19.479  337.838   29.834  123.685   3.8183  126.232   5.7302 -2.547043 6.885852 
1 1 1   23   12   26 o   83.040   3.4536  142.674   11.703  129.062   15.254  162.151   18.246   78.363   4.7197   87.718   5.0433 -9.355827 6.907250 
1 1 1   23   12   27 o  127.477   2.7047  340.169   14.196  315.426   19.954  365.531   20.202  122.723   3.9422  132.230   3.7042 -9.506950 5.409392 
1 1 1   23   12   28 o  111.460   3.1502  262.589   14.120  256.255   22.463  266.725   18.155  110.082   4.9476  112.839   3.9009 -2.757019 6.300490 
1 1 1   23   12   29 o   73.735   4.3228  114.646   12.384  110.224   15.048  123.923   21.797   72.053   5.0636   75.416   7.0076 -3.363251 8.645647 
1 1 1   23   12   30 o  110.071   3.8454  259.009   17.440  245.932   24.656  272.104   24.672  107.190   5.5769  112.953   5.2959 -5.762337 7.690786 
1 1 1   23   12   31 o   65.201   3.7717   91.215   10.075   90.809   15.114   91.540   13.515   64.920   5.6446   65.482   5.0042 -0.5617218 7.543434 
1 1 1   23   12   32 o   51.420   4.4795   57.848   9.4912   58.534   13.752   57.224   13.116   51.654   6.4549   51.186   6.2125 0.4680481 8.958910 
1 1 1   23   12   33 o   70.317   3.8023  104.859   10.920  124.607   16.870   90.618   14.325   75.898   5.3891   64.737   5.3653 11.16058 7.604527 
1 1 1   23   12   34 o   34.570   6.7813   33.615   11.959   47.018   14.419   4.0792   21.405   44.537   8.1501   24.604   10.841 19.93217 13.56256 
1 1 1   23   12   35 o   32.382   7.6817   25.201   11.112   22.361   13.006   32.879   21.382   30.023   9.4289   34.741   12.130 -4.718365 15.36342 
1 1 1   23   12   36 o   37.343   9.3944   38.156   14.447   37.295   15.174   46.498   47.241   38.068   9.6511   36.618   16.121 1.450325 18.78872 
1 1 1   23   12   37 o   22.513   7.1656   1.7889   12.237   0.2494   14.120   6.4322   24.522   19.574   8.7052   25.451   11.384 -5.876534 14.33117 
1 1 1   23   12   38 f   22.679   7.1012   5.5544   12.457   9.5215   14.202  -7.6788   25.938   22.728   9.3697   22.629   10.673 0.9926414E-01 14.20234 
1 1 1   23   12   39 o   26.323   12.100   9.5244   30.098   9.5244   30.098   0.0000   0.0000   26.323   12.100  ?   ?       ?      ? 
1 1 1   23   13    0 o  196.232   2.2315  795.557   25.527  795.557   25.527  795.557   25.527  196.232   3.1559  196.232   3.1559 0.000000 0.000000 
1 1 1   23   13    1 o  139.785   2.1597  403.766   12.451  408.600   17.622  398.945   17.595  140.622   3.0383  138.947   3.0703 1.674286 4.319490 
1 1 1   23   13    2 o   86.313   2.3851  154.020   8.4905  152.565   12.022  155.467   11.993   85.905   3.3930   86.721   3.3530 -0.8157120 4.770236 
1 1 1   23   13    3 o   66.624   2.6739   91.839   7.3437   95.586   10.419   88.141   10.352   67.978   3.7163   65.270   3.8454 2.707802 5.347700 
1 1 1   23   13    4 o  124.953   2.1779  322.584   11.221  311.715   15.744  333.803   15.996  122.812   3.1081  127.094   3.0515 -4.281807 4.355730 
1 1 1   23   13    5 o  163.389   2.1662  551.684   14.597  556.600   20.728  546.848   20.560  164.111   3.0624  162.667   3.0645 1.444183 4.332363 
1 1 1   23   13    6 o   90.036   2.3639  167.548   8.7764  163.316   12.280  171.965   12.547   88.874   3.3502   91.198   3.3358 -2.323914 4.727743 
1 1 1   23   13    7 f  256.952   2.4377  1365.40   25.833  1358.36   36.282  1372.65   36.789  256.283   3.4325  257.621   3.4624 -1.337677 4.875450 
1 1 1   23   13    8 o   68.089   2.7015   95.999   7.5811  100.317   10.732   91.697   10.711   69.623   3.7372   66.554   3.9020 3.068970 5.403003 
1 1 1   23   13    9 o  136.834   2.1781  387.032   12.291  383.126   17.227  391.082   17.541  136.133   3.0682  137.536   3.0923 -1.403412 4.356134 
1 1 1   23   13   10 o  130.892   2.3126  352.208   12.406  336.299   16.497  372.916   18.822  127.526   3.1365  134.257   3.3991 -6.731186 4.625128 
1 1 1   23   13   11 o  109.817   2.2596  249.215   10.229  239.089   14.241  260.010   14.703  107.513   3.2114  112.122   3.1795 -4.608521 4.519157 
1 1 1   23   13   12 o   71.146   3.1280  105.581   9.1235   97.651   13.319  112.592   12.523   68.587   4.7082   73.704   4.1196 -5.116821 6.256059 
1 1 1   23   13   13 o  148.279   2.5044  455.409   15.270  452.806   22.448  457.652   20.833  147.860   3.6809  148.697   3.3968 -0.8365479 5.008750 
1 1 1   23   13   14 o   78.160   2.8818  130.535   8.9381  110.501   14.075  144.072   11.571   72.909   4.6807   83.411   3.3633 -10.50237 5.763689 
1 1 1   23   13   15 o   64.831   3.9628   98.170   9.0343   66.301   16.379  112.107   10.831   56.124   7.0756   73.537   3.5711 -17.41296 7.925666 
1 1 1   23   13   16 o  126.488   2.8845  324.775   13.989  352.913   25.364  312.474   16.770  130.178   4.7240  122.798   3.3112 7.379929 5.768921 
1 1 1   23   13   17 o   46.347   7.3016   53.875   9.1235   36.221   27.968   55.978   9.6515   40.849   13.888   51.845   4.5136 -10.99607 14.60327 
1 1 1   23   13   18 o   32.253   5.0845   26.392   7.0152   7.3104   11.900   36.554   8.6846   22.689   8.8348   41.817   5.0353 -19.12878 10.16903 
1 1 1   23   13   19 o   30.579   5.4516   18.652   6.6463   28.639   11.661   13.846   8.0890   35.921   8.0678   25.238   7.3341 10.68237 10.90314 
1 1 1   23   13   20 o   27.673   5.5496   15.909   7.6928   2.1417   11.279   27.885   10.519   19.761   8.2651   35.584   7.4082 -15.82256 11.09928 
1 1 1   23   13   21 o   69.100   3.5236   99.496   9.9889  105.189   15.071   95.036   13.340   70.814   5.1601   67.386   4.7997 3.427460 7.047220 
1 1 1   23   13   22 o   31.547   5.8355   22.730   7.9437   14.907   11.647   29.535   10.862   26.639   8.9628   36.454   7.4755 -9.815451 11.67110 
1 1 1   23   13   23 o  114.805   2.7737  275.657   13.106  267.283   18.982  283.285   18.117  113.081   4.0700  116.528   3.7696 -3.446846 5.547458 
1 1 1   23   13   24 o   58.576   3.9952   72.745   9.6304   66.905   13.559   78.690   13.680   56.144   5.8556   61.008   5.4368 -4.864265 7.990445 
1 1 1   23   13   25 o   99.515   3.4252  207.444   13.514  205.182   16.892  211.464   22.524   99.029   4.1358  100.001   5.4611 -0.9722519 6.850481 
1 1 1   23   13   26 o   54.162   4.4146   63.281   9.7456   67.151   13.102   58.488   14.581   56.208   5.6517   52.116   6.7834 4.091431 8.829268 
1 1 1   23   13   27 o   22.853   6.0170   8.2677   7.9392   15.241   11.517   1.9546   10.959   26.557   8.9129   19.150   8.0857 7.406811 12.03409 
1 1 1   23   13   28 o   90.230   3.4024  172.457   12.465  170.623   19.335  173.762   16.306   89.614   5.2313   90.846   4.3517 -1.232536 6.804718 
1 1 1   23   13   29 o   23.134   6.6814   6.8638   9.5007   6.9007   11.397   6.7796   17.199   21.642   8.5795   24.625   10.245 -2.982611 13.36276 
1 1 1   23   13   30 o   78.218   4.0660  131.922   12.486  132.468   15.502  130.914   21.067   78.967   4.7597   77.470   6.5934 1.497833 8.131926 
1 1 1   23   13   31 o   59.516   5.2962   82.355   11.497   71.011   21.011   87.204   13.736   55.287   9.2142   63.744   5.2247 -8.457092 10.59238 
1 1 1   23   13   32 o   25.003   6.3506   13.300   8.5076   9.0484   12.482   16.990   11.627   22.907   9.0107   27.098   8.9514 -4.191555 12.70120 
1 1 1   23   13   33 o   41.446   5.9222   41.526   9.8815   30.798   14.307   51.313   13.665   35.094   9.6044   47.798   6.9315 -12.70367 11.84444 
1 1 1   23   13   34 o   21.409   6.7236  -5.3250   10.806 -12.8824   12.707   14.414   20.537   15.348   7.3065   27.470   11.289 -12.12163 13.44730 
1 1 1   23   13   35 o   40.972   7.1883   45.072   11.825   48.441   14.018   36.758   22.021   45.902   7.4042   36.042   12.323 9.860500 14.37665 
1 1 1   23   13   36 o   34.224   10.157   31.229   15.374   31.229   15.374   0.0000   0.0000   34.224   10.157  ?   ?       ?      ? 
1 1 1   23   13   37 o   20.943   6.7873  -2.0928   12.873   3.3566   15.151 -16.2384   24.410   21.017   9.1935   20.870   9.9875 0.1469955 13.57466 
1 1 1   23   13   38 o   38.214   7.1638   47.443   13.899   60.106   16.278   13.358   26.706   49.693   7.9421   26.735   11.925 22.95874 14.32763 
1 1 1   23   13   39 o   29.042   9.0215   23.034   20.669   29.880   31.245   17.707   27.560   30.562   13.289   27.521   12.204 3.041237 18.04291 
1 1 1   23   14    0 o   15.085   6.0046   6.3036   8.0338   6.3036   8.0338   6.3036   8.0338   15.085   8.4918   15.085   8.4918 0.000000 0.000000 
1 1 1   23   14    1 o   92.967   2.3366  178.641   8.9522  188.737   12.788  168.941   12.536   95.546   3.2451   90.389   3.3626 5.157845 4.673145 
1 1 1   23   14    2 o  102.447   2.2485  216.964   9.5005  217.908   13.441  216.022   13.431  102.670   3.1741  102.224   3.1855 0.4460678 4.496914 
1 1 1   23   14    3 o   84.346   2.4331  147.202   8.4558  155.298   11.989  139.190   11.928   86.660   3.3544   82.031   3.5254 4.628815 4.866217 
1 1 1   23   14    4 o  213.966   2.2792  945.963   20.106  966.946   28.937  926.379   27.956  216.255   3.2443  211.677   3.2021 4.577789 4.558417 
1 1 1   23   14    5 o   76.654   2.5212  121.481   7.9683  124.943   11.450  118.231   11.096   77.711   3.5725   75.596   3.5587 2.114944 5.042484 
1 1 1   23   14    6 o  221.371   2.3052  1013.41   21.047  1018.06   29.835  1008.79   29.696  221.878   3.2602  220.865   3.2599 1.012314 4.610374 
1 1 1   23   14    7 o   44.137   3.5226   40.435   6.4106   41.895   9.1413   39.022   8.9924   44.924   4.9336   43.350   5.0294 1.573425 7.045241 
1 1 1   23   14    8 o  202.172   2.2537  845.334   18.793  848.899   26.568  841.764   26.586  202.600   3.1794  201.744   3.1951 0.8561249 4.507466 
1 1 1   23   14    9 o   32.070   4.8233   22.213   6.1681   21.234   8.3716   23.377   9.1229   31.304   6.6870   32.835   6.9529 -1.530775 9.646687 
1 1 1   23   14   10 o  101.254   2.4011  212.722   9.9834  219.113   13.620  205.302   14.676  102.921   3.2086   99.588   3.5731 3.332794 4.802260 
1 1 1   23   14   11 o   90.779   2.3700  170.541   8.8734  169.127   12.540  171.959   12.558   90.401   3.3633   91.157   3.3400 -0.7558670 4.739979 
1 1 1   23   14   12 o  151.708   2.5761  475.755   16.100  448.099   22.205  506.410   23.378  147.066   3.6608  156.349   3.6254 -9.283264 5.152167 
1 1 1   23   14   13 o  171.995   2.3637  616.037   16.406  596.166   25.815  629.500   21.249  169.574   3.6911  174.417   2.9538 -4.842911 4.727444 
1 1 1   23   14   14 o   84.972   2.7104  151.112   9.1991  144.471   14.827  155.269   11.730   83.371   4.3119   86.573   3.2850 -3.201660 5.420728 
1 1 1   23   14   15 o   21.055   5.6195   7.0163   6.5143   6.8586   10.667   7.1101   8.2268   21.755   8.3940   20.355   7.4737 1.400232 11.23901 
1 1 1   23   14   16 o   49.685   4.4831   51.831   8.0518   52.112   15.780   51.732   9.3623   49.540   7.7228   49.829   4.5555 -0.2887726 8.966292 
1 1 1   23   14   17 o  105.345   3.1188  237.401   12.114  217.360   22.487  245.596   14.379  101.867   5.3522  108.823   3.2036 -6.956406 6.237692 
1 1 1   23   14   18 o   23.436   5.7184   9.6946   6.3768   15.031   11.347   7.2313   7.7094   26.824   8.8420   20.049   7.2540 6.775009 11.43681 
1 1 1   23   14   19 o   69.729   3.0831  102.831   8.4569   96.392   14.035  106.502   10.596   67.866   5.0143   71.592   3.5886 -3.726143 6.166137 
1 1 1   23   14   20 o   32.817   5.4752   24.844   7.7436   12.970   11.817   33.779   10.251   25.659   9.0140   39.975   6.2175 -14.31644 10.95037 
1 1 1   23   14   21 o   89.132   3.7079  170.033   12.536  160.182   22.323  174.571   15.151   86.830   6.2332   91.434   4.0175 -4.604073 7.415764 
1 1 1   23   14   22 o   77.589   3.4127  126.118   10.892  131.701   16.119  121.428   14.776   79.130   4.9389   76.048   4.7109 3.081749 6.825312 
1 1 1   23   14   23 o   41.744   5.1912   38.439   8.5775   49.246   12.349   28.365   11.923   48.081   6.2273   35.407   8.3074 12.67411 10.38234 
1 1 1   23   14   24 o  108.735   2.9583  247.497   13.263  254.706   18.767  240.303   18.746  110.340   4.1239  107.130   4.2426 3.209763 5.916603 
1 1 1   23   14   25 o   75.107   4.0085  120.372   11.935  121.992   15.019  117.597   19.661   76.109   4.7845   74.105   6.4328 2.003502 8.016967 
1 1 1   23   14   26 o   33.867   6.1272   26.728   8.7929   33.488   12.145   19.282   12.747   38.460   7.9203   29.274   9.3509 9.186153 12.25435 
1 1 1   23   14   27 o   27.939   6.5748   16.235   9.5375   6.2933   13.744   25.471   13.246   22.784   9.2843   33.095   9.3121 -10.31149 13.14963 
1 1 1   23   14   28 o   28.029   6.1102   17.808   8.1533   10.443   12.051   24.025   11.072   23.810   8.9864   32.248   8.2814 -8.437809 12.22032 
1 1 1   23   14   29 o   50.273   4.3889   54.534   9.0712   56.230   13.452   53.120   12.285   50.912   6.4063   49.635   6.0008 1.277390 8.777788 
1 1 1   23   14   30 o   31.499   5.0928   23.340   8.2075  -1.1962   12.366   42.659   10.973   18.662   8.2302   44.335   6.0007 -25.67289 10.18553 
1 1 1   23   14   31 o   18.749   6.0243  -2.8026   9.0396 -10.0438   18.632  -0.5734   10.338   20.176   9.3610   17.323   7.5857 2.852407 12.04866 
1 1 1   23   14   32 o   40.900   5.3696   38.168   8.8547   43.038   13.123   34.097   11.998   43.704   7.2801   38.097   7.8950 5.607262 10.73925 
1 1 1   23   14   33 o   39.273   7.1388   43.544   12.593   53.345   15.092   21.081   22.849   48.280   7.5793   30.267   12.100 18.01336 14.27753 
1 1 1   23   14   34 o   67.437   6.5098  114.325   14.781  120.300   17.325   98.341   28.337   74.038   5.6735   60.836   11.718 13.20125 13.01953 
1 1 1   23   14   35 o   58.601   7.2316   99.080   14.130  113.052   16.671   63.441   26.625   71.485   5.6544   45.716   13.312 25.76921 14.46315 
1 1 1   23   14   36 o   18.618   6.2804 -10.9694   11.816  -9.3100   13.707 -15.7686   23.310   16.651   7.8242   20.585   9.8263 -3.933886 12.56082 
1 1 1   23   14   37 f   48.628   8.7110   59.604   16.830   59.604   16.830   0.0000   0.0000   48.628   8.7110  ?   ?       ?      ? 
1 1 1   23   14   38 o   52.852   7.5098   77.137   14.794   76.945   17.799   77.566   26.607   56.366   7.6560   49.337   12.922 7.028763 15.01965 
1 1 1   23   15    0 o   81.549   2.7369  138.342   12.952  138.342   12.952  138.342   12.952   81.549   3.8706   81.549   3.8706 0.000000 0.000000 
1 1 1   23   15    1 o  119.177   2.1879  293.536   10.750  304.941   15.362  282.592   15.049  121.447   3.0669  116.907   3.1210 4.540329 4.375703 
1 1 1   23   15    2 o  162.174   2.1580  543.657   14.433  535.295   20.263  552.268   20.564  160.908   3.0532  163.439   3.0506 -2.531540 4.316050 
1 1 1   23   15    3 o  161.482   2.1638  538.891   14.408  553.494   20.630  524.985   20.132  163.617   3.0570  159.346   3.0632 4.270386 4.327664 
1 1 1   23   15    4 o  111.309   2.2154  255.951   10.165  266.050   14.642  246.554   14.124  113.427   3.1299  109.192   3.1361 4.235657 4.430725 
1 1 1   23   15    5 o  293.687   2.5983  1785.21   31.468  1765.35   44.033  1805.93   44.987  292.024   3.6559  295.350   3.6931 -3.325562 5.196537 
1 1 1   23   15    6 o  182.450   2.1993  688.339   16.549  695.183   23.555  681.667   23.256  183.345   3.1149  181.555   3.1057 1.789627 4.398672 
1 1 1   23   15    7 o  279.465   2.5371  1616.69   29.244  1612.08   41.221  1621.36   41.494  279.066   3.5813  279.864   3.5948 -0.7983704 5.074274 
1 1 1   23   15    8 o   69.538   2.7558   99.957   7.8927   96.208   10.818  104.224   11.541   68.151   3.8487   70.925   3.9452 -2.774620 5.511560 
1 1 1   23   15    9 o  234.032   2.5255  1132.41   24.151  1122.14   31.975  1146.05   36.849  232.861   3.3293  235.204   3.7986 -2.343536 5.051052 
1 1 1   23   15   10 f   27.883   4.7643   16.608   5.9535   7.1795   8.4804   25.770   8.3598   20.620   7.5854   35.147   5.7669 -14.52767 9.528641 
1 1 1   23   15   11 o  117.296   2.4265  286.410   11.496  277.883   18.052  292.228   14.911  115.763   3.7808  118.828   3.0425 -3.065132 4.852924 
1 1 1   23   15   12 o   64.782   3.2544   86.743   8.6608   98.265   12.796   77.004   11.765   68.736   4.5138   60.827   4.6895 7.909016 6.508868 
1 1 1   23   15   13 o   84.207   2.7290  148.410   9.1169  142.593   14.958  151.849   11.500   82.804   4.3799   85.610   3.2569 -2.805679 5.458046 
1 1 1   23   15   14 o  132.517   2.6170  364.532   14.300  354.508   20.189  374.622   20.257  130.678   3.7459  134.355   3.6555 -3.677231 5.233969 
1 1 1   23   15   15 o  195.675   2.8083  807.361   21.411  760.506   36.318  832.319   26.507  190.986   4.6106  200.365   3.2075 -9.378464 5.616585 
1 1 1   23   15   16 f  101.171   3.0990  220.475   11.598  196.832   21.261  230.491   13.838   96.923   5.3186  105.418   3.1826 -8.495445 6.198076 
1 1 1   23   15   17 o  127.943   2.8761  336.737   13.764  350.833   25.811  331.136   16.270  129.535   4.8312  126.351   3.1221 3.184036 5.752224 
1 1 1   23   15   18 o   46.410   4.1088   46.282   7.3419   42.432   12.627   48.249   9.0241   44.744   6.8422   48.076   4.5511 -3.331432 8.217544 
1 1 1   23   15   19 o   51.225   3.9335   60.059   7.4511   42.513   12.625   69.439   9.2302   44.712   6.8459   57.739   3.8759 -13.02776 7.866927 
1 1 1   23   15   20 o  100.079   2.8407  208.620   11.687  186.218   16.122  233.435   16.968   94.392   4.1410  105.766   3.8897 -11.37437 5.681368 
1 1 1   23   15   21 o  101.204   2.7951  213.974   11.649  212.847   16.922  214.989   16.060  100.913   4.0658  101.494   3.8366 -0.5807877 5.590168 
1 1 1   23   15   22 o   19.342   5.2891  -0.3662   7.6135 -20.2139   11.893   13.416   9.9104   13.562   6.6052   25.123   8.2625 -11.56183 10.57820 
1 1 1   23   15   23 o   93.402   3.1295  181.636   11.998  170.564   16.043  195.688   18.074   90.234   4.3108   96.570   4.5379 -6.336212 6.259013 
1 1 1   23   15   24 o   27.422   6.7939   15.687   9.4289   17.144   12.059   13.396   15.125   27.987   9.1100   26.857   10.082 1.130556 13.58784 
1 1 1   23   15   25 o   90.970   3.0747  174.049   11.507  158.361   16.120  190.345   16.430   86.725   4.5067   95.216   4.1838 -8.490707 6.149356 
1 1 1   23   15   26 o   89.317   3.0465  167.215   11.204  177.808   16.417  157.978   15.330   91.949   4.3289   86.686   4.2877 5.262886 6.092935 
1 1 1   23   15   27 f   26.134   6.7626   13.702   9.5747   11.061   13.739   16.196   13.351   24.858   9.5434   27.411   9.5840 -2.553198 13.52515 
1 1 1   23   15   28 o   38.044   5.6290   33.979   8.7717   20.204   12.630   46.813   12.192   29.591   9.2914   46.498   6.3572 -16.90636 11.25804 
1 1 1   23   15   29 o   32.030   6.1790   24.474   8.4712   20.444   12.507   27.890   11.514   29.515   9.2425   34.545   8.2036 -5.029968 12.35806 
1 1 1   23   15   30 o   25.659   5.8580   14.221   7.9565   2.7890   11.967   23.280   10.652   19.860   8.4209   31.458   8.1456 -11.59824 11.71593 
1 1 1   23   15   31 o   55.414   6.0783   75.236   12.526   58.446   20.271   85.607   15.932   48.365   10.466   62.464   6.1842 -14.09892 12.15654 
1 1 1   23   15   32 f   40.187   5.8103   38.461   9.3030   41.509   13.430   35.650   12.899   41.845   8.0740   38.528   8.3577 3.316452 11.62070 
1 1 1   23   15   33 o   59.128   6.0683   86.183   12.682   91.907   15.259   73.396   22.807   64.741   5.7146   53.515   10.707 11.22648 12.13659 
1 1 1   23   15   34 o   26.026   7.4232   12.966   11.420   10.706   13.615   18.327   20.973   23.583   9.3682   28.469   11.517 -4.885853 14.84637 
1 1 1   23   15   35 o   45.503   7.2849   59.400   13.850   73.503   17.599   36.455   22.448   55.939   7.6281   35.068   12.413 20.87171 14.56970 
1 1 1   23   15   36 o   26.666   7.8331   14.106   13.235   9.7832   15.900   23.858   23.881   23.513   9.8218   29.820   12.205 -6.307562 15.66616 
1 1 1   23   15   37 o   35.686   14.235   47.796   31.555   47.796   31.555   0.0000   0.0000   35.686   14.235  ?   ?       ?      ? 
1 1 1   23   15   38 o   31.380   8.2468   26.435   13.066   19.811   15.379   43.621   24.770   27.121   10.169   35.638   12.986 -8.516815 16.49367 
1 1 1   23   16    0 o   28.628   5.7916   20.684   8.3832   20.684   8.3832   20.684   8.3832   28.628   8.1906   28.628   8.1906 0.000000 0.000000 
1 1 1   23   16    1 o   52.184   3.1126   56.465   6.6841   61.713   9.5743   51.475   9.3358   54.559   4.2547   49.809   4.5444 4.749439 6.225282 
1 1 1   23   16    2 o   81.026   2.4341  135.874   8.1338  137.246   11.468  134.486   11.538   81.440   3.4143   80.612   3.4702 0.8277969 4.868221 
1 1 1   23   16    3 o  113.340   2.2041  265.628   10.298  254.374   14.457  277.222   14.673  110.898   3.1607  115.781   3.0726 -4.882858 4.408105 
1 1 1   23   16    4 o   83.095   2.4098  142.945   8.2556  140.152   11.767  145.652   11.586   82.290   3.4669   83.899   3.3481 -1.609062 4.819662 
1 1 1   23   16    5 o  118.342   2.1834  289.648   10.657  291.406   15.137  287.920   15.006  118.698   3.0919  117.987   3.0838 0.7111816 4.366838 
1 1 1   23   16    6 o   58.219   2.9305   70.550   6.9760   59.388   9.7853   82.086   9.9478   53.496   4.4350   62.943   3.8319 -9.447758 5.861061 
1 1 1   23   16    7 o  133.041   2.1666  366.161   11.888  365.078   16.679  367.280   16.947  132.844   3.0442  133.238   3.0839 -0.3945007 4.333298 
1 1 1   23   16    8 o   69.142   2.7450   98.690   7.8008   94.129   10.516  104.270   11.632   67.383   3.7840   70.900   3.9776 -3.517441 5.490011 
1 1 1   23   16    9 f  240.204   2.5494  1193.23   24.999  1176.98   32.969  1215.21   38.343  238.368   3.3535  242.040   3.8409 -3.672165 5.098872 
1 1 1   23   16   10 o  136.274   2.3243  383.309   12.736  390.986   20.521  378.500   16.243  137.313   3.6235  135.235   2.9121 2.078354 4.648633 
1 1 1   23   16   11 o   80.530   2.9151  135.184   9.6477  127.537   13.983  142.133   13.329   78.319   4.3287   82.742   3.9056 -4.423256 5.830240 
1 1 1   23   16   12 o   29.972   5.4425   20.618   7.1061   10.956   10.985   27.569   9.3182   24.274   8.6740   35.669   6.5762 -11.39519 10.88508 
1 1 1   23   16   13 o   38.731   4.3817   29.663   6.6958   38.139   11.738   25.574   8.1523   42.527   6.6920   34.934   5.6580 7.592949 8.763320 
1 1 1   23   16   14 o   97.969   2.5752  201.044   10.082  192.340   16.233  206.510   12.864   96.135   4.0939   99.803   3.1251 -3.667953 5.150423 
1 1 1   23   16   15 o   46.929   4.2400   42.992   7.3613   54.234   14.619   39.173   8.5203   50.561   7.0103   43.296   4.7713 7.264420 8.479922 
1 1 1   23   16   16 o  101.211   2.5702  213.392   10.372  210.963   16.942  214.848   13.118  100.646   4.0814  101.775   3.1250 -1.129082 5.140421 
1 1 1   23   16   17 f   49.953   4.2219   47.202   7.6393   64.319   15.914   42.077   8.7082   55.035   7.0111   44.871   4.7055 10.16396 8.443777 
1 1 1   23   16   18 o   76.679   2.8969  118.654   8.7719  136.551   15.136  109.603   10.764   80.786   4.5427   72.572   3.5960 8.214035 5.793778 
1 1 1   23   16   19 o   60.506   3.2795   76.010   7.7573   79.282   13.405   74.362   9.5117   61.318   5.3005   59.694   3.8634 1.624111 6.559026 
1 1 1   23   16   20 o   38.049   5.3236   32.856   8.0938   23.116   11.834   41.418   11.095   31.952   8.7312   44.146   6.0933 -12.19474 10.64723 
1 1 1   23   16   21 o   60.102   3.5892   76.127   8.8867   76.166   12.882   76.092   12.275   60.085   5.1982   60.119   4.9506 -0.3398132E-01 7.178394 
1 1 1   23   16   22 o   52.650   4.2362   59.152   9.0589   57.411   13.957   60.419   11.908   51.832   6.5288   53.469   5.3997 -1.636730 8.472431 
1 1 1   23   16   23 o   73.789   3.4038  114.666   10.346  107.207   14.518  122.362   14.748   71.311   4.9360   76.266   4.6884 -4.954918 6.807681 
1 1 1   23   16   24 o   40.202   6.2120   33.540   9.7613   23.557   11.967   53.388   16.873   31.998   8.7954   48.405   8.7749 -16.40701 12.42404 
1 1 1   23   16   25 o   47.316   4.4357   48.567   8.5564   42.052   12.415   54.461   11.809   44.089   6.8271   50.543   5.6649 -6.454342 8.871330 
1 1 1   23   16   26 o   38.518   5.4943   33.737   8.3467   33.404   12.790   33.984   11.016   38.088   8.3699   38.949   7.1199 -0.8610611 10.98854 
1 1 1   23   16   27 o   21.020   5.9975   1.7864   8.6560  -7.8390   11.603   13.867   12.999   16.068   7.4310   25.973   9.4159 -9.905313 11.99494 
1 1 1   23   16   28 o   43.874   5.1930   44.100   8.9446   36.835   13.380   49.970   12.027   39.741   8.4244   48.008   6.0742 -8.267479 10.38591 
1 1 1   23   16   29 o   33.258   5.9701   24.952   8.4715   37.958   13.028   15.423   11.151   40.387   8.1026   26.130   8.7701 14.25742 11.94017 
1 1 1   23   16   30 o   33.664   6.0619   27.042   8.4114   27.370   12.534   26.773   11.345   33.711   8.8883   33.617   8.2452 0.9325027E-01 12.12377 
1 1 1   23   16   31 o   48.112   6.4659   65.136   10.965   36.051   20.243   77.214   13.045   36.584   11.794   59.639   5.3033 -23.05512 12.93172 
1 1 1   23   16   32 o   84.316   4.3282  155.666   13.984  153.178   16.896  161.079   24.917   84.299   4.8594   84.332   7.1639 -0.3239441E-01 8.656491 
1 1 1   23   16   33 o   47.194   6.9471   56.768   12.847   59.471   16.196   52.181   21.097   50.620   7.7574   43.769   11.527 6.850597 13.89426 
1 1 1   23   16   34 o   31.296   9.2805   26.110   20.605 -20.4669   53.523   34.215   22.326   28.358   13.855   34.234   12.351 -5.876188 18.56107 
1 1 1   23   16   35 o   43.425   8.2210   51.414   14.157   47.050   16.936   61.533   25.790   42.309   9.8841   44.542   13.139 -2.232994 16.44201 
1 1 1   23   16   36 o   41.887   7.5882   53.886   13.874   61.640   16.653   36.294   25.082   50.320   8.0239   33.453   12.882 16.86743 15.17643 
1 1 1   23   16   37 o   39.567   9.9662   43.179   16.256   43.179   16.256   0.0000   0.0000   39.567   9.9662  ?   ?       ?      ? 
1 1 1   23   17    0 o   75.511   2.5707  118.667   11.263  118.667   11.263  118.667   11.263   75.511   3.6355   75.511   3.6355 0.000000 0.000000 
1 1 1   23   17    1 o  116.857   2.1788  282.355   10.497  272.371   14.651  292.887   15.048  114.734   3.0960  118.980   3.0665 -4.246300 4.357565 
1 1 1   23   17    2 o   72.704   2.5489  109.511   7.6429  110.860   10.806  108.160   10.812   73.154   3.5814   72.254   3.6280 0.9005585 5.097876 
1 1 1   23   17    3 o  109.636   2.2211  248.776   10.041  248.143   14.339  249.385   14.067  109.495   3.1750  109.777   3.1069 -0.2820587 4.442232 
1 1 1   23   17    4 o   88.672   2.3369  162.545   8.5336  175.714   12.319  150.396   11.832   92.127   3.2421   85.218   3.3665 6.908394 4.673790 
1 1 1   23   17    5 o   76.079   2.5146  119.948   7.8903  120.683   11.180  119.219   11.137   76.311   3.5521   75.846   3.5603 0.4651031 5.029235 
1 1 1   23   17    6 o   61.552   2.7811   78.481   7.0540   82.616   10.225   74.725   9.7439   63.096   3.9292   60.007   3.9370 3.089729 5.562256 
1 1 1   23   17    7 o  117.757   2.3057  286.699   11.134  282.317   14.917  292.214   16.732  116.768   3.0973  118.745   3.4164 -1.977325 4.611402 
1 1 1   23   17    8 o   58.978   2.9289   72.334   7.1116   73.531   9.8149   71.012   10.319   59.506   3.9991   58.449   4.2803 1.057251 5.857783 
1 1 1   23   17    9 o   71.180   2.5277  105.018   7.4183  108.461   10.646  101.768   10.342   72.314   3.5696   70.046   3.5799 2.267807 5.055445 
1 1 1   23   17   10 o   43.082   3.9690   38.021   6.8415   42.231   11.361   35.625   8.5695   44.850   6.1416   41.314   5.0291 3.535931 7.937970 
1 1 1   23   17   11 o  113.697   2.5554  267.810   11.943  274.820   17.721  261.977   16.166  115.032   3.7352  112.363   3.4884 2.669266 5.110839 
1 1 1   23   17   12 o  116.874   2.4057  281.920   11.307  290.382   18.249  276.646   14.406  118.213   3.7429  115.535   3.0232 2.677505 4.811347 
1 1 1   23   17   13 o   70.017   2.9883  102.924   8.2662   99.361   13.705  104.962   10.364   68.950   4.8192   71.085   3.5348 -2.135475 5.976602 
1 1 1   23   17   14 o   65.542   3.5444   90.999   8.4390   87.564   16.242   92.269   9.8768   64.450   6.1102   66.634   3.5938 -2.184357 7.088717 
1 1 1   23   17   15 o  146.533   2.4292  448.171   14.446  432.485   22.312  459.493   18.956  144.217   3.7512  148.850   3.0876 -4.633331 4.858453 
1 1 1   23   17   16 o  175.629   2.8149  634.183   18.686  663.726   34.456  621.873   22.241  178.145   4.6895  173.113   3.1150 5.031235 5.629815 
1 1 1   23   17   17 o   67.828   3.9969  109.230   9.1976   74.609   17.589  122.259   10.790   58.996   7.2288   76.660   3.4127 -17.66468 7.993879 
1 1 1   23   17   18 o   87.118   2.7550  158.356   9.5387  158.723   15.753  158.143   11.986   87.056   4.3875   87.179   3.3333 -0.1236420 5.510077 
1 1 1   23   17   19 o   43.638   4.6957   42.106   8.0381   34.526   11.897   48.472   10.903   39.397   7.5970   47.879   5.5213 -8.482243 9.391414 
1 1 1   23   17   20 o   32.645   5.8360   24.352   7.9014   20.721   11.694   27.402   10.718   30.318   8.8203   34.971   7.6444 -4.653383 11.67196 
1 1 1   23   17   21 o   42.584   5.0236   40.944   8.2815   27.895   11.931   53.076   11.504   35.094   8.3618   50.075   5.5702 -14.98108 10.04727 
1 1 1   23   17   22 o   67.691   3.6607   96.630   10.198  100.295   15.020   93.494   13.891   68.843   5.2898   66.539   5.0616 2.303474 7.321309 
1 1 1   23   17   23 o   24.893   6.1406   11.483   7.8229   18.852   12.359   6.5563   10.105   28.961   9.2029   20.825   8.1323 8.136108 12.28117 
1 1 1   23   17   24 o   39.397   8.4039   22.794   11.392   15.407   12.255   69.766   30.903   26.817   9.1932   51.977   14.071 -25.16054 16.80776 
1 1 1   23   17   25 o   51.494   4.3216   56.139   9.0753   63.246   14.184   51.212   11.809   54.122   6.3540   48.866   5.8592 5.255932 8.643106 
1 1 1   23   17   26 f   80.998   3.5872  138.928   11.647  142.153   18.903  136.955   14.787   81.470   5.6257   80.527   4.4523 0.9431381 7.174357 
1 1 1   23   17   27 o   34.718   5.9142   29.057   9.4545   44.138   12.772   10.771   14.063   44.810   6.9103   24.625   9.5999 20.18562 11.82840 
1 1 1   23   17   28 o   44.155   4.8821   43.038   8.8844   45.379   12.782   40.851   12.358   45.345   6.8343   42.965   6.9738 2.379887 9.764275 
1 1 1   23   17   29 o   26.261   6.0888   15.540   8.1285   7.3908   12.111   22.221   10.965   21.930   8.7941   30.591   8.4235 -8.660469 12.17752 
1 1 1   23   17   30 o   30.761   6.2725   22.533   8.4905   29.150   12.720   17.215   11.402   34.544   8.8792   26.977   8.8622 7.566679 12.54510 
1 1 1   23   17   31 o   47.865   6.2403   51.617   11.141   64.079   20.637   46.491   13.235   50.365   10.283   45.365   7.0736 4.999313 12.48060 
1 1 1   23   17   32 o   34.619   7.5318   31.047   11.382   30.384   13.830   32.440   20.039   34.718   9.4190   34.521   11.756 0.1968002 15.06367 
1 1 1   23   17   33 o   34.115   7.4538   30.769   11.080   29.959   13.353   32.559   19.851   34.236   9.2415   33.994   11.697 0.2419815 14.90761 
1 1 1   23   17   34 o   29.645   7.7165   23.378   12.787   28.550   16.593   15.813   20.066   32.337   10.694   26.954   11.127 5.382460 15.43297 
1 1 1   23   17   35 o   26.007   7.6328   14.919   13.030   15.183   15.943   14.387   22.613   25.507   10.136   26.507   11.415 -0.9993057 15.26569 
1 1 1   23   17   36 o   54.327   7.4109   79.078   14.725   76.448   17.485   85.494   27.311   56.343   7.5240   52.310   12.770 4.032085 14.82173 
1 1 1   23   18    0 o   95.320   2.2843  188.429   12.667  188.429   12.667  188.429   12.667   95.320   3.2304   95.320   3.2304 0.000000 0.000000 
1 1 1   23   18    1 f   49.368   3.1660   50.803   6.3904   59.542   9.1667   42.540   8.9133   53.537   4.1514   45.199   4.7813 8.338421 6.332024 
1 1 1   23   18    2 o   72.897   2.5420  110.136   7.6390  115.065   10.928  105.425   10.683   74.495   3.5566   71.298   3.6329 3.197067 5.083972 
1 1 1   23   18    3 o  147.545   2.1527  450.541   13.097  461.108   18.758  440.489   18.295  149.232   3.0476  145.858   3.0411 3.373367 4.305383 
1 1 1   23   18    4 o   30.138   4.8877   19.860   5.9614   22.520   8.5014   17.286   8.3616   32.171   6.6276   28.105   7.1856 4.066458 9.775383 
1 1 1   23   18    5 o   25.221   5.0362   13.501   5.5983   18.046   8.1344   9.4113   7.7165   28.712   6.9448   21.730   7.2955 6.981861 10.07246 
1 1 1   23   18    6 o   89.213   2.4588  165.472   9.0116  170.577   12.329  159.615   13.205   90.720   3.2950   87.706   3.6504 3.013458 4.917572 
1 1 1   23   18    7 o  108.587   2.3282  244.828   10.385  249.213   14.141  239.695   15.300  109.672   3.1262  107.502   3.4508 2.169754 4.656332 
1 1 1   23   18    8 o   79.988   2.4500  132.530   8.0672  121.465   11.188  144.512   11.643   76.504   3.5458   83.471   3.3819 -6.966454 4.899955 
1 1 1   23   18    9 o  129.702   2.3916  352.732   12.613  322.919   19.023  376.122   16.850  124.682   3.6992  134.722   3.0324 -10.03922 4.783233 
1 1 1   23   18   10 o   58.790   3.2123   72.045   7.5329   72.321   12.337   71.881   9.5118   58.794   5.0876   58.786   3.9231 0.8285522E-02 6.424513 
1 1 1   23   18   11 o  106.907   2.5942  238.453   11.380  226.899   16.714  248.438   15.538  104.434   3.8803  109.380   3.4442 -4.945984 5.188393 
1 1 1   23   18   12 o   25.435   5.5054   12.311   6.1279   19.795   10.688   8.6461   7.4795   29.912   8.3463   20.959   7.1819 8.953346 11.01087 
1 1 1   23   18   13 o   53.338   3.6418   61.680   7.4758   53.302   12.645   66.182   9.2693   50.290   6.0962   56.386   3.9857 -6.095757 7.283506 
1 1 1   23   18   14 o  146.091   2.7182  452.329   15.034  423.262   26.862  465.586   18.141  142.331   4.5759  149.851   2.9352 -7.520416 5.436398 
1 1 1   23   18   15 o   78.778   2.9021  132.060   9.0050  120.476   14.782  138.896   11.355   75.822   4.7267   81.733   3.3685 -5.911194 5.804187 
1 1 1   23   18   16 o  161.586   2.9302  555.365   18.738  509.617   30.482  583.154   23.757  155.804   4.7436  167.369   3.4415 -11.56522 5.860498 
1 1 1   23   18   17 o   37.082   5.6562   24.217   7.2797   46.413   16.099   18.513   8.1618   45.318   8.9305   28.846   6.9438 16.47282 11.31241 
1 1 1   23   18   18 o   45.470   4.8638   43.159   7.6358   48.530   15.662   41.484   8.7455   46.514   8.4761   44.426   4.7729 2.088562 9.727563 
1 1 1   23   18   19 o  118.332   2.7327  292.484   13.333  283.120   18.812  301.935   18.898  116.408   3.9182  120.256   3.8102 -3.848274 5.465377 
1 1 1   23   18   20 o   61.185   3.5611   79.308   8.9346   71.566   12.855   86.543   12.427   58.195   5.3557   64.175   4.6949 -5.979675 7.122229 
1 1 1   23   18   21 o   72.965   3.6570  110.476   10.839  100.931   13.947  125.032   17.223   69.161   4.8894   76.770   5.4394 -7.609039 7.313942 
1 1 1   23   18   22 o   78.135   4.4157  137.924   13.301  157.812   16.969  106.234   21.419   86.470   4.7579   69.799   7.4402 16.67104 8.831409 
1 1 1   23   18   23 o   67.143   4.3182   98.772   11.659  111.081   15.583   83.119   17.572   72.346   5.2225   61.940   6.8785 10.40591 8.636424 
1 1 1   23   18   24 o   23.626   5.5800   9.4832   7.9130  -7.7879   12.394   21.367   10.281   16.756   7.7250   30.496   8.0543 -13.73998 11.16002 
1 1 1   23   18   25 o   19.496   5.7804   2.8791   7.7688   2.4292   11.934   3.2101   10.234   19.912   8.4242   19.079   7.9173 0.8321800 11.56075 
1 1 1   23   18   26 f   35.143   5.8901   29.267   8.4409   24.515   12.523   33.224   11.427   32.158   9.0563   38.127   7.5336 -5.969856 11.78015 
1 1 1   23   18   27 o   41.318   5.2518   38.339   8.7278   44.187   12.880   33.375   11.868   44.680   6.9893   37.955   7.8407 6.725113 10.50367 
1 1 1   23   18   28 f   34.216   7.1450   28.534   10.494   30.472   17.526   27.450   13.103   34.760   10.950   33.673   9.1818 1.086243 14.28998 
1 1 1   23   18   29 o   35.560   5.7240   31.260   8.8131   15.724   12.977   44.561   12.007   26.320   9.4251   44.800   6.4981 -18.47969 11.44807 
1 1 1   23   18   30 o   31.280   6.2799   24.243   8.5561   20.596   12.842   27.154   11.473   29.025   9.3979   33.534   8.3323 -4.509188 12.55972 
1 1 1   23   18   31 o   23.264   6.6233   9.6099   9.6760   1.7308   17.819   12.905   11.523   22.297   9.8540   24.231   8.8529 -1.933596 13.24666 
1 1 1   23   18   32 o   26.864   6.9005   17.653   10.509   23.473   12.705   5.0401   18.701   30.384   9.2826   23.344   10.213 7.040499 13.80100 
1 1 1   23   18   33 o   31.545   7.0159   27.828   11.085   35.023   13.508   12.992   19.396   37.208   8.9184   25.883   10.833 11.32531 14.03188 
1 1 1   23   18   34 o   39.677   8.2905   44.652   13.868   40.806   16.836   52.768   24.456   38.572   10.362   40.781   12.944 -2.209366 16.58109 
1 1 1   23   18   35 o   31.414   8.1379   30.016   14.212   35.134   18.303   22.243   22.554   34.323   11.226   28.506   11.785 5.817270 16.27571 
1 1 1   23   18   36 o   24.062   7.3759   9.7770   12.411   7.6976   14.649   15.064   23.359   21.848   9.2925   26.277   11.457 -4.428741 14.75178 
1 1 1   23   19    0 o   49.481   3.2262   52.017   9.1293   52.017   9.1293   52.017   9.1293   49.481   4.5625   49.481   4.5625 0.000000 0.000000 
1 1 1   23   19    1 o  132.764   2.1533  365.156   11.791  363.655   16.631  366.673   16.718  132.490   3.0435  133.038   3.0468 -0.5479126 4.306503 
1 1 1   23   19    2 o   48.055   3.2146   48.214   6.3522   52.377   8.9719   44.029   8.9950   50.162   4.3366   45.948   4.7464 4.213387 6.429163 
1 1 1   23   19    3 o   96.759   2.2764  194.143   9.0809  187.808   12.850  200.463   12.835   95.173   3.2736   98.344   3.1643 -3.171738 4.552885 
1 1 1   23   19    4 o   20.727   5.1577   8.0238   5.5090   6.4363   7.8093   9.5963   7.7726   19.597   7.2662   21.857   7.3220 -2.259890 10.31550 
1 1 1   23   19    5 o  165.195   2.1821  564.498   14.851  542.009   20.422  589.742   21.636  161.716   3.0617  168.673   3.1101 -6.957367 4.364277 
1 1 1   23   19    6 o   43.830   3.6304   40.274   6.3715   28.517   8.7095   53.810   9.3453   36.855   5.7297   50.804   4.4599 -13.94913 7.260863 
1 1 1   23   19    7 o   73.495   2.6202  113.082   7.8816  122.177   10.809  102.755   11.518   76.716   3.4160   70.273   3.9739 6.443596 5.240311 
1 1 1   23   19    8 o  137.031   2.3669  391.688   13.204  377.078   20.161  402.659   17.472  134.704   3.6289  139.357   3.0397 -4.653214 4.733821 
1 1 1   23   19    9 o  107.854   2.4854  245.199   10.851  219.396   16.482  264.936   14.416  102.683   3.8918  113.024   3.0924 -10.34104 4.970873 
1 1 1   23   19   10 o  136.538   2.4949  387.938   13.996  379.289   20.590  395.365   19.082  135.073   3.6960  138.004   3.3524 -2.931030 4.989864 
1 1 1   23   19   11 o   81.320   2.9274  139.192   9.7149  122.096   14.168  154.362   13.346   76.486   4.4913   86.155   3.7559 -9.668816 5.854805 
1 1 1   23   19   12 o   26.417   5.5462   14.646   6.1955   17.143   10.801   13.422   7.5635   28.044   8.5572   24.791   7.0580 3.252811 11.09238 
1 1 1   23   19   13 o   52.533   4.2384   60.438   7.8634   54.286   15.457   62.586   9.1336   50.301   7.4503   54.765   4.0437 -4.463387 8.476891 
1 1 1   23   19   14 o  123.348   2.4934  320.847   12.423  294.774   19.174  339.709   16.309  118.836   3.9120  127.861   3.0925 -9.025475 4.986753 
1 1 1   23   19   15 o  104.778   2.5839  230.417   10.897  221.397   17.230  236.429   14.067  102.926   4.0588  106.630   3.1986 -3.704399 5.167706 
1 1 1   23   19   16 o  107.938   2.9804  239.026   11.971  255.083   22.755  232.881   14.077  110.068   5.0125  105.808   3.2257 4.259727 5.960714 
1 1 1   23   19   17 o   64.566   3.9117   84.282   9.6365   98.743   17.877   78.358   11.441   68.026   6.3716   61.105   4.5396 6.920322 7.823387 
1 1 1   23   19   18 o   50.560   5.1137   58.181   8.1644   51.547   17.674   59.980   9.2054   47.584   9.3391   53.536   4.1690 -5.952492 10.22737 
1 1 1   23   19   19 o   76.390   3.4766  126.928   10.529  104.865   16.424  142.320   13.719   70.306   5.6642   82.475   4.0329 -12.16909 6.953218 
1 1 1   23   19   20 o   68.804   3.3740  100.361   9.5123   94.493   14.009  105.381   12.957   66.824   5.0829   70.783   4.4383 -3.959312 6.747913 
1 1 1   23   19   21 o   90.769   3.0352  173.059   11.357  170.412   15.775  175.907   16.365   90.067   4.2464   91.472   4.3378 -1.404068 6.070319 
1 1 1   23   19   22 o   26.277   6.0849   15.219   7.7977   10.252   11.951   18.902   10.290   23.750   8.9526   28.803   8.2434 -5.053276 12.16975 
1 1 1   23   19   23 o   58.794   4.8089   73.072   11.476   58.524   14.958   93.883   17.891   51.788   7.0031   65.799   6.5924 -14.01102 9.617834 
1 1 1   23   19   24 o   44.585   5.1922   45.907   8.8567   37.500   14.011   51.502   11.430   40.157   8.7100   49.013   5.6542 -8.856201 10.38435 
1 1 1   23   19   25 o   49.388   7.3871   74.529   11.622   33.461   29.046   82.357   12.681   36.636   13.921   62.141   4.9477 -25.50494 14.77427 
1 1 1   23   19   26 f   25.085   6.2547   12.802   8.1291   18.728   12.421   8.3626   10.751   28.347   9.2466   21.824   8.4254 6.523483 12.50948 
1 1 1   23   19   27 o   51.576   4.3130   58.837   9.0397   50.573   13.227   66.080   12.383   47.833   6.7047   55.319   5.4272 -7.486496 8.626012 
1 1 1   23   19   28 o   27.352   6.6705   17.578   9.1341   18.166   12.614   16.930   13.245   27.672   9.3273   27.032   9.5386 0.6392460 13.34105 
1 1 1   23   19   29 o   50.005   4.8182   57.896   9.3043   42.434   13.394   72.317   12.935   42.397   7.9515   57.612   5.4436 -15.21452 9.636367 
1 1 1   23   19   30 o   31.401   6.5129   24.680   9.1020   20.446   13.255   28.458   12.521   28.831   9.5590   33.970   8.8485 -5.139120 13.02574 
1 1 1   23   19   31 o   27.046   7.6709   15.215   13.392   7.1060   19.089   23.075   18.794   24.148   10.444   29.945   11.239 -5.796286 15.34183 
1 1 1   23   19   32 o   44.472   7.0113   48.750   11.690   44.175   13.912   59.736   21.558   42.515   8.2316   46.430   11.352 -3.915447 14.02269 
1 1 1   23   19   33 o   21.402   6.8094  -0.9793   12.191  -7.1774   15.348   9.6149   20.066   18.092   8.4284   24.712   10.697 -6.620306 13.61887 
1 1 1   23   19   34 o   54.334   6.8457   73.081   14.273   62.987   17.344   94.259   25.122   50.441   8.3370   58.227   10.860 -7.786343 13.69142 
1 1 1   23   19   35 o   20.587   6.7725  -6.7873   13.489 -15.9301   17.155   8.0194   21.831   17.044   8.2124   24.130   10.771 -7.086023 13.54490 
1 1 1   23   20    0 o   23.792   6.1836   15.820   7.9341   15.820   7.9341   15.820   7.9341   23.792   8.7449   23.792   8.7449 0.000000 0.000000 
1 1 1   23   20    1 o   35.026   4.1543   26.226   5.8282   22.485   8.1317   30.178   8.3575   32.112   6.3646   37.940   5.3409 -5.827934 8.308608 
1 1 1   23   20    2 o   68.697   2.5681   98.059   7.2743   94.881   10.223  101.319   10.353   67.564   3.6685   69.830   3.5948 -2.265549 5.136175 
1 1 1   23   20    3 o  102.832   2.2229  219.322   9.4277  221.998   13.395  216.696   13.271  103.454   3.1392  102.210   3.1482 1.244537 4.445877 
1 1 1   23   20    4 o  111.167   2.2003  256.338   10.087  258.692   14.211  253.948   14.321  111.686   3.0851  110.647   3.1380 1.039482 4.400582 
1 1 1   23   20    5 o   43.787   3.5566   39.972   6.4102   37.320   8.7460   43.051   9.4224   42.225   5.0220   45.349   5.0377 -3.124348 7.113272 
1 1 1   23   20    6 o  135.570   2.2706  381.027   12.629  378.347   16.983  384.343   18.888  135.077   3.0484  136.062   3.3658 -0.9842682 4.541109 
1 1 1   23   20    7 o  109.684   2.4382  250.279   10.775  247.753   17.134  251.932   13.858  109.142   3.8063  110.226   3.0482 -1.084534 4.876424 
1 1 1   23   20    8 o  104.927   2.4504  225.982   10.324  240.264   16.848  217.396   13.064  107.474   3.8009  102.380   3.0937 5.093819 4.900829 
1 1 1   23   20    9 o  100.110   2.4834  210.003   9.9781  200.501   15.876  216.206   12.828   98.127   3.9228  102.093   3.0466 -3.966042 4.966839 
1 1 1   23   20   10 o  117.532   2.9192  291.109   13.955  309.183   18.633  268.020   21.059  121.862   3.7072  113.203   4.5105 8.659386 5.838476 
1 1 1   23   20   11 o  114.415   2.4217  268.472   11.058  287.639   18.360  257.561   13.852  117.459   3.7899  111.370   3.0157 6.088966 4.843373 
1 1 1   23   20   12 o   46.379   5.0743   52.270   7.6246   37.167   15.143   57.399   8.8248   40.351   9.2912   52.407   4.0827 -12.05604 10.14862 
1 1 1   23   20   13 o   95.351   3.1669  192.316   11.783  184.966   20.024  196.209   14.573   93.685   5.1821   97.018   3.6419 -3.333206 6.333871 
1 1 1   23   20   14 o  103.767   2.5949  229.022   10.714  205.834   17.099  244.008   13.747   99.184   4.1799  108.349   3.0762 -9.164459 5.189841 
1 1 1   23   20   15 o  101.862   2.9274  223.302   11.317  200.529   19.879  234.222   13.766   97.599   4.9384  106.125   3.1449 -8.526802 5.854730 
1 1 1   23   20   16 o  158.225   3.1172  520.559   20.343   0.0000   0.0000  520.559   20.343  ?   ?   158.225   3.1172      ?      ? 
1 1 1   23   20   17 o   80.098   3.4525  140.179   9.7177  124.927   19.221  145.417   11.263   76.609   6.0831   83.586   3.2671 -6.976463 6.904959 
1 1 1   23   20   18 o   42.109   5.6020   41.579   7.5898   35.670   16.646   43.129   8.5279   38.943   10.231   45.276   4.5668 -6.333195 11.20395 
1 1 1   23   20   19 o   43.504   4.6743   40.683   8.2750   41.505   12.829   40.097   10.829   43.731   7.1128   43.277   6.0668 0.4538383 9.348679 
1 1 1   23   20   20 o  118.179   2.6504  292.273   12.913  291.617   18.530  292.893   18.004  118.023   3.8066  118.335   3.6888 -0.3119354 5.300710 
1 1 1   23   20   21 o   26.992   6.0825   16.326   7.9205   10.186   11.998   21.069   10.544   23.695   8.9609   30.289   8.2273 -6.594013 12.16502 
1 1 1   23   20   22 o   70.832   4.1725  114.915   11.150   86.222   18.530  131.198   13.959   62.766   7.1581   78.898   4.2897 -16.13250 8.345039 
1 1 1   23   20   23 o   65.884   3.8605   94.296   10.249   85.010   15.784  101.066   13.476   62.738   6.0999   69.030   4.7334 -6.291679 7.720974 
1 1 1   23   20   24 o   63.852   4.0111   82.155   10.208  115.667   17.234   64.040   12.671   73.204   5.7080   54.500   5.6368 18.70399 8.022150 
1 1 1   23   20   25 o   86.365   3.2172  159.359   11.397  149.993   16.687  167.547   15.602   83.811   4.8274   88.920   4.2542 -5.109192 6.434449 
1 1 1   23   20   26 o   84.509   3.2146  152.607   11.168  140.425   15.920  164.409   15.669   81.047   4.7627   87.972   4.3186 -6.925407 6.429150 
1 1 1   23   20   27 f   46.372   4.6387   47.442   8.8310   52.407   13.288   43.514   11.819   48.483   6.6451   44.262   6.4740 4.220325 9.277385 
1 1 1   23   20   28 o   64.776   4.1537   93.733   10.878  106.857   14.829   78.445   16.005   70.250   5.1181   59.302   6.5436 10.94834 8.307478 
1 1 1   23   20   29 o   71.536   3.5772  111.674   10.469  100.820   15.234  121.389   14.412   67.950   5.4358   75.121   4.6515 -7.170883 7.154386 
1 1 1   23   20   30 o   71.396   3.6417  111.453   10.707  105.363   15.212  117.433   15.073   69.327   5.3199   73.464   4.9747 -4.137161 7.283471 
1 1 1   23   20   31 o   29.960   7.9534   23.794   13.307   23.617   19.351   23.953   18.329   29.898   11.362   30.023   11.132 -0.1256237 15.90671 
1 1 1   23   20   32 o   28.931   7.5354   20.483   11.090   16.819   13.282   28.918   20.153   26.103   9.5095   31.758   11.692 -5.655493 15.07083 
1 1 1   23   20   33 o   29.150   7.7670   22.691   12.350   18.494   15.499   29.991   20.439   26.734   10.167   31.566   11.745 -4.831234 15.53399 
1 1 1   23   20   34 o   19.647   6.3479  -6.5435   12.750   8.7941   15.795 -35.2371   21.603   22.639   9.6395   16.654   8.2622 5.984755 12.69580 
1 1 1   23   21    0 o   83.007   2.3951  143.285   11.552  143.285   11.552  143.285   11.552   83.007   3.3871   83.007   3.3871 0.000000 0.000000 
1 1 1   23   21    1 o   33.773   4.2895   24.479   5.8291   26.989   8.2592   21.988   8.2281   35.842   5.5870   31.705   6.5103 4.137501 8.578980 
1 1 1   23   21    2 o   91.226   2.2975  172.706   8.6441  174.285   12.283  171.156   12.167   91.639   3.2499   90.813   3.2484 0.8262558 4.594965 
1 1 1   23   21    3 o   23.458   5.0624   11.743   5.4013   9.5422   7.7023   13.872   7.5765   21.733   7.2888   25.183   7.0275 -3.449066 10.12483 
1 1 1   23   21    4 o   56.279   3.0159   66.914   6.9051   76.463   9.5393   56.403   10.008   60.615   3.8156   51.943   4.6716 8.672348 6.031808 
1 1 1   23   21    5 f   86.459   2.4630  155.016   8.7539  151.197   11.846  159.609   12.993   85.312   3.3667   87.607   3.5958 -2.295662 4.925902 
1 1 1   23   21    6 f   90.679   2.5617  171.396   9.3487  169.806   14.913  172.426   11.999   90.241   4.0068   91.118   3.1929 -0.8768845 5.123328 
1 1 1   23   21    7 o   95.718   2.5080  189.301   9.6291  196.624   15.678  184.866   12.202   97.098   3.9148   94.339   3.1359 2.758774 5.015936 
1 1 1   23   21    8 o   96.681   2.5709  197.975   9.9209  180.761   15.792  209.199   12.751   93.012   4.1165  100.349   3.0809 -7.336929 5.141719 
1 1 1   23   21    9 o   67.948   3.1115   95.948   8.6493  102.370   13.255   91.186   11.414   69.864   4.6001   66.031   4.1911 3.833015 6.223010 
1 1 1   23   21   10 o   18.549   5.3189   3.0537   6.5721  -2.8772   10.398   6.9997   8.4812   16.859   7.4851   20.239   7.5588 -3.380690 10.63778 
1 1 1   23   21   11 o   58.906   3.7738   76.257   7.9859   66.831   15.206   79.848   9.3844   55.932   6.5913   61.880   3.6770 -5.947712 7.547564 
1 1 1   23   21   12 o   57.149   4.3500   78.058   8.2925   54.063   16.274   86.473   9.6374   49.901   7.9073   64.398   3.6285 -14.49705 8.700054 
1 1 1   23   21   13 o   73.349   2.9842  116.409   8.4730  100.763   14.179  125.099   10.567   69.174   4.9699   77.524   3.3049 -8.350777 5.968405 
1 1 1   23   21   14 o   20.878   5.5391   7.4436   6.0740   6.8099   11.220   7.7063   7.2242   21.764   8.5489   19.993   7.0458 1.771147 11.07821 
1 1 1   23   21   15 o   55.556   3.6847   68.418   7.7952   55.583   13.159   75.356   9.6756   51.058   6.2489   60.053   3.9064 -8.994751 7.369399 
1 1 1   23   21   16 o   29.850   6.0884   18.782   6.8738   22.331   14.978   17.835   7.7367   31.436   10.146   28.265   6.7327 3.170597 12.17681 
1 1 1   23   21   17 o   23.503   6.1622   9.1560   6.7321   13.594   14.880   8.0139   7.5489   26.706   10.005   20.300   7.1972 6.405722 12.32443 
1 1 1   23   21   18 o   49.049   4.7279   49.147   9.0928   61.065   16.110   43.575   11.015   52.942   7.3778   45.156   5.9143 7.786354 9.455729 
1 1 1   23   21   19 o   42.601   4.7674   39.023   8.1106   47.780   12.380   32.438   10.735   47.100   6.3728   38.103   7.0922 8.997318 9.534802 
1 1 1   23   21   20 o   24.920   5.9519   12.254   7.5189   19.565   11.304   6.4524   10.069   29.190   8.7204   20.649   8.1027 8.540281 11.90371 
1 1 1   23   21   21 o   29.106   5.5568   19.775   7.7727   5.5169   11.763   30.824   10.355   21.168   8.6035   37.043   7.0351 -15.87523 11.11363 
1 1 1   23   21   22 o   59.225   4.3326   74.320   10.434   66.599   13.448   85.997   16.537   55.562   5.8683   62.888   6.3757 -7.325851 8.665250 
1 1 1   23   21   23 o   23.747   6.1161   11.110   7.7379   14.608   11.853   8.5129   10.215   25.816   9.0301   21.679   8.2514 4.136656 12.23226 
1 1 1   23   21   24 o  114.143   3.6722  268.121   15.269  305.829   30.384  255.382   17.661  118.285   6.2280  110.002   3.8926 8.282631 7.344454 
1 1 1   23   21   25 o   31.202   6.2517   23.334   8.3279   23.779   13.000   23.024   10.846   31.289   9.3524   31.114   8.2987 0.1749630 12.50344 
1 1 1   23   21   26 o   45.619   4.9906   49.148   8.7219   37.319   13.199   58.317   11.620   39.477   8.3665   51.762   5.4431 -12.28552 9.981242 
1 1 1   23   21   27 o   44.033   5.1629   45.135   8.9532   40.163   13.551   48.988   11.928   40.993   8.2993   47.074   6.1434 -6.080273 10.32572 
1 1 1   23   21   28 o   48.660   4.6541   53.467   9.2508   48.582   13.568   57.711   12.646   46.239   7.1145   51.081   6.0024 -4.842499 9.308294 
1 1 1   23   21   29 o   29.723   6.4452   20.627   9.4251   9.0270   12.711   34.794   14.047   22.402   9.0001   37.043   9.2283 -14.64168 12.89046 
1 1 1   23   21   30 o   35.911   6.1309   31.895   8.9489   37.310   13.556   27.713   11.914   38.611   8.7188   33.210   8.6218 5.400726 12.26185 
1 1 1   23   21   31 o   26.643   7.2724   16.456   10.805   13.981   13.213   21.453   18.774   24.623   9.3815   28.663   11.115 -4.039282 14.54471 
1 1 1   23   21   32 o   27.635   8.3307   15.806   15.548   31.682   28.044   8.7609   18.682   31.569   13.103   23.701   10.291 7.867193 16.66133 
1 1 1   23   21   33 o   41.376   7.9607   50.165   13.595   48.635   16.866   53.002   22.970   42.222   9.8633   40.530   12.498 1.692101 15.92138 
1 1 1   23   22    0 o   78.129   2.4300  127.187   11.025  127.187   11.025  127.187   11.025   78.129   3.4365   78.129   3.4365 0.000000 0.000000 
1 1 1   23   22    1 o   67.838   2.5945   95.928   7.2568   94.898   10.359   96.919   10.169   67.470   3.7225   68.206   3.6149 -0.7355652 5.188909 
1 1 1   23   22    2 o   66.965   2.6221   93.319   7.2140  105.156   10.436   82.487   9.9833   71.053   3.5612   62.877   3.8496 8.175270 5.244177 
1 1 1   23   22    3 o   76.111   2.5778  121.016   8.0673  125.285   11.111  116.257   11.732   77.571   3.4730   74.651   3.8104 2.919487 5.155602 
1 1 1   23   22    4 o  121.653   2.6051  305.121   12.475  297.369   15.396  319.936   21.285  119.614   3.1208  123.692   4.1722 -4.077538 5.210219 
1 1 1   23   22    5 o   99.907   2.8120  207.905   11.569  193.173   15.928  224.355   16.832   96.159   4.0161  103.656   3.9371 -7.496704 5.624004 
1 1 1   23   22    6 o  143.680   2.6601  435.918   14.510  416.775   25.942  444.633   17.504  141.024   4.4601  146.336   2.9002 -5.311646 5.320111 
1 1 1   23   22    7 o  104.848   2.4672  231.398   10.344  218.519   16.560  239.638   13.246  102.293   3.9251  107.404   2.9903 -5.111244 4.934381 
1 1 1   23   22    8 o   17.771   5.0787   3.1318   5.9006  -3.3520   10.154   6.4374   7.2503   16.457   7.3461   19.086   7.0149 -2.628408 10.15740 
1 1 1   23   22    9 o   87.120   2.8018  159.281   9.9772  152.986   14.978  164.303   13.377   85.480   4.2483   88.759   3.6541 -3.279327 5.603662 
1 1 1   23   22   10 o   96.023   2.7071  193.355   10.651  184.089   15.762  201.143   14.450   93.818   4.0733   98.228   3.5668 -4.409843 5.414226 
1 1 1   23   22   11 o  112.139   2.8867  268.174   11.971  251.076   22.238  275.150   14.205  109.209   4.9371  115.070   2.9930 -5.860718 5.773431 
1 1 1   23   22   12 o   82.274   3.3344  152.442   9.7232  121.320   18.369  164.556   11.460   75.589   5.8920   88.959   3.1235 -13.36960 6.668769 
1 1 1   23   22   13 o   74.928   2.8704  118.258   8.4306  114.880   14.234  120.082   10.463   73.924   4.6686   75.932   3.3410 -2.008163 5.740880 
1 1 1   23   22   14 o   38.124   5.5498   35.587   7.4099   25.649   14.821   38.898   8.5559   33.302   9.9933   42.945   4.8304 -9.643158 11.09951 
1 1 1   23   22   15 o   64.410   3.4957   87.959   9.2340   85.068   13.666   90.387   12.526   63.338   5.2315   65.481   4.6379 -2.142864 6.991328 
1 1 1   23   22   16 o   53.166   3.9870   56.492   7.6542   68.189   15.646   52.812   8.7762   56.192   6.7509   50.140   4.2438 6.051651 7.973961 
1 1 1   23   22   17 o   45.745   5.1226   47.516   7.6132   43.822   16.107   48.579   8.6392   43.447   9.2712   48.044   4.3598 -4.597260 10.24510 
1 1 1   23   22   18 o   77.084   3.5227  127.426   9.5517  123.316   19.264  128.766   10.999   75.672   6.1722   78.495   3.3974 -2.822289 7.045452 
1 1 1   23   22   19 o   42.415   4.9291   40.312   8.2783   34.724   12.193   45.092   11.276   39.038   7.8448   45.791   5.9702 -6.753517 9.858231 
1 1 1   23   22   20 o   66.265   3.5502   94.052   9.6329   83.712   13.871  103.685   13.388   62.574   5.3747   69.956   4.6400 -7.382473 7.100458 
1 1 1   23   22   21 o   21.232   5.7683   7.3170   7.4243   0.9291   11.499   11.883   9.7221   18.868   8.1328   23.596   8.1824 -4.728426 11.53667 
1 1 1   23   22   22 o   32.844   6.6167   24.558   9.3493   18.367   11.938   34.378   15.035   28.092   9.0574   37.596   9.6480 -9.504230 13.23332 
1 1 1   23   22   23 o   54.441   5.0119   71.431   9.7859   51.936   16.420   82.169   12.187   46.860   8.8194   62.022   4.7640 -15.16138 10.02388 
1 1 1   23   22   24 f   17.467   5.4888  -1.4267   7.7990  -6.9520   13.361   1.4287   9.6050   17.414   8.0258   17.520   7.4897 -0.1050453 10.97766 
1 1 1   23   22   25 o   21.886   6.0529   3.9603   8.1575   18.816   13.877  -3.8835   10.084   28.040   9.7728   15.733   7.1444 12.30716 12.10580 
1 1 1   23   22   26 f   54.186   4.0253   63.606   8.9446   71.542   13.551   57.479   11.907   57.115   5.7524   51.258   5.6323 5.857262 8.050609 
1 1 1   23   22   27 o   31.054   6.1610   22.995   8.3032   31.029   12.700   16.997   10.973   35.496   8.7343   26.612   8.6915 8.883755 12.32196 
1 1 1   23   22   28 o   39.084   5.6894   36.929   8.8284   38.012   13.192   36.050   11.881   39.371   8.3810   38.798   7.6965 0.5736694 11.37883 
1 1 1   23   22   29 o   65.440   4.2882   96.299   11.319   97.186   14.653   94.986   17.825   66.404   5.3502   64.477   6.7029 1.926834 8.576306 
1 1 1   23   22   30 o   27.752   7.1329   20.144   10.711   23.268   13.281   14.332   18.115   29.734   9.5496   25.770   10.598 3.964054 14.26589 
1 1 1   23   22   31 o   22.502   6.8196   6.6171   10.691   2.8683   13.054   14.252   18.629   19.547   8.5426   25.456   10.632 -5.909716 13.63910 
1 1 1   23   22   32 o   34.805   9.0601   40.392   16.698   42.727   29.853   39.329   20.145   34.128   13.764   35.483   11.785 -1.354916 18.12026 
1 1 1   23   23    0 o   49.116   3.2235   51.439   9.0521   51.439   9.0521   51.439   9.0521   49.116   4.5587   49.116   4.5587 0.000000 0.000000 
1 1 1   23   23    1 o   29.217   5.5793   20.348   6.7352   13.235   12.653   23.161   7.9561   25.927   9.3044   32.507   6.1596 -6.580286 11.15851 
1 1 1   23   23    2 o   79.213   2.4459  130.627   7.9873  136.275   11.432  125.241   11.164   80.892   3.4265   77.534   3.4912 3.358528 4.891784 
1 1 1   23   23    3 o   87.871   2.4441  160.228   8.8318  153.327   11.952  168.529   13.109   85.814   3.3768   89.927   3.5343 -4.112602 4.888119 
1 1 1   23   23    4 o   44.614   3.8937   41.816   6.9702   43.350   11.323   40.881   8.8447   45.145   6.0812   44.083   4.8646 1.062084 7.787474 
1 1 1   23   23    5 o   60.347   3.2958   79.975   7.6990   64.829   12.591   89.020   9.7301   55.354   5.5148   65.339   3.6106 -9.984684 6.591575 
1 1 1   23   23    6 o   68.483   2.9526   99.669   7.9833   92.623   13.104  103.828   10.067   66.370   4.7871   70.596   3.4575 -4.225426 5.905122 
1 1 1   23   23    7 o   95.125   2.5476  188.736   9.7157  188.414   15.689  188.936   12.374   94.935   4.0068   95.314   3.1476 -0.3788147 5.095279 
1 1 1   23   23    8 o   73.620   2.8482  115.088   8.2975  106.615   13.539  120.185   10.500   71.262   4.6065   75.979   3.3508 -4.717155 5.696320 
1 1 1   23   23    9 o   95.969   2.6798  192.691   10.543  188.197   15.695  196.385   14.232   94.877   4.0108   97.061   3.5550 -2.183784 5.359541 
1 1 1   23   23   10 o   18.431   5.5851   0.8338   7.3983  -3.2348   12.736   2.9061   9.0892   18.605   8.2711   18.257   7.5075 0.3481369 11.17019 
1 1 1   23   23   11 o   71.472   3.3535  103.420   8.7029  116.631   17.407   99.017   10.049   74.062   5.6985   68.882   3.5372 5.180771 6.707057 
1 1 1   23   23   12 o   40.232   4.6289   37.187   6.7910   30.419   11.804   40.535   8.3025   36.594   8.0407   43.869   4.5887 -7.274380 9.257877 
1 1 1   23   23   13 o  139.390   2.4621  406.037   13.983  403.581   21.468  407.848   18.429  138.886   3.7477  139.893   3.1940 -1.007126 4.924159 
1 1 1   23   23   14 o   64.798   3.1038   83.722   7.9779  105.521   13.770   72.707   9.7883   70.715   4.7210   58.881   4.0306 11.83481 6.207576 
1 1 1   23   23   15 o   66.868   3.2237   98.090   8.3074   82.417   13.869  106.860   10.374   62.234   5.4032   71.503   3.5178 -9.269524 6.447457 
1 1 1   23   23   16 o   98.399   3.2372  205.093   12.457  202.710   21.209  206.348   15.391   97.580   5.2699   99.217   3.7611 -1.636856 6.474407 
1 1 1   23   23   17 o   61.954   4.4711   96.794   8.8454   59.196   17.546  109.605   10.242   51.514   8.2582   72.395   3.4302 -20.88089 8.942276 
1 1 1   23   23   18 o   18.945   5.7106  -6.5317   7.5366   12.863   14.517 -13.6882   8.8181   25.941   9.8454   11.949   5.7890 13.99269 11.42124 
1 1 1   23   23   19 o   90.586   3.0684  173.764   11.454  168.727   16.369  178.596   16.034   89.241   4.4473   91.931   4.2287 -2.690353 6.136793 
1 1 1   23   23   20 o   83.625   3.0574  149.221   10.467  134.362   15.190  162.654   14.443   79.466   4.6345   87.784   3.9890 -8.317886 6.114786 
1 1 1   23   23   21 o   44.981   5.2501   45.083   9.4817   40.075   12.530   51.794   14.504   41.792   7.5468   48.170   7.3006 -6.378304 10.50017 
1 1 1   23   23   22 o   50.977   4.3143   57.606   8.8868   52.018   13.550   61.824   11.772   48.432   6.7833   53.521   5.3330 -5.088875 8.628645 
1 1 1   23   23   23 o   45.270   5.7390   53.346   9.4179   33.111   15.928   64.224   11.678   36.063   10.234   54.476   5.1976 -18.41254 11.47795 
1 1 1   23   23   24 o   50.098   4.3599   54.488   8.8681   61.412   14.102   49.959   11.405   52.484   6.5148   47.712   5.7958 4.771851 8.719739 
1 1 1   23   23   25 o   22.466   5.7447   9.3664   8.0681  -7.6510   13.861   18.086   9.9219   17.448   8.0878   27.485   8.1604 -10.03681 11.48936 
1 1 1   23   23   26 o   23.071   6.0116   11.345   7.8077   5.5719   12.299   15.243   10.105   20.787   8.6569   25.354   8.3436 -4.566715 12.02319 
1 1 1   23   23   27 f   24.909   6.1235   14.504   8.1800   6.9293   12.420   20.307   10.871   21.258   8.7628   28.560   8.5558 -7.301388 12.24702 
1 1 1   23   23   28 o   18.093   5.6324   0.4036   8.0709   1.7739   12.369  -0.6124   10.651   19.087   8.3293   17.098   7.5842 1.989634 11.26489 
1 1 1   23   23   29 o   17.293   5.4963  -8.2487   9.0469 -23.8772   12.718   7.7585   12.871   13.037   6.4445   21.550   8.9054 -8.512836 10.99265 
1 1 1   23   23   30 o   35.066   8.5657   39.387   13.878   40.640   14.496   25.635   48.026   39.379   9.1068   30.753   14.510 8.626242 17.13141 
1 1 1   23   23   31 o   20.288   6.5171  -3.1137   12.076 -13.2830   16.212   9.5577   18.097   17.005   8.1385   23.570   10.181 -6.564713 13.03418 
1 1 1   23   24    0 o   52.179   3.0512   57.722   9.1403   57.722   9.1403   57.722   9.1403   52.179   4.3150   52.179   4.3150 0.000000 0.000000 
1 1 1   23   24    1 o   65.332   3.0746   92.130   7.9872   76.901   12.427  102.851   10.426   60.429   4.9858   70.235   3.5992 -9.805607 6.149222 
1 1 1   23   24    2 o   29.100   4.8413   18.920   5.7393   21.703   8.0537   16.048   8.1810   31.361   6.4420   26.840   7.2287 4.521093 9.682662 
1 1 1   23   24    3 o   90.901   2.6758  173.099   9.9588  166.976   14.858  178.094   13.419   89.362   4.0313   92.440   3.5197 -3.078400 5.351601 
1 1 1   23   24    4 o   37.018   4.4528   28.229   6.4908   35.700   10.871   24.090   8.0914   40.878   6.4479   33.158   6.1428 7.719757 8.905569 
1 1 1   23   24    5 o   54.389   3.7845   61.517   8.2401   66.801   13.600   58.451   10.358   56.064   5.8815   52.713   4.7641 3.351166 7.568906 
1 1 1   23   24    6 o   62.614   3.2822   82.306   8.4523   84.155   12.486   80.741   11.484   63.223   4.7881   62.004   4.4906 1.218899 6.564405 
1 1 1   23   24    7 o   21.699   5.4455   7.0429   6.0141   15.504   10.542   2.9605   7.3227   26.593   8.5048   16.806   6.8032 9.786791 10.89109 
1 1 1   23   24    8 o   62.834   3.0400   80.807   7.6779   92.261   12.642   74.112   9.6646   66.181   4.6314   59.488   3.9390 6.692425 6.079926 
1 1 1   23   24    9 o   78.548   3.0041  131.613   9.5487  116.432   14.439  143.412   12.730   74.295   4.7120   82.802   3.7275 -8.507080 6.008102 
1 1 1   23   24   10 o   36.071   5.4215   37.031   7.3166   11.752   14.817   45.183   8.4140   25.797   9.9092   46.346   4.4018 -20.54855 10.84293 
1 1 1   23   24   11 o   56.141   3.5738   68.231   7.6216   62.619   13.425   70.901   9.2583   54.095   6.0170   58.187   3.8578 -4.091438 7.147523 
1 1 1   23   24   12 o   39.329   4.4891   33.887   6.6439   33.273   11.494   34.195   8.1418   38.453   7.5167   40.204   4.9101 -1.750435 8.978287 
1 1 1   23   24   13 o   25.875   4.7901   16.649   6.1735  -1.0897   11.446   23.927   7.3314   18.219   7.9798   33.531   5.3012 -15.31197 9.580182 
1 1 1   23   24   14 o   70.002   3.0755  105.614   8.3913   95.748   14.038  111.099   10.467   67.127   5.0703   72.878   3.4823 -5.751343 6.151001 
1 1 1   23   24   15 o   25.779   5.7074   13.997   6.2230   17.119   11.853   12.809   7.3118   27.619   9.0338   23.938   6.9776 3.681093 11.41472 
1 1 1   23   24   16 o   66.405   4.1010  107.317   8.9703   72.362   17.687  119.422   10.408   57.242   7.4914   75.568   3.3395 -18.32600 8.202072 
1 1 1   23   24   17 o   25.282   6.1043   12.866   6.4755   15.631   14.848   12.216   7.1959   27.230   10.034   23.335   6.9544 3.895357 12.20851 
1 1 1   23   24   18 o   83.723   3.6660  153.069   12.130  139.238   19.676  161.549   15.407   80.105   5.9555   87.340   4.2769 -7.234955 7.332045 
1 1 1   23   24   19 o   52.288   4.0410   60.207   8.5342   52.184   12.832   66.570   11.428   48.806   6.3748   55.771   4.9681 -6.964523 8.082096 
1 1 1   23   24   20 o   27.088   6.1330   16.799   7.6452   18.892   12.021   15.378   9.9071   28.318   9.0844   25.857   8.2421 2.460382 12.26609 
1 1 1   23   24   21 o   30.984   6.4390   23.660   9.1895   30.633   12.420   15.225   13.660   35.704   8.5476   26.264   9.6323 9.439970 12.87804 
1 1 1   23   24   22 o   40.693   5.9129   41.762   9.1430   31.964   15.807   46.688   11.208   35.307   10.250   46.079   5.8974 -10.77240 11.82577 
1 1 1   23   24   23 o   53.354   4.1122   62.627   8.9376   61.585   13.658   63.407   11.820   52.694   6.2842   54.015   5.3056 -1.321243 8.224398 
1 1 1   23   24   24 o   40.495   5.2914   37.041   8.4862   54.821   13.075   24.099   11.155   49.561   6.3964   31.429   8.4310 18.13169 10.58282 
1 1 1   23   24   25 o  111.391   3.1851  267.072   14.345  268.634   22.622  266.022   18.551  111.187   4.9331  111.595   4.0305 -0.4077988 6.370208 
1 1 1   23   24   26 o   35.298   5.7718   31.926   8.4612   22.234   13.327   38.470   10.951   29.390   9.5776   41.205   6.4440 -11.81534 11.54358 
1 1 1   23   24   27 o   16.759   5.2854  -1.3995   7.5060  -7.4112   12.164   2.2968   9.5384   16.030   7.4796   17.488   7.4697 -1.458694 10.57076 
1 1 1   23   24   28 o   62.109   4.0384   86.872   10.297   82.649   15.022   90.615   14.142   60.389   6.0313   63.829   5.3720 -3.440022 8.076840 
1 1 1   23   24   29 o   26.260   7.1663   14.600   10.571   7.7669   12.855   28.874   18.579   21.304   8.8597   31.216   11.266 -9.911510 14.33251 
1 1 1   23   24   30 o   27.085   7.9619   18.946   12.957   21.934   13.490 -16.6495   46.558   28.372   9.6454   25.798   12.670 2.574156 15.92374 
1 1 1   23   25    0 o   19.618   6.8431   12.217   9.3786   12.217   9.3786   12.217   9.3786   19.618   9.6776   19.618   9.6776 0.000000 0.000000 
1 1 1   23   25    1 o   43.709   3.8407   40.303   6.7428   39.353   8.5699   41.848   10.925   43.175   4.8126   44.243   5.9868 -1.068237 7.681338 
1 1 1   23   25    2 o   66.437   3.0256   92.830   8.1619   92.192   12.677   93.281   10.667   66.132   4.6477   66.743   3.8750 -0.6107330 6.051174 
1 1 1   23   25    3 o   83.953   2.7493  148.612   9.3501  141.937   14.473  153.392   12.249   82.192   4.2695   85.715   3.4649 -3.523132 5.498544 
1 1 1   23   25    4 o   70.075   2.8932  102.471   8.0776  105.160   13.332  100.912   10.153   70.647   4.5756   69.502   3.5419 1.145248 5.786307 
1 1 1   23   25    5 o  106.107   2.4574  237.013   10.444  226.581   16.704  243.709   13.383  104.007   3.8940  108.207   2.9987 -4.200310 4.914832 
1 1 1   23   25    6 o   31.395   5.1320   21.145   6.3004   26.599   10.684   18.236   7.8012   34.254   7.7439   28.536   6.7364 5.718548 10.26394 
1 1 1   23   25    7 o   25.142   5.3389   11.857   5.9766   21.911   10.317   6.7793   7.3321   31.001   8.0112   19.284   7.0594 11.71710 10.67773 
1 1 1   23   25    8 o   28.162   5.7357   16.969   7.7165   28.005   11.096   6.6328   10.739   35.098   7.8604   21.225   8.3552 13.87312 11.47143 
1 1 1   23   25    9 o   60.992   5.0662   89.229   11.026   50.632   16.693  119.102   14.685   46.913   8.9538   75.072   4.7429 -28.15915 10.13243 
1 1 1   23   25   10 o   58.818   3.9965   70.077   9.1501   85.953   16.446   62.958   11.012   63.130   6.3162   54.507   4.8983 8.622242 7.992938 
1 1 1   23   25   11 o   30.071   5.3814   17.845   6.3562   30.081   11.733   12.763   7.5618   36.207   8.0640   23.935   7.1281 12.27122 10.76276 
1 1 1   23   25   12 o   58.644   3.5367   74.185   8.3359   67.161   12.963   79.137   10.885   56.019   5.6107   61.269   4.3074 -5.249695 7.073438 
1 1 1   23   25   13 o   54.120   3.9051   65.284   8.3143   50.291   12.800   76.226   10.935   48.162   6.4440   60.078   4.4131 -11.91603 7.810263 
1 1 1   23   25   14 o   22.692   5.6456   9.7742   6.0991   13.677   11.281   8.1624   7.2500   25.258   8.8111   20.126   7.0610 5.131956 11.29127 
1 1 1   23   25   15 o   28.567   5.5112   18.678   6.3061   18.809   11.606   18.623   7.5118   28.447   8.9023   28.688   6.4992 -0.2411919 11.02231 
1 1 1   23   25   16 o   62.310   4.1376   92.046   8.5940   69.570   17.267   99.447   9.9084   55.797   7.5029   68.823   3.4906 -13.02623 8.275182 
1 1 1   23   25   17 o   81.617   3.4868  150.320   10.172  125.678   19.180  159.963   11.998   75.904   6.1266   87.330   3.3310 -11.42606 6.973580 
1 1 1   23   25   18 o   36.874   6.2399   33.243   9.1173   29.592   15.422   35.204   11.304   34.538   10.153   39.210   7.2572 -4.671825 12.47985 
1 1 1   23   25   19 o   27.807   6.0734   17.604   7.6462   23.324   11.951   13.640   9.9492   31.042   8.8838   24.571   8.2838 6.471115 12.14675 
1 1 1   23   25   20 f   56.859   3.8069   69.911   8.8932   74.948   13.307   65.846   11.955   58.633   5.5028   55.085   5.2619 3.548042 7.613706 
1 1 1   23   25   21 o   22.400   6.1259   4.9132   8.8462  -5.9597   11.668   19.614   13.567   16.340   7.5193   28.460   9.6729 -12.12006 12.25177 
1 1 1   23   25   22 o   37.259   6.0727   34.837   8.9197   28.508   15.680   37.865   10.845   33.280   10.337   41.238   6.3765 -7.958691 12.14532 
1 1 1   23   25   23 o   15.854   5.1376  -5.2151   7.3595  -1.3706   11.889  -7.6034   9.3706   17.857   7.9614   13.851   6.4956 4.006301 10.27511 
1 1 1   23   25   24 o   41.454   5.3011   39.665   8.7364   53.055   13.295   29.489   11.590   48.289   6.6755   34.618   8.2367 13.67071 10.60213 
1 1 1   23   25   25 o   91.643   3.1428  181.829   11.776  177.939   17.730  184.899   15.751   90.467   4.7517   92.820   4.1145 -2.352211 6.285499 
1 1 1   23   25   26 o   23.583   6.2525   12.678   8.1743   9.9430   13.647   14.208   10.208   22.857   9.2753   24.309   8.3871 -1.451555 12.50495 
1 1 1   23   25   27 o   54.408   4.2165   67.330   9.3897   65.100   13.985   69.160   12.670   53.238   6.3691   55.579   5.5272 -2.340614 8.433001 
1 1 1   23   25   28 o   44.734   5.3690   49.915   9.3410   39.648   13.963   58.234   12.568   38.994   8.8804   50.474   6.0369 -11.47991 10.73802 
1 1 1   23   26    0 o   67.734   2.7483   96.313   10.776   96.313   10.776   96.313   10.776   67.734   3.8867   67.734   3.8867 0.000000 0.000000 
1 1 1   23   26    1 o   43.834   3.8731   41.107   6.8118   40.099   10.890   41.755   8.7307   43.220   6.1091   44.447   4.7625 -1.227203 7.746126 
1 1 1   23   26    2 o   38.067   4.6661   33.594   6.7118   25.505   10.828   38.641   8.5533   33.399   7.9711   42.734   4.8528 -9.335522 9.332108 
1 1 1   23   26    3 o   73.733   2.8072  113.323   8.2223  116.957   13.686  111.271   10.286   74.486   4.4548   72.980   3.4171 1.506180 5.614440 
1 1 1   23   26    4 o   29.353   5.3191   19.067   6.2046   21.293   10.735   17.950   7.6031   30.433   8.3162   28.274   6.6341 2.158895 10.63820 
1 1 1   23   26    5 o   78.641   3.3075  129.151   9.5082  134.288   18.454  127.294   11.094   79.249   5.6459   78.032   3.4471 1.216705 6.615036 
1 1 1   23   26    6 o   55.638   4.4436   72.358   8.3758   56.267   16.633   77.825   9.6947   50.374   8.0054   60.901   3.8596 -10.52707 8.887251 
1 1 1   23   26    7 f   19.840   5.5165   4.1703   6.8116   10.943   10.444  -0.8431   8.9857   23.425   8.4480   16.256   7.0964 7.169170 11.03306 
1 1 1   23   26    8 o   40.210   5.2808   35.990   8.5048   28.323   11.659   44.710   12.434   35.042   8.2104   45.377   6.6436 -10.33521 10.56163 
1 1 1   23   26    9 o   77.448   3.9364  131.496   12.210  110.534   18.622  147.304   16.171   71.495   6.3151   83.401   4.7011 -11.90548 7.872741 
1 1 1   23   26   10 o   77.302   3.1147  129.469   9.6598  102.316   14.264  152.470   13.128   69.362   4.9861   85.241   3.7342 -15.87965 6.229391 
1 1 1   23   26   11 o  108.726   2.6815  249.659   11.949  234.961   17.581  262.279   16.290  105.601   4.0365  111.850   3.5312 -6.249367 5.363062 
1 1 1   23   26   12 o  107.884   2.9521  242.008   12.624  260.098   21.301  232.213   15.674  110.618   4.6688  105.150   3.6141 5.467529 5.904169 
1 1 1   23   26   13 o   37.100   4.9600   32.068   6.8621   27.650   11.982   34.224   8.3707   34.212   8.5233   39.988   5.0754 -5.775894 9.919955 
1 1 1   23   26   14 o   53.515   3.5651   60.404   7.3609   64.011   13.076   58.730   8.9061   54.331   5.8352   52.700   4.0974 1.630482 7.130124 
1 1 1   23   26   15 o   34.003   5.1401   26.653   6.5416   25.118   12.083   27.289   7.7805   32.402   8.8097   35.605   5.2983 -3.202637 10.28018 
1 1 1   23   26   16 o   46.994   4.8909   47.781   7.4404   52.813   16.458   46.488   8.3414   47.216   8.7743   46.772   4.3241 0.4441910 9.781879 
1 1 1   23   26   17 o   23.966   5.9912   12.238   6.4627   10.736   14.876   12.587   7.1751   24.487   9.7719   23.445   6.9345 1.041805 11.98240 
1 1 1   23   26   18 o   55.336   4.5627   69.558   9.7046   63.423   16.568   72.763   11.974   52.631   7.6326   58.041   5.0018 -5.410732 9.125479 
1 1 1   23   26   19 o   59.602   3.7563   76.955   9.1988   79.967   13.712   74.490   12.404   60.555   5.4901   58.648   5.1280 1.906712 7.512501 
1 1 1   23   26   20 o   25.495   6.0726   9.3280   9.0185  -5.6642   11.881   29.709   13.853   16.572   7.6117   34.418   9.4641 -17.84630 12.14520 
1 1 1   23   26   21 o   24.178   6.4976   12.043   8.5599   13.848   14.893   11.152   10.460   25.506   9.8969   22.850   8.4217 2.656000 12.99515 
1 1 1   23   26   22 o   86.395   3.5806  161.509   12.559  155.346   16.261  170.618   19.770   84.740   4.6527   88.051   5.4439 -3.311310 7.161287 
1 1 1   23   26   23 o   63.004   4.5216   87.455   11.480   79.121   14.513  101.391   18.766   59.507   5.9132   66.501   6.8421 -6.993721 9.043244 
1 1 1   23   26   24 o   43.439   6.0924   46.563   10.378   44.764   13.461   49.199   16.296   42.994   7.8814   43.884   9.2927 -0.8902359 12.18487 
1 1 1   23   26   25 o   32.362   6.2122   27.736   8.7530   20.580   13.256   33.268   11.655   28.039   9.5614   36.685   7.9337 -8.646883 12.42439 
1 1 1   23   26   26 f   16.794   5.3256  -2.5699   8.0565 -13.1220   12.923   4.1388   10.304   15.026   7.2110   18.562   7.8390 -3.535358 10.65127 
1 1 1   23   26   27 o   41.805   5.4923   41.653   9.1621   54.295   14.350   32.954   11.904   47.625   7.3057   35.986   8.2029 11.63905 10.98457 
1 1 1   23   27    0 o  108.850   2.8443  247.734   18.003  247.734   18.003  247.734   18.003  108.850   4.0224  108.850   4.0224 0.000000 0.000000 
1 1 1   23   27    1 o   67.069   3.2297   97.568   8.4361   87.009   14.056  103.513   10.547   63.855   5.3371   70.283   3.6384 -6.428005 6.459318 
1 1 1   23   27    2 o   43.348   3.8975   40.300   6.5992   39.830   11.247   40.547   8.1496   42.897   6.3567   43.798   4.5114 -0.9011459 7.794920 
1 1 1   23   27    3 o   85.517   2.6044  151.413   8.9137  161.262   14.672  145.650   11.222   87.541   4.0636   83.494   3.2588 4.046532 5.208883 
1 1 1   23   27    4 o   44.045   3.8542   40.778   6.7099   44.019   11.396   39.059   8.3014   45.155   6.1190   42.934   4.6879 2.221340 7.708384 
1 1 1   23   27    5 f   74.208   2.7920  113.710   8.2496  123.874   13.815  108.078   10.285   76.573   4.3743   71.843   3.4709 4.730278 5.584041 
1 1 1   23   27    6 o   24.010   5.7452   12.511   6.7729   10.665   10.519   13.819   8.8521   23.185   8.4601   24.834   7.7754 -1.649538 11.49046 
1 1 1   23   27    7 o   21.283   5.3514   7.8430   6.7682  -3.3743   10.724   15.269   8.7255   16.683   7.4906   25.883   7.6447 -9.200373 10.70284 
1 1 1   23   27    8 o   72.792   4.0204  113.307   11.941  120.799   18.499  107.954   15.634   74.652   6.0080   70.933   5.3441 3.719559 8.040881 
1 1 1   23   27    9 o   20.671   5.8430   6.3302   7.5257  -5.1677   15.163   10.088   8.6687   19.332   8.7718   22.011   7.7211 -2.679581 11.68590 
1 1 1   23   27   10 o   27.133   5.6509   14.978   6.9203   26.328   11.371   8.3015   8.7213   33.450   8.2854   20.816   7.6866 12.63352 11.30185 
1 1 1   23   27   11 f   66.644   3.3498   94.973   9.0188   93.422   14.180   96.028   11.687   65.953   5.2128   67.335   4.2084 -1.381882 6.699507 
1 1 1   23   27   12 o   39.436   5.8912   35.641   8.4285   37.150   16.484   35.107   9.8076   38.699   10.188   40.174   5.9190 -1.475510 11.78249 
1 1 1   23   27   13 o   40.696   5.8989   38.852   8.7799   37.800   16.603   39.261   10.345   38.938   10.212   42.453   5.9080 -3.515163 11.79776 
1 1 1   23   27   14 o   28.624   4.7354   22.578   6.7163  -2.6397   12.407   33.030   7.9878   18.037   8.0809   39.211   4.9391 -21.17380 9.470773 
1 1 1   23   27   15 o   40.641   4.8199   38.569   6.8559   34.845   13.027   39.995   8.0628   38.052   8.5133   43.231   4.5220 -5.178646 9.639757 
1 1 1   23   27   16 o   44.987   5.4099   49.642   7.6134   42.006   16.604   51.675   8.5671   40.747   9.9631   49.227   4.2196 -8.479279 10.81979 
1 1 1   23   27   17 o   39.994   5.9746   39.181   8.9147   35.026   16.379   40.929   10.626   36.885   10.347   43.104   5.9772 -6.219627 11.94918 
1 1 1   23   27   18 o   51.211   5.2520   63.935   9.4691   51.152   16.891   69.794   11.435   45.557   9.3041   56.866   4.8755 -11.30914 10.50410 
1 1 1   23   27   19 o   61.737   3.6560   83.238   9.1857   81.156   14.056   84.791   12.136   60.774   5.6075   62.700   4.6928 -1.926018 7.312094 
1 1 1   23   27   20 o   50.687   4.9043   58.275   10.181   49.690   13.826   68.441   15.046   46.433   7.2197   54.941   6.6396 -8.508820 9.808587 
1 1 1   23   27   21 o  107.540   4.4545  289.279   15.951  203.679   30.924  320.309   18.619   92.412   8.1135  122.669   3.6801 -30.25690 8.909099 
1 1 1   23   27   22 o   26.164   5.8274   16.867   8.0716   3.5454   12.809   25.640   10.395   19.982   8.5984   32.345   7.8676 -12.36320 11.65471 
1 1 1   23   27   23 o   31.159   5.9334   25.638   8.4560   13.608   12.834   34.867   11.241   24.301   9.2489   38.018   7.4351 -13.71796 11.86690 
1 1 1   23   27   24 o   37.963   5.6073   36.334   8.6019   28.548   12.737   42.864   11.664   32.890   9.0877   43.035   6.5712 -10.14447 11.21456 
1 1 1   23   27   25 o   23.270   5.8477   11.399   8.3006  -2.6819   12.622   22.130   11.019   17.411   7.9398   29.129   8.5872 -11.71783 11.69533 
1 1 1   23   28    0 o   32.773   6.4603   27.730   10.684   27.730   10.684   27.730   10.684   32.773   9.1362   32.773   9.1362 0.000000 0.000000 
1 1 1   23   28    1 o   25.120   4.9167   10.035   6.8414   28.981   10.202  -5.4485   9.2227   35.632   7.1897   14.608   6.7086 21.02341 9.833465 
1 1 1   23   28    2 o   63.341   3.1491   88.834   7.6857   73.312   12.741   97.712   9.6362   58.434   5.2867   68.249   3.4233 -9.814468 6.298264 
1 1 1   23   28    3 f   61.951   3.2012   84.619   7.7195   70.732   12.591   92.984   9.7715   57.375   5.3206   66.527   3.5612 -9.151630 6.402401 
1 1 1   23   28    4 o   46.098   3.8053   46.566   6.7842   43.019   11.556   48.432   8.3805   44.373   6.3141   47.822   4.2489 -3.449005 7.610575 
1 1 1   23   28    5 o   90.531   2.6100  171.368   9.3792  176.635   15.631  168.404   11.725   91.372   4.1476   89.690   3.1695 1.681656 5.219989 
1 1 1   23   28    6 o   63.183   3.4000   85.829   8.7431   80.902   13.247   89.632   11.638   61.365   5.2340   65.000   4.3410 -3.634293 6.799923 
1 1 1   23   28    7 o   20.647   5.5998   7.0581   7.0102   0.3573   11.189   11.389   8.9946   18.338   7.9631   22.956   7.8754 -4.617804 11.19969 
1 1 1   23   28    8 o   69.594   4.1165  105.593   11.548  103.122   18.210  107.255   14.936   68.514   6.4441   70.674   5.1241 -2.159981 8.233037 
1 1 1   23   28    9 o   93.834   3.2206  188.151   12.374  192.566   16.662  182.721   18.477   95.267   4.2406   92.402   4.8482 2.864433 6.441124 
1 1 1   23   28   10 o   39.390   4.9153   31.857   7.4973   53.223   12.707   20.449   9.2856   49.220   6.2597   29.560   7.5801 19.66000 9.830666 
1 1 1   23   28   11 o   45.960   4.2520   45.557   7.8977   50.186   12.711   42.647   10.079   47.612   6.4728   44.308   5.5155 3.303783 8.504003 
1 1 1   23   28   12 o   68.621   3.4161  102.343   9.5032   94.588   14.487  108.201   12.591   66.012   5.3208   71.230   4.2858 -5.218155 6.832229 
1 1 1   23   28   13 o   69.587   3.4373  107.557   9.3999   91.694   15.090  117.615   12.016   64.735   5.6519   74.439   3.9137 -9.703896 6.874686 
1 1 1   23   28   14 o   55.532   3.9621   68.335   8.6495   63.875   14.280   70.920   10.870   53.561   6.4642   57.503   4.5835 -3.941570 7.924282 
1 1 1   23   28   15 o   55.453   3.9484   69.886   8.4757   57.718   13.846   77.178   10.719   50.805   6.6077   60.100   4.3241 -9.295074 7.896821 
1 1 1   23   28   16 o   60.497   4.4343   85.918   9.1905   72.177   18.250   90.586   10.638   55.735   7.9392   65.260   3.9522 -9.525570 8.868524 
1 1 1   23   28   17 o   43.872   5.7820   46.011   9.1076   45.395   17.202   46.251   10.736   41.939   10.071   45.806   5.6827 -3.866585 11.56405 
1 1 1   23   28   18 o   27.485   6.4366   19.320   8.7007   12.126   15.420   22.680   10.539   24.638   9.9078   30.332   8.2192 -5.694469 12.87326 
1 1 1   23   28   19 o   39.373   6.2376   38.746   9.9205   31.859   13.648   46.461   14.446   35.200   9.2716   43.546   8.3468 -8.345844 12.47530 
1 1 1   23   28   20 o   17.902   5.5350  -0.1419   8.1819 -14.3082   14.664   6.2615   9.8592   16.181   7.7430   19.623   7.9114 -3.442156 11.06995 
1 1 1   23   28   21 o   20.725   5.8909   7.6429   7.7805   3.6241   12.480   10.198   9.9511   19.714   8.4853   21.736   8.1739 -2.021036 11.78187 
1 1 1   23   28   22 o   53.318   5.1889   70.765   10.150   56.640   16.793   78.895   12.740   46.984   8.9935   59.652   5.1782 -12.66784 10.37771 
1 1 1   23   28   23 o   22.699   6.3986   9.0313   8.6934   18.657   14.981   4.1444   10.675   26.663   10.029   18.736   7.9493 7.927549 12.79714 
1 1 1   23   28   24 o   19.081   5.8393   3.1805   8.6050  -5.0572   14.743   7.4372   10.598   17.976   8.3356   20.186   8.1798 -2.209507 11.67865 
1 1 1   23   29    0 o   27.506   7.1739   21.995   10.660   21.995   10.660   21.995   10.660   27.506   10.145   27.506   10.145 0.000000 0.000000 
1 1 1   23   29    1 o   66.534   3.3383   94.355   9.0954   96.637   13.769   92.588   12.115   67.118   4.9740   65.950   4.4537 1.167938 6.676578 
1 1 1   23   29    2 o   33.943   5.4749   26.657   7.4693   30.275   11.237   23.795   9.9974   36.001   7.7939   31.885   7.6911 4.115997 10.94979 
1 1 1   23   29    3 o  125.697   2.3913  333.176   12.276  322.840   18.537  341.250   16.383  123.776   3.6311  127.618   3.1125 -3.842201 4.782510 
1 1 1   23   29    4 o   50.332   3.7842   58.400   7.1329   44.281   12.042   66.033   8.8532   44.766   6.5219   55.898   3.8401 -11.13211 7.568468 
1 1 1   23   29    5 o   70.730   3.1466  105.968   9.1251  113.002   13.825  100.538   12.147   72.711   4.6099   68.749   4.2840 3.962021 6.293142 
1 1 1   23   29    6 o   59.844   3.5356   77.460   8.5794   75.036   13.271   79.199   11.245   58.785   5.4738   60.903   4.4767 -2.117916 7.071290 
1 1 1   23   29    7 o   85.796   3.8572  161.757   13.203  152.443   21.153  167.700   16.898   83.133   6.1692   88.459   4.6317 -5.325989 7.714377 
1 1 1   23   29    8 f   32.571   6.4754   21.078   9.4724   45.628   16.541   9.0974   11.555   42.861   9.5957   22.281   8.6975 20.57988 12.95082 
1 1 1   23   29    9 o   29.029   5.8852   18.977   7.3582   27.421   12.003   13.893   9.3136   33.544   8.6270   24.515   8.0073 9.028509 11.77038 
1 1 1   23   29   10 f   30.644   5.8166   22.777   7.4035   21.423   12.038   23.600   9.3890   29.588   9.0352   31.701   7.3277 -2.112679 11.63318 
1 1 1   23   29   11 o   15.027   4.8840  -4.6614   6.5724  -4.8389   11.258  -4.5696   8.0953   16.361   7.4755   13.694   6.2873 2.667222 9.767991 
1 1 1   23   29   12 o   49.286   4.2473   51.852   8.3999   61.340   13.946   46.450   10.523   52.463   6.4451   46.108   5.5334 6.354832 8.494568 
1 1 1   23   29   13 o   23.138   5.7800   12.036   7.1474   4.5620   12.584   15.595   8.6841   20.595   8.6785   25.680   7.6367 -5.085243 11.56006 
1 1 1   23   29   14 o   62.998   3.5064   85.760   8.8358   87.510   14.390   84.701   11.195   63.136   5.5261   62.861   4.3178 0.2747993 7.012892 
1 1 1   23   29   15 o   27.619   6.0232   18.938   7.5225   16.757   12.165   20.289   9.5721   26.332   9.1516   28.906   7.8335 -2.574352 12.04637 
1 1 1   23   29   16 o  111.654   3.0229  267.297   13.841  230.568   19.048  308.390   20.148  103.338   4.4691  119.970   4.0718 -16.63219 6.045832 
1 1 1   23   29   17 o   49.821   5.3786   60.579   9.7472   52.749   16.958   64.442   11.911   45.561   9.3381   54.081   5.3401 -8.520885 10.75717 
1 1 1   23   29   18 o   44.875   5.7638   53.703   9.2755   36.162   16.219   62.227   11.307   36.542   10.312   53.207   5.1524 -16.66511 11.52759 
1 1 1   23   29   19 o   22.221   6.3355   9.4537   8.9464   10.189   12.560   8.6966   12.746   22.530   8.9828   21.913   8.9366 0.6176701 12.67093 
1 1 1   23   29   20 o   64.112   5.1035  109.472   10.893   59.960   17.784  139.198   13.780   48.003   9.3186   80.221   4.1648 -32.21815 10.20695 
1 1 1   23   29   21 o   81.567   3.3081  148.846   10.812  112.804   15.515  182.873   15.075   71.081   5.2923   92.052   3.9707 -20.97115 6.616248 
1 1 1   23   29   22 o   43.893   5.2439   47.836   8.9549   36.982   13.218   57.044   12.175   37.757   8.6706   50.029   5.9003 -12.27243 10.48777 
1 1 1   23   30    0 o   18.215   6.8347   10.940   9.7799   10.940   9.7799   10.940   9.7799   18.215   9.6657   18.215   9.6657 0.000000 0.000000 
1 1 1   23   30    1 o   67.677   3.3652  100.077   9.2278   85.614   13.653  112.239   12.520   62.784   5.2726   72.569   4.1830 -9.784950 6.730358 
1 1 1   23   30    2 o   37.112   5.1497   31.362   7.6992   47.201   11.576   18.797   10.310   46.241   6.0697   27.984   8.3208 18.25720 10.29938 
1 1 1   23   30    3 o   57.937   3.7705   73.838   8.8629   66.651   13.344   79.511   11.856   55.065   5.8755   60.810   4.7270 -5.744965 7.540927 
1 1 1   23   30    4 o   78.492   2.9901  131.356   9.6666  131.933   14.054  130.839   13.317   78.589   4.3359   78.395   4.1186 0.1938858 5.980206 
1 1 1   23   30    5 o   55.253   3.7432   66.320   8.4364   66.336   12.897   66.308   11.154   55.046   5.6807   55.459   4.8762 -0.4132271 7.486458 
1 1 1   23   30    6 o   54.338   3.8476   63.829   8.4592   67.043   13.443   61.722   10.884   55.202   5.9045   53.474   4.9351 1.728458 7.695294 
1 1 1   23   30    7 o   27.192   6.6984   17.856   9.5275   9.3120   16.551   22.091   11.652   24.339   10.081   30.045   8.8227 -5.706013 13.39686 
1 1 1   23   30    8 o   28.473   6.2971   19.583   8.3053   23.617   11.933   15.792   11.567   30.971   8.8813   25.976   8.9297 4.995012 12.59429 
1 1 1   23   30    9 o   72.699   3.0302  112.709   8.5350  113.987   14.871  112.081   10.423   72.557   4.9693   72.841   3.4692 -0.2842407 6.060473 
1 1 1   23   30   10 o   19.142   5.4394   0.9818   6.1461   14.714   12.159  -3.7309   7.1231   25.308   9.1169   12.976   5.9356 12.33148 10.87886 
1 1 1   23   30   11 o   75.153   3.1013  122.414   8.9866  118.132   15.594  124.543   10.996   73.598   5.1373   76.709   3.4756 -3.111122 6.202551 
1 1 1   23   30   12 o   41.493   4.6409   38.809   7.0900   40.869   12.890   37.916   8.4897   41.251   7.8631   41.735   4.9320 -0.4841309 9.281875 
1 1 1   23   30   13 o   84.093   2.8685  150.889   9.3771  153.332   16.249  149.669   11.482   84.075   4.6860   84.110   3.3097 -0.3566742E-01 5.736996 
1 1 1   23   30   14 o   43.654   4.6140   44.088   7.2149   42.508   13.329   44.742   8.5807   41.855   8.0128   45.452   4.5772 -3.596756 9.228028 
1 1 1   23   30   15 o   19.984   5.2723   5.2495   7.3016 -13.6407   12.272   15.601   9.0845   14.625   7.0208   25.342   7.8674 -10.71699 10.54458 
1 1 1   23   30   16 o   44.168   5.8214   49.165   10.120   62.735   13.981   34.226   14.669   52.407   6.4681   35.929   9.6808 16.47754 11.64277 
1 1 1   23   30   17 o   35.974   6.9641   35.282   10.759   30.000   15.545   40.139   14.906   32.864   10.306   39.083   9.3691 -6.218639 13.92817 
1 1 1   23   30   18 o   28.469   7.0149   22.063   10.448   15.638   15.795   27.062   13.931   25.474   10.099   31.464   9.7383 -5.989923 14.02973 
1 1 1   23   30   19 o   56.390   7.0180   97.689   13.603   54.366   24.311  117.435   16.412   40.505   12.911   72.274   5.5058 -31.76888 14.03606 
1 1 1   23   30   20 o   26.163   6.2534   18.027   8.2826   12.586   13.023   21.722   10.733   23.433   9.2084   28.894   8.4631 -5.460474 12.50672 
1 1 1   23   31    0 o   46.468   4.1976   48.142   10.870   48.142   10.870   48.142   10.870   46.468   5.9363   46.468   5.9363 0.000000 0.000000 
1 1 1   23   31    1 o   46.352   4.3435   47.082   8.1642   60.277   12.270   36.597   10.937   52.342   5.6834   40.362   6.5698 11.98025 8.686955 
1 1 1   23   31    2 o   21.919   5.8434   9.1632   7.2916   13.517   10.819   5.5400   9.8697   24.363   8.6186   19.475   7.8931 4.887869 11.68677 
1 1 1   23   31    3 o   48.612   4.2560   52.460   8.4548   52.305   12.810   52.580   11.254   48.306   6.4295   48.919   5.5780 -0.6129837 8.511927 
1 1 1   23   31    4 o   63.417   3.5285   86.363   9.1600   95.366   14.039   79.688   12.087   66.162   5.1446   60.672   4.8304 5.490253 7.056910 
1 1 1   23   31    5 o   24.408   6.0489   13.033   7.5416   18.395   11.666   9.1839   9.8846   27.391   8.9626   21.425   8.1259 5.966751 12.09784 
1 1 1   23   31    6 o   52.737   5.2308   65.602   9.8174   62.148   18.153   67.030   11.672   50.044   9.1314   55.430   5.1053 -5.385197 10.46169 
1 1 1   23   31    7 o   26.347   6.8205   16.554   9.4743   14.703   16.415   17.479   11.602   25.988   10.298   26.706   8.9457 -0.7177505 13.64104 
1 1 1   23   31    8 o   35.441   4.9776   27.029   6.6850   38.942   11.961   21.617   8.0616   40.500   7.4346   30.381   6.6206 10.11868 9.955184 
1 1 1   23   31    9 o   26.888   5.2595   19.363   6.5343   6.8702   12.092   24.514   7.7657   21.051   8.6583   32.725   5.9737 -11.67417 10.51905 
1 1 1   23   31   10 o   61.775   3.4973   84.891   8.1950   78.761   14.444   87.801   9.9516   59.376   5.8982   64.173   3.7599 -4.796925 6.994676 
1 1 1   23   31   11 o   44.459   4.2628   41.545   7.3217   52.827   13.409   36.753   8.7396   48.012   6.7713   40.905   5.1802 7.107098 8.525522 
1 1 1   23   31   12 o   54.933   3.6501   64.604   7.7357   71.532   13.848   61.462   9.3268   56.455   5.9471   53.410   4.2339 3.044682 7.300271 
1 1 1   23   31   13 o   39.585   5.0446   37.397   7.0873   35.970   13.469   37.943   8.3345   37.535   8.8449   41.634   4.8537 -4.098125 10.08913 
1 1 1   23   31   14 o   38.932   5.1402   38.919   7.2130   29.272   12.921   43.286   8.6937   33.397   9.1223   44.467   4.7402 -11.07063 10.28039 
1 1 1   23   31   15 o   51.934   4.0694   62.870   7.8153   55.386   14.047   66.225   9.4054   48.524   7.0187   55.343   4.1205 -6.819019 8.138803 
1 1 1   23   31   16 o   51.663   5.3368   61.962   10.371   36.916   13.474   98.371   16.245   37.655   8.8289   65.670   5.9978 -28.01458 10.67350 
1 1 1   23   31   17 o   66.097   4.6651  102.077   12.681   98.013   18.333  105.805   17.560   64.482   6.8934   67.711   6.2877 -3.229652 9.330284 
1 1 1   23   32    0 o   23.880   7.2746   18.340   10.407   18.340   10.407   18.340   10.407   23.880   10.288   23.880   10.288 0.000000 0.000000 
1 1 1   23   32    1 o   48.227   4.1624   51.993   8.2504   57.011   11.724   47.071   11.612   50.707   5.6059   45.748   6.1544 4.958965 8.324876 
1 1 1   23   32    2 o   23.463   6.0296   12.498   7.5051   12.504   11.416   12.493   9.9604   23.622   8.7799   23.304   8.2666 0.3180943 12.05918 
1 1 1   23   32    3 o   43.584   5.0512   45.669   8.5149   36.610   12.934   52.599   11.312   38.486   8.3856   48.683   5.6338 -10.19681 10.10233 
1 1 1   23   32    4 o   33.060   5.4865   28.976   8.3426   10.009   13.047   42.094   10.850   22.827   9.1369   43.294   6.0765 -20.46729 10.97302 
1 1 1   23   32    5 o   53.027   3.9472   61.971   8.5692   65.696   13.063   59.157   11.353   54.241   5.8393   51.813   5.3126 2.427830 7.894352 
1 1 1   23   32    6 o   24.643   6.3296   14.642   8.3773   5.8538   16.530   17.679   9.7176   22.502   9.7250   26.785   8.1042 -4.282354 12.65913 
1 1 1   23   32    7 o   58.745   3.9784   77.129   9.5611   80.104   12.922   73.530   14.212   60.321   5.1941   57.169   6.0276 3.151798 7.956777 
1 1 1   23   32    8 o   26.531   5.9998   14.959   6.4964   24.377   13.644   12.197   7.3875   30.365   9.6719   22.697   7.1026 7.668224 11.99969 
1 1 1   23   32    9 o   23.513   5.6973   12.942   6.3135   13.339   11.644   12.777   7.5139   23.906   8.8709   23.120   7.1514 0.7860260 11.39453 
1 1 1   23   32   10 o   57.559   3.4834   71.249   7.8055   77.921   13.695   68.039   9.4994   58.959   5.6319   56.160   4.1012 2.799850 6.966892 
1 1 1   23   32   11 o   33.359   5.4138   25.875   6.8683   32.724   12.427   22.862   8.2415   35.756   8.5434   30.962   6.6520 4.793831 10.82769 
1 1 1   23   32   12 o   41.340   5.0541   44.643   7.4372   30.713   12.902   51.575   9.1015   34.107   9.0296   48.573   4.5431 -14.46549 10.10810 
1 1 1   23   32   13 o   32.342   5.8729   28.448   8.1047   19.463   13.194   33.891   10.271   27.074   9.5241   37.611   6.8743 -10.53609 11.74581 
1 1 1   23   32   14 o   19.697   5.9576   3.8771   7.8593   9.8632   14.650   1.4582   9.3128   22.687   9.4483   16.706   7.2596 5.981146 11.91520 
1 1 1   23   33    0 o   25.975   7.3458   21.196   10.793   21.196   10.793   21.196   10.793   25.975   10.389   25.975   10.389 0.000000 0.000000 
1 1 1   23   33    1 o   27.927   5.7112   19.245   7.5619   9.6353   10.619   29.131   10.771   21.531   8.3563   34.323   7.7873 -12.79169 11.42240 
1 1 1   23   33    2 o   31.077   5.9966   24.370   7.8794   28.566   11.919   21.114   10.501   33.359   8.6061   28.795   8.3531 4.563694 11.99327 
1 1 1   23   33    3 o   33.735   5.9577   29.492   8.2192   26.259   13.070   31.607   10.571   31.381   9.3771   36.088   7.3518 -4.707458 11.91549 
1 1 1   23   33    4 o   29.517   5.9805   18.377   8.1504   38.976   13.881   7.5380   10.069   38.876   8.8549   20.158   8.0410 18.71754 11.96104 
1 1 1   23   33    5 o   22.641   6.4170   8.3825   8.1417   18.550   16.096   4.8868   9.4382   26.817   10.321   18.464   7.6276 8.353523 12.83400 
1 1 1   23   33    6 o   27.778   5.5619   21.253   8.2889  -0.5646   14.546   31.745   10.087   19.195   8.6615   36.361   6.9798 -17.16648 11.12379 
1 1 1   23   33    7 o   16.652   5.2891  -1.6316   7.5996  -4.3832   10.486   1.4125   11.029   15.461   7.1197   17.843   7.8237 -2.382021 10.57824 
1 1 1   23   33    8 o   36.549   5.3198   32.895   7.7111   32.694   11.563   33.056   10.348   36.073   7.9827   37.024   7.0340 -0.9507294 10.63952 
1 1 1   23   33    9 o   18.615   5.6079   3.9343   7.2968   4.4770   12.307   3.6401   9.0614   19.679   8.4470   17.551   7.3785 2.127323 11.21577 
1 1 1   23   33   10 o   28.980   5.8416   23.637   8.1053   9.9966   14.146   30.303   9.8896   22.585   9.3347   35.376   7.0258 -12.79161 11.68325 
1 1 1   23   33   11 o   27.856   6.2435   21.248   8.3802   13.869   14.322   25.090   10.334   24.277   9.6196   31.435   7.9617 -7.157742 12.48705 
1 1 1   23   34    0 o   14.193   6.2085   4.7841   10.169   4.7841   10.169   4.7841   10.169   14.193   8.7801   14.193   8.7801 0.000000 0.000000 
1 1 1   23   34    1 o   25.995   6.0297   17.368   7.5591   14.288   10.809   20.317   10.576   24.019   8.6017   27.972   8.4524 -3.952606 12.05950 
1 1 1   23   34    2 o   76.926   4.5327  150.382   12.283  101.970   21.483  173.892   14.971   64.221   8.1106   89.632   4.0497 -25.41101 9.065367 
1 1 1   23   34    3 o   43.121   5.2500   44.922   8.8359   45.727   14.257   44.420   11.259   42.328   8.4622   43.914   6.2162 -1.586910 10.49999 
1 1 1   23   34    4 o   78.459   4.4203  141.985   12.220  140.816   24.324  142.379   14.133   75.995   7.7605   80.924   4.2344 -4.928688 8.840589 
1 1 1   24    0    0 o  179.723   3.1193  667.837   32.655  667.837   32.655  667.837   32.655  179.723   4.4114  179.723   4.4114 0.000000 0.000000 
1 1 1   24    0    1 o   55.903   3.0527   65.689   9.8174   65.689   9.8174   65.689   9.8174   55.903   4.3171   55.903   4.3171 0.000000 0.000000 
1 1 1   24    0    2 o  130.794   2.1798  353.648   16.609  353.648   16.609  353.648   16.609  130.794   3.0826  130.794   3.0826 0.000000 0.000000 
1 1 1   24    0    3 f  116.169   2.2319  279.145   15.098  279.145   15.098  279.145   15.098  116.169   3.1564  116.169   3.1564 0.000000 0.000000 
1 1 1   24    0    4 o  211.307   2.2762  922.219   28.040  922.219   28.040  922.219   28.040  211.307   3.2191  211.307   3.2191 0.000000 0.000000 
1 1 1   24    0    5 o  180.698   2.2051  674.490   23.225  674.490   23.225  674.490   23.225  180.698   3.1184  180.698   3.1184 0.000000 0.000000 
1 1 1   24    0    6 o  230.589   2.3438  1098.19   31.510  1098.19   31.510  1098.19   31.510  230.589   3.3147  230.589   3.3147 0.000000 0.000000 
1 1 1   24    0    7 o  240.856   2.3798  1198.18   33.418  1198.18   33.418  1198.18   33.418  240.856   3.3655  240.856   3.3655 0.000000 0.000000 
1 1 1   24    0    8 f   67.199   2.7533   94.181   10.709   94.181   10.709   94.181   10.709   67.199   3.8938   67.199   3.8938 0.000000 0.000000 
1 1 1   24    0    9 o   42.860   4.0219   39.938   9.5601   39.938   9.5601   39.938   9.5601   42.860   5.6878   42.860   5.6878 0.000000 0.000000 
1 1 1   24    0   10 o   62.594   2.9157   81.969   10.539   81.969   10.539   81.969   10.539   62.594   4.1234   62.594   4.1234 0.000000 0.000000 
1 1 1   24    0   11 o   57.542   3.7883   70.217   12.461   70.217   12.461   70.217   12.461   57.542   5.3574   57.542   5.3574 0.000000 0.000000 
1 1 1   24    0   12 o   15.895   6.5905   6.1417   10.277   6.1417   10.277   6.1417   10.277   15.895   9.3204   15.895   9.3204 0.000000 0.000000 
1 1 1   24    0   13 o   25.309   7.6662   18.967   11.569   18.967   11.569   18.967   11.569   25.309   10.842   25.309   10.842 0.000000 0.000000 
1 1 1   24    0   14 o   34.883   5.7774   29.001   10.216   29.001   10.216   29.001   10.216   34.883   8.1705   34.883   8.1705 0.000000 0.000000 
1 1 1   24    0   15 o   21.293   6.7001   13.599   8.8126   13.599   8.8126   13.599   8.8126   21.293   9.4753   21.293   9.4753 0.000000 0.000000 
1 1 1   24    0   16 o  250.398   2.7778  1296.59   40.548  1296.59   40.548  1296.59   40.548  250.398   3.9283  250.398   3.9283 0.000000 0.000000 
1 1 1   24    0   17 o  171.014   2.2408  604.609   22.335  604.609   22.335  604.609   22.335  171.014   3.1690  171.014   3.1690 0.000000 0.000000 
1 1 1   24    0   18 o   69.686   3.4789  101.989   13.979  101.989   13.979  101.989   13.979   69.686   4.9200   69.686   4.9200 0.000000 0.000000 
1 1 1   24    0   19 o   82.756   3.1934  142.987   15.310  142.987   15.310  142.987   15.310   82.756   4.5162   82.756   4.5162 0.000000 0.000000 
1 1 1   24    0   20 o   49.639   5.5825   55.080   14.939   55.080   14.939   55.080   14.939   49.639   7.8949   49.639   7.8949 0.000000 0.000000 
1 1 1   24    0   21 o   94.385   2.8167  185.348   15.444  185.348   15.444  185.348   15.444   94.385   3.9834   94.385   3.9834 0.000000 0.000000 
1 1 1   24    0   22 f   72.578   3.2395  110.498   13.589  110.498   13.589  110.498   13.589   72.578   4.5814   72.578   4.5814 0.000000 0.000000 
1 1 1   24    0   23 o   88.999   3.0122  165.317   15.555  165.317   15.555  165.317   15.555   88.999   4.2599   88.999   4.2599 0.000000 0.000000 
1 1 1   24    0   24 o   13.661   6.0762   2.1213   10.167   2.1213   10.167   2.1213   10.167   13.661   8.5930   13.661   8.5930 0.000000 0.000000 
1 1 1   24    0   25 o   12.506   5.7699  -0.7882   10.280  -0.7882   10.280  -0.7882   10.280   12.506   8.1599   12.506   8.1599 0.000000 0.000000 
1 1 1   24    0   26 o   45.326   4.8524   45.879   11.958   45.879   11.958   45.879   11.958   45.326   6.8623   45.326   6.8623 0.000000 0.000000 
1 1 1   24    0   27 o   56.499   6.1905   72.222   18.942   72.222   18.942   72.222   18.942   56.499   8.7547   56.499   8.7547 0.000000 0.000000 
1 1 1   24    0   28 o   37.350   6.6667   34.534   12.560   34.534   12.560   34.534   12.560   37.350   9.4282   37.350   9.4282 0.000000 0.000000 
1 1 1   24    0   29 o   61.832   3.7478   81.559   13.288   81.559   13.288   81.559   13.288   61.832   5.3002   61.832   5.3002 0.000000 0.000000 
1 1 1   24    0   30 o   14.093   6.5088  -0.6038   13.131  -0.6038   13.131  -0.6038   13.131   14.093   9.2048   14.093   9.2048 0.000000 0.000000 
1 1 1   24    0   31 o   31.557   8.6091   29.526   15.030   29.526   15.030   29.526   15.030   31.557   12.175   31.557   12.175 0.000000 0.000000 
1 1 1   24    0   32 o   16.838   6.9825   7.7186   11.539   7.7186   11.539   7.7186   11.539   16.838   9.8747   16.838   9.8747 0.000000 0.000000 
1 1 1   24    0   33 o   7.6390   3.9471 -25.4739   10.789 -25.4739   10.789 -25.4739   10.789   7.6390   5.5820   7.6390   5.5820 0.000000 0.000000 
1 1 1   24    0   34 o   80.281   3.3377  136.504   15.505  136.504   15.505  136.504   15.505   80.281   4.7202   80.281   4.7202 0.000000 0.000000 
1 1 1   24    0   35 o   52.077   4.5275   60.195   13.195   60.195   13.195   60.195   13.195   52.077   6.4028   52.077   6.4028 0.000000 0.000000 
1 1 1   24    0   36 o   27.130   9.6834   26.453   18.983   26.453   18.983   26.453   18.983   27.130   13.694   27.130   13.694 0.000000 0.000000 
1 1 1   24    0   37 o   15.699   7.6630 -11.9124   23.566 -11.9124   23.566 -11.9124   23.566   15.699   10.837   15.699   10.837 0.000000 0.000000 
1 1 1   24    0   38 o   24.427   10.319   22.150   26.055   22.150   26.055   22.150   26.055   24.427   14.594   24.427   14.594 0.000000 0.000000 
1 1 1   24    1    0 o  237.575   2.3612  1165.70   32.705  1165.70   32.705  1165.70   32.705  237.575   3.3392  237.575   3.3392 0.000000 0.000000 
1 1 1   24    1    1 o  229.851   2.3346  1091.44   22.132  1089.96   31.290  1092.92   31.308  229.695   3.3028  230.007   3.3003 -0.3124237 4.669114 
1 1 1   24    1    2 o  242.671   2.3828  1216.66   23.849  1221.07   33.826  1212.29   33.629  243.108   3.3736  242.233   3.3660 0.8743744 4.765606 
1 1 1   24    1    3 o  212.288   2.2800  930.897   19.962  936.532   28.379  925.378   28.085  212.923   3.2316  211.653   3.2173 1.270096 4.560040 
1 1 1   24    1    4 o  215.629   2.2870  959.870   20.332  938.228   28.280  983.026   29.251  213.117   3.2173  218.141   3.2512 -5.024643 4.573987 
1 1 1   24    1    5 o   99.591   2.3115  204.975   9.4906  211.011   13.388  198.877   13.455  101.068   3.2118   98.113   3.3251 2.954941 4.622937 
1 1 1   24    1    6 o  210.501   2.2823  915.304   19.814  922.895   28.181  907.883   27.865  211.363   3.2326  209.639   3.2227 1.724945 4.564630 
1 1 1   24    1    7 o  127.996   2.1831  338.327   11.523  330.711   16.170  346.184   16.425  126.532   3.0984  129.460   3.0762 -2.927696 4.366168 
1 1 1   24    1    8 o  122.174   2.2045  308.233   11.105  318.599   15.857  298.255   15.558  124.190   3.0958  120.157   3.1394 4.033127 4.409010 
1 1 1   24    1    9 o  157.103   2.1688  509.857   14.053  512.754   19.864  506.955   19.884  157.551   3.0569  156.656   3.0775 0.8952179 4.337699 
1 1 1   24    1   10 o  121.037   2.2245  302.649   11.104  303.750   15.814  301.579   15.596  121.253   3.1621  120.821   3.1297 0.4319153 4.449069 
1 1 1   24    1   11 o  137.703   2.2008  391.742   12.499  392.996   17.736  390.504   17.618  137.922   3.1178  137.484   3.1070 0.4372711 4.401630 
1 1 1   24    1   12 o   45.620   4.2599   43.260   8.0081   44.408   11.190   42.054   11.466   46.250   5.8660   44.991   6.1789 1.259094 8.519889 
1 1 1   24    1   13 o  181.920   3.0922  685.261   23.201  681.484   32.871  689.011   32.752  181.417   4.3931  182.423   4.3530 -1.005875 6.184475 
1 1 1   24    1   14 o  234.192   2.5538  1134.66   24.487  1132.29   36.905  1136.53   32.730  233.930   3.8251  234.453   3.3848 -0.5227814 5.107598 
1 1 1   24    1   15 o  214.799   2.3242  953.980   20.591  949.499   29.069  958.492   29.170  214.292   3.2890  215.305   3.2849 -1.013092 4.648446 
1 1 1   24    1   16 o  156.117   2.3560  502.511   15.042  516.076   22.937  492.274   19.926  157.933   3.5212  154.301   3.1310 3.631912 4.711930 
1 1 1   24    1   17 o   66.895   2.8434   92.864   7.8179   83.524   11.005  102.381   11.108   63.480   4.2033   70.311   3.8305 -6.831532 5.686842 
1 1 1   24    1   18 o   28.210   5.4759   14.936   6.7649   27.225   11.170   7.8188   8.5012   35.334   7.8669   21.086   7.6192 14.24802 10.95176 
1 1 1   24    1   19 o   78.833   3.5575  127.456   11.310  137.883   18.292  121.003   14.390   81.345   5.4521   76.321   4.5716 5.024727 7.115085 
1 1 1   24    1   20 f  141.167   3.1873  413.614   18.492  423.726   27.468  405.231   25.008  142.699   4.6670  139.634   4.3423 3.065125 6.374666 
1 1 1   24    1   21 o   49.282   4.3448   50.921   8.7718   43.416   12.162   59.059   12.664   45.451   6.4878   53.113   5.7809 -7.662315 8.689691 
1 1 1   24    1   22 o  243.706   2.7427  1234.51   27.456  1236.14   37.210  1232.56   40.681  243.968   3.6979  243.443   4.0516 0.5259247 5.485442 
1 1 1   24    1   23 o  110.246   2.7233  252.590   12.377  260.664   17.827  245.077   17.198  111.943   3.8612  108.549   3.8413 3.393753 5.446517 
1 1 1   24    1   24 o   96.274   2.8732  192.969   11.406  194.410   16.358  191.605   15.911   96.614   4.1051   95.934   4.0212 0.6803055 5.746482 
1 1 1   24    1   25 o   29.781   6.0448   19.640   7.8844   16.277   11.117   23.043   11.184   27.481   8.7279   32.080   8.3657 -4.599257 12.08967 
1 1 1   24    1   26 o   24.431   6.3918   10.503   8.3699   8.6670   10.694   13.407   13.447   22.506   8.4715   26.356   9.5736 -3.849474 12.78359 
1 1 1   24    1   27 o   52.674   7.0810   63.824   14.575   66.835   18.638   59.084   23.383   55.403   8.1564   49.945   11.577 5.458443 14.16191 
1 1 1   24    1   28 o   84.614   3.2886  150.138   11.438  153.101   16.955  147.663   15.495   85.323   4.8179   83.905   4.4775 1.417877 6.577292 
1 1 1   24    1   29 o   53.870   4.1868   61.963   9.1375   77.284   13.224   47.964   12.641   60.429   5.3057   47.310   6.4782 13.11954 8.373577 
1 1 1   24    1   30 o   18.194   5.5731  -0.5859   7.7541   2.2656   11.206  -3.2056   10.741   19.465   8.1952   16.924   7.5548 2.540653 11.14613 
1 1 1   24    1   31 o   31.144   6.6167   21.854   9.0580   26.155   14.330   18.992   11.689   33.394   9.7783   28.894   8.9168 4.500202 13.23345 
1 1 1   24    1   32 o   30.489   6.6753   21.550   9.2024   21.831   12.128   21.170   14.128   30.655   9.0013   30.323   9.8599 0.3319759 13.35070 
1 1 1   24    1   33 o   43.802   6.4293   55.582   11.288   72.484   13.575   17.718   20.318   58.006   5.6742   29.598   11.539 28.40793 12.85858 
1 1 1   24    1   34 o   23.588   6.3249   10.104   8.4919   14.551   12.828   6.6345   11.330   25.960   9.3626   21.216   8.5065 4.743517 12.64985 
1 1 1   24    1   35 o   37.515   6.0867   34.003   9.3153   41.574   13.080   26.212   13.270   42.297   7.7846   32.733   9.3590 9.563534 12.17337 
1 1 1   24    1   36 f   46.238   8.1568   58.195   15.580   64.337   20.456   49.709   24.044   50.565   10.161   41.911   12.763 8.654968 16.31356 
1 1 1   24    1   37 o   52.920   8.1271   74.395   17.236   70.462   24.451   78.280   24.301   51.109   11.833   54.731   11.144 -3.622150 16.25429 
1 1 1   24    1   38 o   27.848   8.2212   14.688   16.368   2.1143   23.398   26.736   22.905   24.273   10.966   31.424   12.251 -7.150330 16.44235 
1 1 1   24    1   39 o   34.308   13.443   36.720   27.684   0.0000   0.0000   36.720   27.684  ?   ?    34.308   13.443      ?      ? 
1 1 1   24    2    0 o  269.219   2.4915  1496.96   39.110  1496.96   39.110  1496.96   39.110  269.219   3.5236  269.219   3.5236 0.000000 0.000000 
1 1 1   24    2    1 o  178.606   2.1989  658.894   16.198  658.602   22.950  659.184   22.865  178.566   3.1162  178.646   3.1032 -0.8013916E-01 4.397763 
1 1 1   24    2    2 o   40.528   3.9127   34.170   6.5146   36.189   9.0109   31.959   9.4296   41.798   5.2270   39.258   5.8238 2.540051 7.825442 
1 1 1   24    2    3 o  132.858   2.1835  364.472   11.962  375.044   17.067  354.262   16.772  134.753   3.0708  130.964   3.1050 3.788879 4.366985 
1 1 1   24    2    4 o   92.338   2.3748  176.153   9.0435  179.115   12.824  173.222   12.755   93.111   3.3394   91.564   3.3774 1.546310 4.749575 
1 1 1   24    2    5 f  142.435   2.1656  419.029   12.722  419.263   18.003  418.794   17.982  142.475   3.0636  142.395   3.0618 0.7960510E-01 4.331286 
1 1 1   24    2    6 o  168.824   2.1822  588.699   15.195  586.862   21.458  590.547   21.519  168.559   3.0866  169.088   3.0857 -0.5284576 4.364445 
1 1 1   24    2    7 o  126.851   2.1959  332.383   11.488  327.017   16.208  337.799   16.285  125.821   3.1233  127.881   3.0875 -2.059807 4.391828 
1 1 1   24    2    8 o   44.004   3.6130   40.134   6.5544   41.009   9.2060   39.234   9.3340   44.494   5.0165   43.514   5.2009 0.9807701 7.225959 
1 1 1   24    2    9 o  134.531   2.1887  373.879   12.144  373.436   17.092  374.332   17.257  134.452   3.0822  134.611   3.1082 -0.1591644 4.377304 
1 1 1   24    2   10 o  126.659   2.2095  331.161   11.538  341.869   16.596  321.147   16.050  128.638   3.1281  124.679   3.1212 3.959099 4.418943 
1 1 1   24    2   11 o   73.349   2.6918  111.261   8.1426  109.753   11.531  112.761   11.500   72.852   3.8376   73.847   3.7756 -0.9949875 5.383562 
1 1 1   24    2   12 o   95.919   2.9790  191.687   11.634  199.399   15.455  181.603   17.672   98.190   3.8162   93.647   4.5754 4.542900 5.957997 
1 1 1   24    2   13 o   22.202   5.9743   6.0245   7.6831   1.5691   10.103   12.136   11.832   18.799   7.8389   25.606   9.0178 -6.806757 11.94860 
1 1 1   24    2   14 o  117.461   2.3959  286.579   11.536  271.431   17.014  299.467   15.694  114.555   3.6010  120.367   3.1612 -5.811882 4.791723 
1 1 1   24    2   15 f  121.922   2.3681  306.806   11.853  313.347   17.718  301.507   15.947  123.081   3.4902  120.762   3.2017 2.319084 4.736298 
1 1 1   24    2   16 o   81.522   2.5623  137.498   8.6119  142.889   12.287  132.292   12.074   83.096   3.5850   79.949   3.6618 3.146790 5.124503 
1 1 1   24    2   17 o  127.102   2.2652  334.158   11.872  325.161   16.745  343.250   16.834  125.378   3.2381  128.827   3.1683 -3.448730 4.530310 
1 1 1   24    2   18 o  171.117   2.3995  603.160   16.487  618.114   26.696  593.939   20.963  172.758   3.7466  169.476   2.9990 3.282303 4.799021 
1 1 1   24    2   19 o   51.300   4.7908   54.887   9.9676   56.699   15.692   53.662   12.906   51.936   7.3256   50.665   6.1760 1.271076 9.581671 
1 1 1   24    2   20 o  111.900   3.0148  257.097   13.742  241.763   17.865  279.319   21.506  107.910   4.0140  115.889   4.4992 -7.979164 6.029519 
1 1 1   24    2   21 o   64.030   3.8076   85.195   9.8864   83.115   12.790   88.284   15.583   63.135   4.9117   64.925   5.8194 -1.789448 7.615101 
1 1 1   24    2   22 o  145.755   2.9449  439.842   17.066  433.710   21.388  450.588   28.314  144.533   3.5879  146.976   4.6707 -2.442856 5.889714 
1 1 1   24    2   23 o   80.831   3.4210  136.206   11.326  133.460   15.083  139.754   17.148   79.958   4.5738   81.703   5.0887 -1.745842 6.842082 
1 1 1   24    2   24 f   84.921   3.1698  150.462   11.055  150.740   16.408  150.231   14.962   84.947   4.6831   84.895   4.2730 0.5251312E-01 6.339552 
1 1 1   24    2   25 o   28.095   6.1429   17.221   7.8583   15.705   11.138   18.724   11.089   27.093   8.7500   29.097   8.6241 -2.003277 12.28572 
1 1 1   24    2   26 o   34.083   5.8803   26.097   8.2619   20.813   11.420   31.898   11.967   30.422   8.6768   37.745   7.9388 -7.322556 11.76061 
1 1 1   24    2   27 f   48.449   6.4772   49.520   13.268   13.614   17.166  102.799   20.910   27.846   10.673   69.052   7.3421 -41.20655 12.95449 
1 1 1   24    2   28 o  108.813   2.9744  248.731   13.257  239.432   19.724  256.394   17.905  106.845   4.4758  110.781   3.9188 -3.936829 5.948876 
1 1 1   24    2   29 o   38.899   5.4339   34.170   8.4845   25.116   12.148   42.793   11.855   33.113   8.7595   44.684   6.4327 -11.57068 10.86779 
1 1 1   24    2   30 o   40.453   5.3640   36.860   8.6347   26.373   12.149   47.565   12.275   33.843   8.6661   47.063   6.3237 -13.21984 10.72805 
1 1 1   24    2   31 o   22.083   6.2424   4.3583   8.7046   13.921   13.976  -1.7017   11.126   26.426   9.7355   17.740   7.8160 8.685755 12.48478 
1 1 1   24    2   32 o   56.966   6.0055   74.839   12.958   68.359   21.518   78.526   16.230   53.763   10.074   60.169   6.5402 -6.406094 12.01093 
1 1 1   24    2   33 o   79.317   4.1859  136.832   12.777  133.788   22.312  138.317   15.586   77.964   6.9385   80.669   4.6844 -2.704773 8.371783 
1 1 1   24    2   34 o   31.726   6.1082   23.931   8.3565   18.433   11.821   29.423   11.815   28.093   9.0081   35.360   8.2519 -7.266640 12.21637 
1 1 1   24    2   35 o   50.921   5.9636   59.340   11.368   57.188   13.751   63.987   20.208   50.826   6.5596   51.015   9.9615 -0.1887665 11.92724 
1 1 1   24    2   36 o   43.252   7.7016   51.407   15.557   72.146   20.715   24.579   23.561   54.918   9.1456   31.586   12.394 23.33219 15.40326 
1 1 1   24    2   37 o   26.222   8.7472  -3.2635   19.384  -5.6394   46.714  -2.7693   21.305   29.723   14.109   22.721   10.344 7.001932 17.49430 
1 1 1   24    2   38 o   61.590   8.8028  106.269   21.958   87.661   29.959  127.867   32.277   54.005   13.490   69.176   11.313 -15.17099 17.60565 
1 1 1   24    2   39 o   31.778   13.348   28.527   29.612   0.0000   0.0000   28.527   29.612  ?   ?    31.778   13.348      ?      ? 
1 1 1   24    3    0 o   62.709   2.8543   82.204   10.341   82.204   10.341   82.204   10.341   62.709   4.0366   62.709   4.0366 0.000000 0.000000 
1 1 1   24    3    1 o  155.333   2.1772  498.338   13.948  495.668   19.656  501.046   19.796  154.914   3.0764  155.752   3.0816 -0.8377838 4.354397 
1 1 1   24    3    2 o  110.405   2.2385  251.775   10.193  254.731   14.457  248.854   14.373  111.050   3.1564  109.760   3.1750 1.289543 4.477023 
1 1 1   24    3    3 o  134.020   2.3738  365.588   12.892  399.725   20.578  343.533   16.541  139.076   3.5874  128.965   3.1097 10.11166 4.747589 
1 1 1   24    3    4 o  245.478   2.3983  1245.05   24.282  1245.79   34.361  1244.30   34.317  245.551   3.3928  245.404   3.3905 0.1464996 4.796558 
1 1 1   24    3    5 o  238.603   2.3703  1176.22   23.325  1170.88   32.879  1181.64   33.096  238.058   3.3487  239.148   3.3554 -1.090042 4.740517 
1 1 1   24    3    6 o  126.766   2.1921  331.858   11.458  335.071   16.418  328.806   15.998  127.362   3.1255  126.169   3.0744 1.192917 4.384160 
1 1 1   24    3    7 o   65.178   2.7867   87.791   7.4877   91.781   10.724   83.996   10.460   66.624   3.9026   63.733   3.9791 2.891277 5.573475 
1 1 1   24    3    8 o  245.749   2.3965  1247.95   24.290  1242.17   34.207  1253.83   34.496  245.175   3.3828  246.322   3.3955 -1.146271 4.792988 
1 1 1   24    3    9 o  175.561   2.2016  636.041   15.932  657.067   23.025  616.727   22.068  178.340   3.1303  172.782   3.0966 5.557816 4.403145 
1 1 1   24    3   10 o  113.403   2.2517  265.654   10.529  274.685   14.994  256.871   14.787  115.305   3.1529  111.500   3.2154 3.805511 4.503329 
1 1 1   24    3   11 f  141.422   2.2053  413.041   12.860  404.577   17.966  421.935   18.417  139.937   3.1127  142.906   3.1247 -2.969345 4.410552 
1 1 1   24    3   12 o  112.853   2.7097  264.490   12.107  267.312   15.176  259.551   20.079  113.732   3.2352  111.973   4.3478 1.758453 5.419388 
1 1 1   24    3   13 o  144.500   2.7873  428.175   16.350  411.256   21.134  453.397   25.803  141.014   3.6337  147.987   4.2275 -6.973022 5.574596 
1 1 1   24    3   14 o  133.777   2.6419  375.222   14.027  351.286   22.831  389.735   17.777  130.240   4.2503  137.314   3.1390 -7.074417 5.283740 
1 1 1   24    3   15 o   68.765   2.9374   98.284   8.2946   93.419   12.124  102.564   11.372   67.143   4.3782   70.386   3.9174 -3.243401 5.874888 
1 1 1   24    3   16 o  174.702   2.2387  630.891   16.126  610.486   22.574  652.159   23.046  171.815   3.1855  177.589   3.1464 -5.773499 4.477410 
1 1 1   24    3   17 o  197.882   2.7893  800.316   21.299  841.898   37.888  781.105   25.753  201.439   4.5603  194.326   3.2131 7.112717 5.578619 
1 1 1   24    3   18 o  169.973   2.6390  598.302   18.486  600.343   26.690  596.421   25.629  170.238   3.8012  169.708   3.6616 0.5295715 5.277924 
1 1 1   24    3   19 o   96.193   3.5847  192.225   14.205  184.111   19.510  201.379   20.722   94.045   5.0298   98.341   5.1089 -4.296814 7.169338 
1 1 1   24    3   20 f   49.536   4.5055   50.485   9.0920   63.131   13.888   41.000   12.028   54.891   6.1343   44.181   6.6006 10.71059 9.010999 
1 1 1   24    3   21 o   73.512   3.5632  113.650   10.600  117.726   13.868  107.922   16.439   75.202   4.4710   71.821   5.5494 3.380592 7.126407 
1 1 1   24    3   22 o   91.788   2.9010  175.357   10.978  173.433   15.682  177.207   15.374   91.282   4.1655   92.295   4.0387 -1.013344 5.801923 
1 1 1   24    3   23 f   96.136   2.8576  192.763   11.298  175.647   15.956  209.971   15.999   91.808   4.2138  100.463   3.8612 -8.654182 5.715292 
1 1 1   24    3   24 o   21.458   5.8645   6.6686   7.3838   8.3512   10.702   5.1402   10.200   22.496   8.4736   20.420   8.1097 2.076077 11.72895 
1 1 1   24    3   25 o   73.785   3.2686  113.663   9.9224  125.517   14.440  103.059   13.658   77.443   4.5208   70.127   4.7220 7.315948 6.537160 
1 1 1   24    3   26 o   88.839   3.5780  168.293   12.576  174.392   15.879  158.030   20.598   91.303   4.2166   86.375   5.7819 4.927689 7.156094 
1 1 1   24    3   27 f  119.810   2.9175  300.301   14.413  300.561   20.171  300.029   20.603  119.882   4.0795  119.738   4.1719 0.1444397 5.834992 
1 1 1   24    3   28 o   82.649   3.9339  143.279   12.492  148.196   22.262  141.018   15.092   83.297   6.4798   82.001   4.4624 1.295425 7.867727 
1 1 1   24    3   29 o  125.774   5.0648  334.370   26.273   0.0000   0.0000  334.370   26.273  ?   ?   125.774   5.0648      ?      ? 
1 1 1   24    3   30 o   41.070   5.9081   38.287   9.5278   36.382   15.519   39.439   12.070   39.435   9.6259   42.705   6.8529 -3.270203 11.81612 
1 1 1   24    3   31 o   39.420   5.3696   35.024   8.4980   30.825   12.400   38.743   11.669   36.569   8.3985   42.272   6.6930 -5.703686 10.73924 
1 1 1   24    3   32 o   17.897   5.5565  -1.6501   7.9106  -4.3500   10.781   1.4992   11.644   16.466   7.4409   19.328   8.2542 -2.862679 11.11303 
1 1 1   24    3   33 o   65.142   3.6959   90.883   9.9278   89.450   13.862   92.392   14.225   64.628   5.2006   65.657   5.2528 -1.029495 7.391777 
1 1 1   24    3   34 f   23.025   6.2389   9.5863   8.3654   12.632   11.960   6.6686   11.705   24.629   9.0160   21.421   8.6260 3.207989 12.47779 
1 1 1   24    3   35 o   48.895   6.4070   66.083   11.327   81.890   13.892   34.728   19.565   61.429   5.4829   36.361   11.582 25.06778 12.81395 
1 1 1   24    3   36 f   69.595   6.6348  120.449   17.631  141.014   23.492   93.927   26.679   78.860   7.2227   60.331   11.132 18.52880 13.26963 
1 1 1   24    3   37 o   31.577   8.5490   25.626   15.544   25.363   21.276   25.927   22.764   31.425   11.921   31.730   12.257 -0.3053513 17.09798 
1 1 1   24    3   38 o   34.995   10.643   20.029   24.181   92.233   49.867  -2.1686   27.649   45.254   17.944   24.736   11.451 20.51844 21.28638 
1 1 1   24    3   39 o   37.442   14.159   47.555   29.958   0.0000   0.0000   47.555   29.958  ?   ?    37.442   14.159      ?      ? 
1 1 1   24    4    0 o   8.3697   4.1771  -9.8638   8.1820  -9.8638   8.1820  -9.8638   8.1820   8.3697   5.9073   8.3697   5.9073 0.000000 0.000000 
1 1 1   24    4    1 o  156.878   2.1663  508.276   14.016  512.192   19.935  504.448   19.711  157.475   3.0693  156.281   3.0580 1.194046 4.332692 
1 1 1   24    4    2 o  147.283   2.1752  447.942   13.212  453.944   18.882  442.185   18.493  148.249   3.0880  146.318   3.0644 1.931046 4.350475 
1 1 1   24    4    3 o  282.305   2.5461  1645.69   29.626  1682.83   42.839  1611.66   41.015  285.348   3.6400  279.262   3.5610 6.086151 5.092171 
1 1 1   24    4    4 o   86.189   2.4379  153.323   8.6497  167.144   12.452  140.433   12.025   89.943   3.3565   82.435   3.5366 7.507957 4.875875 
1 1 1   24    4    5 o  108.327   2.2507  242.310   10.054  248.954   14.382  235.960   14.060  109.779   3.1763  106.875   3.1897 2.904167 4.501453 
1 1 1   24    4    6 o   55.577   3.0603   63.904   7.0147   64.138   9.9780   63.675   9.8636   55.677   4.3451   55.477   4.3108 0.1999245 6.120680 
1 1 1   24    4    7 o  192.165   2.2283  762.659   17.658  773.984   25.265  751.844   24.689  193.558   3.1648  190.772   3.1378 2.785690 4.456647 
1 1 1   24    4    8 o   88.572   2.4332  162.134   8.8887  160.975   12.580  163.289   12.561   88.255   3.4560   88.889   3.4262 -0.6338959 4.866486 
1 1 1   24    4    9 o  118.718   2.2202  291.177   10.871  290.179   15.371  292.176   15.377  118.514   3.1446  118.922   3.1351 -0.4077988 4.440469 
1 1 1   24    4   10 o  113.752   2.2816  266.972   10.693  285.336   15.422  249.972   14.838  117.517   3.1819  109.988   3.2709 7.529175 4.563270 
1 1 1   24    4   11 o   71.905   2.8690  107.005   8.4236  107.239   11.160  106.695   12.841   72.013   3.7575   71.797   4.3365 0.2156754 5.737939 
1 1 1   24    4   12 o  237.018   2.8769  1167.42   26.827  1179.09   33.365  1146.06   45.122  238.827   3.3872  235.208   4.6512 3.619461 5.753862 
1 1 1   24    4   13 o  177.898   2.8087  656.489   20.227  646.880   31.686  663.098   26.277  176.734   4.3470  179.061   3.5580 -2.327164 5.617428 
1 1 1   24    4   14 o  184.930   2.5937  707.528   19.783  703.451   27.903  711.649   28.052  184.394   3.6690  185.465   3.6672 -1.071686 5.187478 
1 1 1   24    4   15 o   99.324   2.5398  204.150   10.368  203.883   15.311  204.376   14.090   99.250   3.7404   99.398   3.4368 -0.1480331 5.079570 
1 1 1   24    4   16 o  135.267   2.3570  378.802   13.093  375.374   19.395  381.671   17.746  134.684   3.4916  135.850   3.1672 -1.166458 4.713999 
1 1 1   24    4   17 o  267.775   2.6526  1483.92   28.481  1488.73   46.050  1480.95   36.244  267.996   4.1662  267.553   3.2844 0.4423218 5.305152 
1 1 1   24    4   18 o   52.994   4.8350   66.341   8.6870   45.627   15.857   75.224   10.384   45.763   8.7197   60.226   4.1803 -14.46299 9.669970 
1 1 1   24    4   19 o   92.007   3.3227  175.204   12.406  180.931   19.498  171.308   16.081   93.198   5.0723   90.815   4.2934 2.383652 6.645422 
1 1 1   24    4   20 o   60.939   3.6224   77.384   9.0954   82.426   13.064   72.642   12.670   62.875   5.0379   59.003   5.2065 3.871433 7.244846 
1 1 1   24    4   21 o   23.700   6.1806   9.4585   8.2764   14.126   10.596   2.1563   13.254   26.111   8.5415   21.290   8.9355 4.820871 12.36121 
1 1 1   24    4   22 o   20.086   5.6368   2.6869   7.5124   10.689   10.600  -5.3867   10.648   23.859   8.5212   16.312   7.3811 7.547314 11.27351 
1 1 1   24    4   23 o   72.142   3.3402  108.771   9.9312  114.166   14.108  103.470   13.983   73.935   4.6263   70.349   4.8192 3.586380 6.680368 
1 1 1   24    4   24 o  108.831   2.7899  247.279   12.482  235.024   18.101  258.389   17.236  106.203   4.1324  111.459   3.7493 -5.255783 5.579812 
1 1 1   24    4   25 o   71.064   4.0338  108.085   11.148  102.380   18.971  111.094   13.777   69.310   6.6364   72.817   4.5874 -3.507355 8.067603 
1 1 1   24    4   26 o   48.431   5.9155   51.026   10.183   50.009   11.883   53.839   19.760   48.551   5.9342   48.311   10.235 0.2398071 11.83100 
1 1 1   24    4   27 o   69.379   3.4011  101.186   9.7259   96.202   13.618  106.374   13.895   67.616   4.8833   71.143   4.7354 -3.527191 6.802209 
1 1 1   24    4   28 o   51.200   6.0430   66.072   10.523   42.072   19.301   76.223   12.553   42.261   10.975   60.140   5.0607 -17.87931 12.08593 
1 1 1   24    4   29 o  138.195   2.8411  399.871   16.078  403.053   24.260  397.379   21.471  138.556   4.2452  137.833   3.7768 0.7234955 5.682134 
1 1 1   24    4   30 o   58.302   4.2894   72.955   10.164   71.712   15.676   73.857   13.350   57.678   6.5897   58.925   5.4929 -1.246803 8.578835 
1 1 1   24    4   31 o   32.272   5.9525   24.146   8.0044   22.891   11.768   25.226   10.919   31.418   8.7550   33.127   8.0670 -1.709633 11.90490 
1 1 1   24    4   32 o   96.345   4.0060  207.896   14.379  176.357   25.502  222.594   17.410   89.868   6.8803  102.822   4.1053 -12.95347 8.012027 
1 1 1   24    4   33 o   28.594   6.0683   15.267   9.0630   0.3622   12.066   34.563   13.729   19.024   8.2652   38.165   8.8874 -19.14041 12.13666 
1 1 1   24    4   34 o   37.749   5.6578   33.382   8.6997   25.955   12.549   40.255   12.072   32.861   8.9957   42.638   6.8646 -9.776333 11.31569 
1 1 1   24    4   35 o   20.616   6.4784   0.8880   9.6993   2.0062   11.052  -2.8604   20.234   18.762   8.0279   22.469   10.170 -3.706335 12.95684 
1 1 1   24    4   36 o   19.450   6.4542 -11.3024   10.559 -15.6396   12.021   3.3455   22.091   14.213   6.8547   24.687   10.938 -10.47435 12.90837 
1 1 1   24    4   37 o   30.300   8.1485   21.574   15.040   34.144   20.633   7.3235   21.968   35.148   11.929   25.452   11.104 9.696089 16.29706 
1 1 1   24    4   38 o   25.116   8.4804  -8.5641   22.499 -31.3757   47.067  -1.8074   25.616   26.144   12.820   24.087   11.105 2.056746 16.96090 
1 1 1   24    4   39 o   31.540   10.101   23.937   25.215   36.338   52.495   20.217   28.748   33.687   15.658   29.394   12.764 4.293552 20.20141 
1 1 1   24    5    0 o   55.659   3.0867   65.156   9.8791   65.156   9.8791   65.156   9.8791   55.659   4.3652   55.659   4.3652 0.000000 0.000000 
1 1 1   24    5    1 o  253.063   2.4229  1322.49   25.279  1296.98   35.158  1349.80   36.373  250.541   3.4023  255.585   3.4505 -5.043961 4.845781 
1 1 1   24    5    2 o  147.928   2.1709  451.889   13.244  458.591   18.903  445.428   18.561  149.005   3.0759  146.852   3.0645 2.152985 4.341883 
1 1 1   24    5    3 o  148.104   2.1681  452.893   13.241  444.562   18.495  461.652   18.965  146.708   3.0565  149.500   3.0757 -2.791763 4.336151 
1 1 1   24    5    4 f   92.041   2.3769  175.053   9.0171  166.896   12.687  183.377   12.818   89.871   3.4229   94.211   3.2987 -4.339745 4.753706 
1 1 1   24    5    5 o  188.707   2.2210  735.403   17.284  748.318   24.723  723.057   24.171  190.326   3.1495  187.088   3.1325 3.238312 4.442045 
1 1 1   24    5    6 o   85.173   2.4468  149.946   8.5923  149.005   12.292  150.845   12.016   84.909   3.5098   85.437   3.4099 -0.5278091 4.893517 
1 1 1   24    5    7 o  174.931   2.1971  632.148   15.852  628.245   22.359  636.093   22.477  174.388   3.1086  175.474   3.1057 -1.086029 4.394182 
1 1 1   24    5    8 o  107.216   2.2908  237.480   10.129  232.697   14.235  242.385   14.416  106.122   3.2523  108.310   3.2270 -2.188202 4.581612 
1 1 1   24    5    9 o  226.357   2.3367  1058.78   21.815  1058.71   30.848  1058.84   30.855  226.350   3.3043  226.363   3.3048 -0.1290894E-01 4.673359 
1 1 1   24    5   10 o  185.623   2.4229  709.326   18.266  696.362   23.741  728.135   28.597  183.587   3.1354  187.660   3.6947 -4.073013 4.845759 
1 1 1   24    5   11 o   69.462   3.2470  101.930   8.8870  107.346   11.210   92.767   14.581   72.044   3.7726   66.880   5.2858 5.163521 6.494019 
1 1 1   24    5   12 f  133.279   2.7636  367.214   14.909  365.841   19.298  369.245   23.482  133.012   3.5176  133.545   4.2632 -0.5327606 5.527116 
1 1 1   24    5   13 o   21.817   5.5608   7.0881   6.5746   13.286   10.096   2.5245   8.6634   25.601   8.3356   18.033   7.3625 7.568161 11.12151 
1 1 1   24    5   14 o   41.502   4.2309   35.967   7.2076   34.217   10.562   37.493   9.8603   40.532   6.3179   42.471   5.6290 -1.938999 8.461796 
1 1 1   24    5   15 o  105.838   2.4439  231.269   10.625  236.927   15.834  226.635   14.330  106.999   3.5879  104.676   3.3192 2.323547 4.887710 
1 1 1   24    5   16 o  126.769   2.3826  333.193   12.385  325.647   18.420  339.420   16.733  125.432   3.5605  128.106   3.1669 -2.674194 4.765105 
1 1 1   24    5   17 o   62.496   3.5476   86.400   8.4867   64.343   13.786   99.859   10.769   55.554   6.0169   69.438   3.7602 -13.88429 7.095208 
1 1 1   24    5   18 o  121.812   2.9484  312.855   13.549  295.288   24.429  320.660   16.283  119.146   4.9711  124.477   3.1716 -5.330849 5.896701 
1 1 1   24    5   19 o   56.878   3.9123   68.290   9.0728   58.630   13.139   77.094   12.544   52.927   6.0188   60.830   4.9998 -7.903183 7.824529 
1 1 1   24    5   20 o  150.296   2.5961  468.209   16.040  474.081   23.730  463.269   21.765  151.129   3.8070  149.464   3.5306 1.665512 5.192201 
1 1 1   24    5   21 o  126.534   3.1873  325.486   15.784  359.075   27.563  309.096   19.254  131.093   5.0977  121.975   3.8272 9.117996 6.374506 
1 1 1   24    5   22 o   47.792   4.7196   47.296   9.1870   38.549   12.112   59.147   14.098   42.659   6.8839   52.925   6.4584 -10.26635 9.439188 
1 1 1   24    5   23 o  148.754   2.6095  459.404   15.961  467.562   23.597  452.523   21.672  149.928   3.8159  147.579   3.5604 2.349060 5.218993 
1 1 1   24    5   24 o  100.509   2.8208  210.255   11.688  204.131   16.217  216.874   16.859   98.992   3.9720  102.026   4.0064 -3.034134 5.641653 
1 1 1   24    5   25 o   66.309   3.5997   92.994   9.7601   79.105   13.782  106.968   13.824   61.217   5.4586   71.401   4.6942 -10.18407 7.199402 
1 1 1   24    5   26 o   80.597   4.2932  140.083   12.579  142.572   14.759  133.474   24.049   82.509   4.3371   78.685   7.4105 3.823997 8.586329 
1 1 1   24    5   27 o   52.098   4.0819   57.494   8.7480   52.006   12.148   63.404   12.608   49.473   5.9536   54.722   5.5860 -5.249493 8.163888 
1 1 1   24    5   28 o   93.596   3.5575  184.720   13.198  184.423   21.891  184.889   16.542   93.253   5.6917   93.939   4.2694 -0.6863861 7.115050 
1 1 1   24    5   29 o   52.163   4.2662   57.584   9.1061   68.721   13.605   48.545   12.256   56.751   5.8124   47.574   6.2463 9.176392 8.532343 
1 1 1   24    5   30 o   23.820   6.2031   9.5302   8.0873   16.355   12.682   4.8518   10.499   27.476   9.3519   20.165   8.1522 7.310465 12.40629 
1 1 1   24    5   31 o   26.080   6.0032   14.586   8.0188   5.4949   11.985   21.955   10.790   21.316   8.6762   30.845   8.2992 -9.528913 12.00641 
1 1 1   24    5   32 o   23.684   6.2253   10.537   8.1177   13.402   12.091   8.1868   10.953   25.366   9.0964   22.003   8.5014 3.362745 12.45064 
1 1 1   24    5   33 o   78.914   3.7250  133.225   12.016  130.288   15.895  137.141   18.354   78.093   4.9351   79.735   5.5811 -1.642426 7.450059 
1 1 1   24    5   34 o   44.242   5.0430   43.627   9.1942   43.641   13.272   43.614   12.748   44.178   7.2842   44.306   6.9763 -0.1286240 10.08603 
1 1 1   24    5   35 o   77.473   4.8703  124.728   13.382  115.685   15.219  155.564   28.102   73.194   5.0412   81.751   8.3347 -8.556129 9.740616 
1 1 1   24    5   36 o   53.105   6.6582   68.187   12.518   67.796   14.676   69.231   23.982   55.179   6.4487   51.031   11.651 4.148472 13.31635 
1 1 1   24    5   37 o   31.931   8.6800   27.073   16.235   30.901   21.802   22.308   24.325   33.465   12.185   30.397   12.365 3.068317 17.35991 
1 1 1   24    5   38 o   24.950   8.1615  -6.4745   21.789 -110.6592   52.076   15.636   23.990   22.146   11.226   27.755   11.850 -5.608755 16.32307 
1 1 1   24    5   39 o   28.718   9.0958   15.752   22.928 -25.3120   49.345   27.059   25.893   26.556   13.043   30.880   12.682 -4.324732 18.19167 
1 1 1   24    5   40 o   36.655   13.941   49.200   29.147   0.0000   0.0000   49.200   29.147  ?   ?    36.655   13.941      ?      ? 
1 1 1   24    6    0 o   22.786   6.6630   15.107   8.7945   15.107   8.7945   15.107   8.7945   22.786   9.4229   22.786   9.4229 0.000000 0.000000 
1 1 1   24    6    1 o  205.695   2.2698  874.057   19.256  870.639   27.114  877.536   27.351  205.290   3.2022  206.100   3.2176 -0.8098450 4.539533 
1 1 1   24    6    2 o   87.560   2.4173  158.335   8.7249  151.063   12.195  165.961   12.488   85.499   3.4583   89.620   3.3785 -4.121315 4.834628 
1 1 1   24    6    3 o  123.655   2.2071  315.789   11.253  304.902   15.790  327.024   16.041  121.488   3.1513  125.822   3.0911 -4.334381 4.414263 
1 1 1   24    6    4 o  251.956   2.4266  1309.47   25.183  1267.81   34.545  1356.71   36.789  247.696   3.3814  256.217   3.4813 -8.521805 4.853178 
1 1 1   24    6    5 o  206.029   2.4512  879.054   20.637  890.946   27.487  863.689   31.242  207.661   3.2092  204.397   3.7060 3.264435 4.902395 
1 1 1   24    6    6 o   71.798   2.8816  107.146   8.3889  109.595   10.975  103.704   13.010   72.811   3.6546   70.785   4.4564 2.025902 5.763277 
1 1 1   24    6    7 o  192.072   2.3957  764.222   18.855  745.429   28.129  779.557   25.409  189.898   3.5914  194.247   3.1716 -4.349045 4.791346 
1 1 1   24    6    8 o  186.675   2.3862  720.544   18.233  716.992   27.497  723.331   24.357  186.240   3.5797  187.111   3.1562 -0.8710480 4.772451 
1 1 1   24    6    9 o  286.264   2.5729  1694.14   30.377  1702.03   43.155  1686.40   42.767  286.922   3.6467  285.606   3.6306 1.316681 5.145818 
1 1 1   24    6   10 o  144.529   2.5523  431.813   15.159  384.157   21.124  482.418   21.768  136.292   3.7578  152.765   3.4548 -16.47272 5.104626 
1 1 1   24    6   11 o  128.936   2.6610  346.732   13.581  354.425   17.074  333.476   22.412  130.957   3.1611  126.914   4.2815 4.042595 5.321990 
1 1 1   24    6   12 o   95.172   2.6325  187.851   10.260  191.558   13.790  183.254   15.354   96.246   3.4740   94.098   3.9562 2.147675 5.265013 
1 1 1   24    6   13 o  152.538   2.3938  478.603   14.880  497.388   23.076  465.232   19.469  155.058   3.6083  150.019   3.1465 5.039368 4.787525 
1 1 1   24    6   14 o   97.305   2.5409  196.422   10.101  192.085   15.283  199.786   13.460   96.325   3.8468   98.285   3.3205 -1.960396 5.081707 
1 1 1   24    6   15 o  110.148   2.4423  251.562   11.016  246.506   16.508  255.622   14.792  109.124   3.6677  111.171   3.2261 -2.047043 4.884657 
1 1 1   24    6   16 o  166.283   3.5490  556.927   18.254  601.380   45.124  548.228   19.961  169.731   6.4458  162.835   2.9721 6.896027 7.098028 
1 1 1   24    6   17 o  178.401   3.9332  665.777   21.463  658.347   52.608  667.261   23.509  177.212   7.1977  179.590   3.1738 -2.377701 7.866388 
1 1 1   24    6   18 o  210.332   3.0735  915.723   25.985  932.906   41.886  904.971   33.131  211.767   4.7956  208.896   3.8454 2.870758 6.146978 
1 1 1   24    6   19 o   74.538   3.0458  118.523   9.0169  102.623   14.279  129.068   11.629   70.179   4.9332   78.897   3.5736 -8.717751 6.091564 
1 1 1   24    6   20 o  171.645   2.5688  611.165   18.142  614.125   26.627  608.601   24.785  171.996   3.7535  171.293   3.5082 0.7037354 5.137691 
1 1 1   24    6   21 o  144.780   2.6143  435.515   15.574  434.125   22.799  436.731   21.326  144.527   3.8248  145.033   3.5651 -0.5069733 5.228648 
1 1 1   24    6   22 o   70.894   3.7731  108.558   10.690  128.463   14.449   84.489   15.889   78.467   4.4647   63.321   6.0838 15.14585 7.546216 
1 1 1   24    6   23 o   84.714   3.0443  149.372   10.621  138.581   14.725  161.075   15.335   81.513   4.3800   87.914   4.2292 -6.400291 6.088559 
1 1 1   24    6   24 o   49.492   4.1852   52.038   8.4900   46.444   12.172   57.337   11.848   46.808   6.3051   52.177   5.5053 -5.369114 8.370387 
1 1 1   24    6   25 o  108.479   2.8798  245.873   12.863  245.003   17.673  246.854   18.757  108.316   3.9560  108.643   4.1859 -0.3271561 5.759505 
1 1 1   24    6   26 o   40.273   6.9157   35.774   10.301   34.090   11.942   40.671   20.361   39.104   7.6783   41.442   11.504 -2.338337 13.83148 
1 1 1   24    6   27 o   40.272   5.0350   35.282   8.1811   32.595   11.275   38.271   11.889   38.295   7.4064   42.248   6.8229 -3.952526 10.07010 
1 1 1   24    6   28 o   70.265   4.1922  104.254   11.441  107.685   19.953  102.573   13.966   70.756   6.8371   69.774   4.8529 0.9824142 8.384323 
1 1 1   24    6   29 o   23.993   5.9517   10.050   8.4129  -4.2246   13.252   19.686   10.889   18.576   8.3347   29.409   8.4984 -10.83293 11.90342 
1 1 1   24    6   30 o   56.960   4.1311   69.907   9.6152   64.630   14.236   74.334   13.038   54.803   6.2983   59.118   5.3474 -4.315460 8.262165 
1 1 1   24    6   31 o   21.511   6.0352   6.7480   7.9694   7.1540   11.646   6.3903   10.929   21.907   8.6762   21.114   8.3916 0.7923126 12.07045 
1 1 1   24    6   32 o   54.050   4.1829   62.519   9.2809   69.432   13.966   57.052   12.420   56.677   5.9745   51.423   5.8559 5.254417 8.365772 
1 1 1   24    6   33 o   24.834   6.3750   11.561   8.7631   4.7740   11.852   19.745   13.015   20.661   8.5424   29.008   9.4651 -8.347534 12.74992 
1 1 1   24    6   34 o   22.117   6.1090   3.7528   10.158   17.861   12.083 -30.2510   18.758   27.647   9.1247   16.587   8.1252 11.05947 12.21793 
1 1 1   24    6   35 o   40.403   6.4449   50.394   11.595   65.177   13.509   9.0311   22.597   54.378   6.0233   26.427   11.396 27.95103 12.88986 
1 1 1   24    6   36 o   32.139   7.0545   28.686   11.181   35.151   12.740   7.0155   23.325   38.239   8.3150   26.039   11.399 12.19948 14.10910 
1 1 1   24    6   37 o   43.605   9.8118   56.922   19.611   75.114   31.454   45.353   25.083   48.437   14.563   38.774   13.153 9.663319 19.62358 
1 1 1   24    6   38 o   36.729   10.560   45.944   23.921   44.707   52.843   46.263   26.827   35.436   16.193   38.023   13.558 -2.587242 21.11983 
1 1 1   24    6   39 o   33.341   10.430   30.430   24.123   69.168   50.842   19.175   27.405   38.065   16.741   28.617   12.445 9.447533 20.85999 
1 1 1   24    6   40 o   34.847   13.390   42.696   27.059   0.0000   0.0000   42.696   27.059  ?   ?    34.847   13.390      ?      ? 
1 1 1   24    7    0 o   34.218   5.3555   27.502   9.3462   27.502   9.3462   27.502   9.3462   34.218   7.5738   34.218   7.5738 0.000000 0.000000 
1 1 1   24    7    1 o  232.918   2.5502  1121.24   24.219  1120.49   31.924  1122.26   37.173  232.867   3.3238  232.969   3.8687 -0.1022186 5.100484 
1 1 1   24    7    2 o  120.474   2.2517  299.807   11.185  309.952   15.926  289.932   15.712  122.488   3.1525  118.461   3.2159 4.026070 4.503352 
1 1 1   24    7    3 o  112.350   2.4039  261.098   11.056  258.762   16.644  262.944   14.792  111.885   3.6067  112.815   3.1790 -0.9301376 4.807758 
1 1 1   24    7    4 o  111.815   2.2597  258.164   10.412  273.653   14.908  243.415   14.548  115.091   3.1406  108.539   3.2498 6.551704 4.519379 
1 1 1   24    7    5 o  169.292   2.1890  591.852   15.281  580.411   21.359  603.848   21.871  167.617   3.0896  170.967   3.1017 -3.349564 4.377938 
1 1 1   24    7    6 o  193.614   2.2379  774.402   17.870  768.149   25.084  780.846   25.464  192.822   3.1540  194.406   3.1758 -1.584549 4.475884 
1 1 1   24    7    7 o   41.809   3.9093   36.271   6.7380   37.265   9.4816   35.257   9.5772   42.393   5.4228   41.226   5.6325 1.166912 7.818697 
1 1 1   24    7    8 o  176.600   2.2176  644.373   16.153  643.036   22.868  645.704   22.818  176.416   3.1429  176.783   3.1295 -0.3670502 4.435255 
1 1 1   24    7    9 o  171.524   2.3600  603.562   16.492  580.713   21.519  636.080   25.672  167.645   3.1122  175.404   3.5485 -7.758652 4.719973 
1 1 1   24    7   10 o  176.134   2.3685  639.452   17.039  628.393   22.491  654.352   26.106  174.379   3.1271  177.889   3.5581 -3.510635 4.736977 
1 1 1   24    7   11 o   74.717   3.0728  115.819   9.1683  116.428   11.614  114.813   14.935   75.018   3.7537   74.415   4.8661 0.6029663 6.145669 
1 1 1   24    7   12 o   48.390   4.0600   48.734   8.0480   41.637   11.223   56.248   11.548   44.735   6.0825   52.045   5.3795 -7.310032 8.120048 
1 1 1   24    7   13 o  119.374   2.6503  294.886   13.043  293.581   18.152  296.280   18.753  119.107   3.6950  119.641   3.8004 -0.5341492 5.300543 
1 1 1   24    7   14 o  110.558   2.7315  252.959   12.451  247.129   17.344  259.161   17.887  109.245   3.8492  111.870   3.8767 -2.624535 5.463061 
1 1 1   24    7   15 o  244.855   2.6079  1236.77   26.024  1270.16   40.249  1212.78   34.115  247.615   3.9411  242.094   3.4166 5.521255 5.215848 
1 1 1   24    7   16 o  102.851   3.0437  216.268   12.611  233.559   20.457  205.669   16.016  106.067   4.6761   99.635   3.8976 6.433022 6.087454 
1 1 1   24    7   17 o   43.577   5.8936   44.710   8.4247   34.151   17.919   47.707   9.5455   39.254   10.751   47.900   4.8317 -8.645969 11.78718 
1 1 1   24    7   18 o   40.140   4.4429   32.857   7.2224   38.616   11.638   29.250   9.2106   42.892   6.5788   37.387   5.9731 5.504742 8.885837 
1 1 1   24    7   19 o   54.650   3.4716   59.146   7.6220   77.978   12.609   48.303   9.5679   61.151   4.9994   48.148   4.8181 13.00345 6.943182 
1 1 1   24    7   20 o  101.011   2.8147  211.077   11.693  225.427   17.359  199.158   15.821  104.127   4.0420   97.896   3.9183 6.230789 5.629463 
1 1 1   24    7   21 o   37.870   5.3950   31.325   8.1166   35.064   12.041   28.210   10.988   39.985   7.5786   35.754   7.6805 4.230946 10.79004 
1 1 1   24    7   22 o   79.775   3.5039  132.873   11.321  131.649   14.657  134.683   17.824   79.427   4.4742   80.123   5.3936 -0.6964722 7.007801 
1 1 1   24    7   23 o   82.359   3.7758  146.880   12.153  158.964   15.345  126.544   19.905   87.308   4.2612   77.409   6.2345 9.899254 7.551617 
1 1 1   24    7   24 o   95.625   2.9287  191.064   11.550  188.850   16.379  193.254   16.288   95.063   4.1774   96.187   4.1058 -1.123459 5.857354 
1 1 1   24    7   25 o   79.400   4.2340  130.969   12.483  127.353   14.662  140.495   23.797   77.925   4.5618   80.875   7.1343 -2.949951 8.468071 
1 1 1   24    7   26 o   55.261   4.0173   65.033   9.0209   78.946   12.926   51.822   12.595   61.192   5.1216   49.329   6.1908 11.86251 8.034680 
1 1 1   24    7   27 o   46.169   4.8073   46.440   8.7994   37.262   12.292   56.086   12.602   40.957   7.5550   51.381   5.9468 -10.42371 9.614669 
1 1 1   24    7   28 o   23.647   6.6160   8.6789   9.1339   2.4727   17.519   10.996   10.704   23.566   10.096   23.728   8.5533 -0.1625118 13.23194 
1 1 1   24    7   29 o   44.318   5.6106   45.731   9.6603   32.296   14.427   56.649   13.006   37.218   9.3970   51.419   6.1329 -14.20070 11.22126 
1 1 1   24    7   30 o   47.463   4.6051   48.403   8.9364   57.881   13.163   40.300   12.171   51.864   6.1536   43.062   6.8528 8.802574 9.210232 
1 1 1   24    7   31 o   62.764   3.7926   84.323   9.7853   77.779   13.973   90.620   13.708   60.263   5.6216   65.265   5.0925 -5.002205 7.585257 
1 1 1   24    7   32 o   32.814   5.8232   23.783   8.3711   39.572   12.790   11.953   11.072   41.555   7.7476   24.072   8.6956 17.48366 11.64642 
1 1 1   24    7   33 f   34.258   5.2619   26.557   8.5950   3.7749   11.964   50.853   12.355   20.267   8.4972   48.248   6.2088 -27.98106 10.52381 
1 1 1   24    7   34 f   38.087   7.6245   29.950   10.954   22.787   12.393   55.523   23.416   30.663   9.1240   45.512   12.218 -14.84838 15.24892 
1 1 1   24    7   35 o   28.493   7.3030   19.905   11.297   24.530   13.009   5.7232   22.780   31.431   9.3470   25.555   11.224 5.875784 14.60606 
1 1 1   24    7   36 o   23.728   7.0917   5.9323   10.444   2.7713   12.021   15.663   21.091   19.562   8.3713   27.895   11.449 -8.332428 14.18338 
1 1 1   24    7   37 o   35.970   9.5775   37.789   19.360   54.633   30.162   25.987   25.248   40.656   14.389   31.284   12.644 9.372566 19.15492 
1 1 1   24    7   38 f   29.047   8.1890   14.527   18.222 -27.5919   29.264   41.198   23.287   21.323   10.380   36.772   12.669 -15.44894 16.37803 
1 1 1   24    7   39 o   27.092   8.9571   7.4162   23.759 -22.2141   52.375   15.093   26.660   26.870   13.244   27.313   12.063 -0.4428043 17.91415 
1 1 1   24    7   40 o   34.323   13.708   42.945   29.294   0.0000   0.0000   42.945   29.294  ?   ?    34.323   13.708      ?      ? 
1 1 1   24    8    0 o  210.180   2.2827  912.511   27.970  912.511   27.970  912.511   27.970  210.180   3.2282  210.180   3.2282 0.000000 0.000000 
1 1 1   24    8    1 o   79.089   2.5795  129.384   8.4092  132.846   11.804  125.817   11.983   80.167   3.5699   78.010   3.7244 2.157562 5.159018 
1 1 1   24    8    2 o   83.876   2.6615  145.694   9.1512  147.698   12.328  143.235   13.657   84.532   3.5360   83.220   3.9789 1.312225 5.323063 
1 1 1   24    8    3 f  216.941   2.3088  971.891   20.650  992.825   29.706  952.313   28.727  219.198   3.2858  214.684   3.2443 4.513474 4.617576 
1 1 1   24    8    4 o  105.619   2.5070  228.307   10.791  244.873   16.825  216.729   14.065  108.827   3.7484  102.411   3.3300 6.416740 5.013909 
1 1 1   24    8    5 o  150.003   2.1734  464.638   13.444  475.939   19.244  453.865   18.789  151.783   3.0740  148.222   3.0734 3.561600 4.346859 
1 1 1   24    8    6 o   61.968   3.2705   81.106   8.1057   72.192   12.737   87.174   10.508   59.013   5.2329   64.922   3.9244 -5.908558 6.540995 
1 1 1   24    8    7 o   84.908   2.5214  148.873   8.7930  168.262   12.694  130.986   12.192   90.226   3.4111   79.590   3.7141 10.63573 5.042773 
1 1 1   24    8    8 o  138.270   2.3725  396.189   13.438  386.062   20.078  404.405   18.085  136.645   3.5626  139.895   3.1343 -3.249680 4.745094 
1 1 1   24    8    9 o  196.040   2.7431  794.749   20.973  793.960   25.763  796.301   36.115  195.999   3.1869  196.080   4.4656 -0.8120728E-01 5.486192 
1 1 1   24    8   10 o  192.443   2.7530  754.392   20.347  734.369   24.483  799.101   36.584  188.494   3.1491  196.391   4.5165 -7.897308 5.505991 
1 1 1   24    8   11 o  293.327   2.8283  1780.95   33.828  1779.77   44.600  1782.57   51.906  293.296   3.6869  293.358   4.2900 -0.6188965E-01 5.656621 
1 1 1   24    8   12 o  158.504   2.2127  519.303   14.464  512.141   20.289  526.706   20.626  157.393   3.1254  159.615   3.1331 -2.221497 4.425397 
1 1 1   24    8   13 o  161.306   2.3898  538.619   15.739  535.776   23.989  540.768   20.855  160.896   3.6149  161.717   3.1268 -0.8206177 4.779552 
1 1 1   24    8   14 o  166.774   2.3937  577.387   16.318  560.361   24.582  590.798   21.818  164.528   3.6226  169.019   3.1297 -4.490555 4.787303 
1 1 1   24    8   15 o  108.632   2.5295  246.751   11.030  233.049   17.492  255.796   14.212  106.051   3.9992  111.213   3.0983 -5.161453 5.058935 
1 1 1   24    8   16 o  120.856   3.4774  312.113   13.900  289.385   30.323  318.159   15.640  117.696   6.2467  124.016   3.0576 -6.320061 6.954885 
1 1 1   24    8   17 o   77.155   3.8785  115.515   10.242  140.288   22.738  109.211   11.471   81.748   6.7440   72.562   3.8329 9.186340 7.757088 
1 1 1   24    8   18 o   98.429   2.6154  201.373   10.370  199.105   16.494  202.856   13.336   97.906   4.0846   98.952   3.2677 -1.046013 5.230840 
1 1 1   24    8   19 o   74.968   2.8763  116.126   8.6773  119.947   13.989  113.736   11.063   75.904   4.4683   74.032   3.6232 1.871338 5.752681 
1 1 1   24    8   20 f   31.426   4.9345   21.514   7.7758  -1.7081   11.412   41.638   10.623   18.317   7.9967   44.535   5.7836 -26.21880 9.868940 
1 1 1   24    8   21 o  112.822   2.7413  265.363   12.728  253.696   18.350  276.182   17.670  110.387   4.0303  115.257   3.7170 -4.869873 5.482693 
1 1 1   24    8   22 o  142.802   3.0498  422.727   17.559  413.869   22.466  436.637   28.150  141.045   3.8618  144.560   4.7214 -3.515274 6.099639 
1 1 1   24    8   23 o   92.694   3.7290  182.944   13.974  142.552   19.818  222.891   19.709   82.182   5.8467  103.206   4.6300 -21.02333 7.457927 
1 1 1   24    8   24 o   73.365   3.2176  112.627   9.7202  103.983   13.453  122.069   14.060   70.404   4.6329   76.327   4.4663 -5.923096 6.435144 
1 1 1   24    8   25 f   47.148   5.7002   43.597   10.048   36.414   11.738   63.287   19.435   40.594   7.2783   53.701   8.7747 -13.10688 11.40040 
1 1 1   24    8   26 o   32.471   5.9200   23.890   7.9831   23.069   11.309   24.705   11.271   31.909   8.4566   33.033   8.2868 -1.124193 11.83997 
1 1 1   24    8   27 o   52.095   4.1182   57.649   8.8482   57.571   12.461   57.729   12.566   52.065   5.8029   52.125   5.8451 -0.6000900E-01 8.236476 
1 1 1   24    8   28 o   58.459   4.7934   73.404   10.588   74.818   19.314   72.797   12.660   58.326   8.0288   58.591   5.2388 -0.2647095 9.586751 
1 1 1   24    8   29 o   50.068   4.5674   54.655   9.2608   43.723   13.212   65.214   12.985   44.846   7.1430   55.290   5.6940 -10.44432 9.134748 
1 1 1   24    8   30 o   66.523   3.8104   95.448   10.320   85.079   15.287  104.131   13.988   62.952   5.8878   70.094   4.8385 -7.142754 7.620830 
1 1 1   24    8   31 o   28.620   5.8561   18.269   8.0660   7.1434   11.530   28.933   11.288   21.777   8.6304   35.464   7.9178 -13.68621 11.71222 
1 1 1   24    8   32 o   48.674   4.6200   52.092   9.1875   50.408   13.816   53.428   12.302   47.746   7.0157   49.601   6.0132 -1.855141 9.240101 
1 1 1   24    8   33 o   89.442   3.1951  170.386   11.779  164.863   16.747  175.793   16.570   87.946   4.6171   90.939   4.4178 -2.993309 6.390151 
1 1 1   24    8   34 o   33.352   7.8034   32.202   12.590   37.390   12.990 -48.1427   51.119   39.678   8.2083   27.026   13.274 12.65230 15.60676 
1 1 1   24    8   35 o   37.480   7.8410   30.098   11.608   21.954   13.278   56.502   23.908   29.827   9.5452   45.132   12.442 -15.30517 15.68191 
1 1 1   24    8   36 o   21.472   6.5821   3.4811   10.707   9.0976   12.351 -13.4993   21.476   22.448   8.9210   20.495   9.6805 1.952261 13.16420 
1 1 1   24    8   37 o   63.234   8.7984  115.769   22.132   90.516   32.749  136.999   30.027   53.038   14.538   73.429   9.9148 -20.39102 17.59689 
1 1 1   24    8   38 o   27.427   8.6399   9.9722   19.588   25.294   30.384  -0.9239   25.623   30.831   13.254   24.024   11.087 6.807232 17.27988 
1 1 1   24    8   39 o   40.346   10.314   70.046   26.731   25.855   53.544   84.716   30.850   31.126   14.867   49.566   14.299 -18.44028 20.62794 
1 1 1   24    8   40 o   22.498   10.671  -7.0841   26.627   0.0000   0.0000  -7.0841   26.627  ?   ?    22.498   10.671      ?      ? 
1 1 1   24    9    0 o  114.074   2.2654  269.248   15.047  269.248   15.047  269.248   15.047  114.074   3.2038  114.074   3.2038 0.000000 0.000000 
1 1 1   24    9    1 o  138.374   2.1861  395.512   12.475  404.542   17.746  386.693   17.539  139.936   3.0748  136.811   3.1083 3.124573 4.372123 
1 1 1   24    9    2 o  111.637   2.2426  257.480   10.323  249.722   14.529  265.390   14.670  109.936   3.2042  113.337   3.1383 -3.400764 4.485127 
1 1 1   24    9    3 o   76.480   2.7526  120.485   8.6426  125.798   12.965  116.236   11.595   77.983   4.0309   74.976   3.7494 3.006775 5.505126 
1 1 1   24    9    4 o  165.771   2.3527  569.402   15.974  554.483   23.874  581.495   21.494  163.778   3.5343  167.765   3.1063 -3.987625 4.705344 
1 1 1   24    9    5 o   52.071   3.5735   56.550   7.5307   58.156   9.8295   54.268   11.718   52.998   4.4968   51.143   5.5550 1.855511 7.146996 
1 1 1   24    9    6 o  287.150   2.5766  1705.02   30.516  1705.52   43.109  1704.52   43.203  287.193   3.6394  287.107   3.6484 0.8609009E-01 5.153238 
1 1 1   24    9    7 o   61.173   3.2074   77.911   7.9857   80.179   10.563   74.884   12.200   62.242   4.1148   60.105   4.9213 2.136642 6.414868 
1 1 1   24    9    8 o  293.616   2.8079  1784.65   33.710  1788.37   44.856  1779.82   51.100  294.036   3.6987  293.197   4.2257 0.8395081 5.615777 
1 1 1   24    9    9 o  144.340   2.5231  431.377   15.004  415.875   21.452  446.223   20.993  141.786   3.6684  146.893   3.4651 -5.107071 5.046175 
1 1 1   24    9   10 o  240.488   2.5940  1195.63   25.424  1190.40   33.439  1202.78   39.138  239.926   3.3792  241.051   3.9366 -1.124802 5.188079 
1 1 1   24    9   11 o  198.217   2.4524  808.612   19.747  789.655   25.648  836.207   30.945  195.428   3.1820  201.007   3.7326 -5.579758 4.904814 
1 1 1   24    9   12 o  145.139   2.2106  435.329   13.229  421.448   18.469  449.953   18.957  142.763   3.1367  147.515   3.1158 -4.751511 4.421156 
1 1 1   24    9   13 o  168.222   2.3933  585.251   16.423  587.335   25.177  583.707   21.667  168.442   3.6240  168.002   3.1269 0.4396210 4.786535 
1 1 1   24    9   14 o  104.910   2.7699  225.572   11.418  235.969   19.556  220.194   14.064  106.655   4.4456  103.164   3.3054 3.491234 5.539774 
1 1 1   24    9   15 o  181.642   2.3899  686.631   17.518  664.493   27.565  701.631   22.689  179.099   3.7316  184.185   2.9867 -5.086670 4.779719 
1 1 1   24    9   16 o  106.420   3.5664  242.637   12.548  224.343   27.356  247.511   14.121  103.490   6.4089  109.349   3.1310 -5.859032 7.132844 
1 1 1   24    9   17 o  127.734   2.7063  338.037   13.457  340.185   23.278  336.959   16.492  127.908   4.4125  127.560   3.1347 0.3482285 5.412592 
1 1 1   24    9   18 o   39.461   4.7360   33.914   7.1117   31.364   11.919   35.324   8.8620   37.793   7.9010   41.128   5.2243 -3.334694 9.471971 
1 1 1   24    9   19 o  117.494   2.4830  290.312   11.745  267.296   18.328  306.348   15.298  113.399   3.9187  121.589   3.0505 -8.190544 4.966071 
1 1 1   24    9   20 o   68.989   3.3118   99.234   9.4131  102.628   13.709   96.206   12.948   70.092   4.7422   67.885   4.6244 2.207314 6.623689 
1 1 1   24    9   21 o   94.401   2.9149  185.664   11.323  185.155   16.569  186.110   15.510   94.247   4.2625   94.555   3.9770 -0.3082123 5.829721 
1 1 1   24    9   22 o   47.790   4.4364   48.581   8.6319   39.627   12.151   57.703   12.265   43.210   6.8179   52.370   5.6782 -9.160255 8.872747 
1 1 1   24    9   23 o   69.778   3.7193   99.104   10.522   82.425   13.505  124.868   16.785   62.565   5.2337   76.991   5.2860 -14.42566 7.438605 
1 1 1   24    9   24 o   84.492   3.1639  150.670   10.920  158.988   14.732  140.526   16.269   87.208   4.0957   81.775   4.8235 5.433365 6.327773 
1 1 1   24    9   25 o   71.571   4.2094  113.268   11.611  123.820   14.529   94.615   19.316   76.802   4.5867   66.341   7.0596 10.46062 8.418762 
1 1 1   24    9   26 o   89.518   3.0132  168.007   11.112  160.816   15.852  174.954   15.580   87.592   4.3880   91.445   4.1307 -3.853271 6.026418 
1 1 1   24    9   27 o   27.215   6.2599   16.143   8.1950   12.107   11.893   19.792   11.308   24.870   9.0079   29.559   8.6951 -4.689198 12.51988 
1 1 1   24    9   28 o   57.646   7.5544   94.093   12.687   53.187   29.918  103.062   14.009   45.448   14.305   69.845   4.8630 -24.39647 15.10887 
1 1 1   24    9   29 o   86.343   3.1725  156.664   11.276  166.542   16.586  148.175   15.376   88.848   4.5261   83.838   4.4466 5.009384 6.344906 
1 1 1   24    9   30 o   30.964   6.0018   22.522   8.0605   16.848   11.998   27.190   10.882   27.475   9.0938   34.452   7.8352 -6.976610 12.00369 
1 1 1   24    9   31 o   34.827   5.5441   30.074   8.7882   8.4462   13.327   46.714   11.690   23.231   9.2559   46.423   6.1054 -23.19243 11.08815 
1 1 1   24    9   32 o   35.749   6.0087   30.308   8.7224   28.734   12.808   31.669   11.911   34.669   8.9092   36.829   8.0650 -2.159721 12.01739 
1 1 1   24    9   33 o   17.627   5.3715  -6.1148   8.0737 -20.3499   11.227   9.1326   11.619   12.727   6.2449   22.528   8.7416 -9.800354 10.74309 
1 1 1   24    9   34 o   45.861   9.3726   58.956   13.250   59.056   13.639   57.275   55.849   51.538   6.4163   40.184   17.613 11.35381 18.74528 
1 1 1   24    9   35 o   22.843   7.1432  -0.0720   11.216  -4.3139   12.787   14.072   23.350   17.641   8.0242   28.046   11.820 -10.40473 14.28650 
1 1 1   24    9   36 o   76.512   5.5501  129.607   16.234  117.873   19.301  157.980   30.013   72.372   6.4659   80.651   9.0225 -8.279022 11.10017 
1 1 1   24    9   37 o   22.739   7.5819 -10.1800   18.562 -21.4595   29.443  -2.7397   23.913   22.225   10.721   23.253   10.724 -1.027523 15.16383 
1 1 1   24    9   38 o   31.827   8.4464   18.379   19.806 -32.3171   29.341   60.813   26.845   20.561   10.090   43.092   13.548 -22.53123 16.89271 
1 1 1   24    9   39 f   26.612   8.9106   5.8141   23.856  -9.9604   52.218   9.9750   26.819   27.376   13.440   25.847   11.703 1.528538 17.82111 
1 1 1   24   10    0 o   52.564   3.9315   59.035   11.745   59.035   11.745   59.035   11.745   52.564   5.5600   52.564   5.5600 0.000000 0.000000 
1 1 1   24   10    1 o  197.096   2.4255  799.570   19.468  782.152   25.452  824.130   30.222  194.554   3.1718  199.638   3.6705 -5.084381 4.851059 
1 1 1   24   10    2 o  113.703   2.3953  266.267   11.140  260.047   14.753  274.517   16.992  112.179   3.1887  115.227   3.5753 -3.048317 4.790669 
1 1 1   24   10    3 o  232.104   2.3544  1113.37   22.537  1104.94   31.607  1122.10   32.143  231.212   3.3144  232.996   3.3448 -1.783615 4.708812 
1 1 1   24   10    4 f  295.992   2.6143  1811.88   31.914  1804.34   44.931  1819.55   45.339  295.373   3.6881  296.611   3.7061 -1.237732 5.228519 
1 1 1   24   10    5 o  287.840   2.5789  1713.15   30.610  1696.13   42.798  1730.97   43.798  286.382   3.6233  289.297   3.6707 -2.915283 5.157734 
1 1 1   24   10    6 o  212.793   2.2856  935.853   20.057  928.405   28.125  943.560   28.612  211.933   3.2175  213.652   3.2470 -1.718277 4.571139 
1 1 1   24   10    7 o  133.372   2.3202  368.737   12.693  378.240   17.209  357.395   18.799  135.282   3.0842  131.463   3.4671 3.818573 4.640375 
1 1 1   24   10    8 o   81.613   2.6292  137.890   8.8079  138.632   11.907  136.994   13.089   81.869   3.5264   81.357   3.9007 0.5121613 5.258419 
1 1 1   24   10    9 o   84.284   2.5709  146.768   8.8977  144.801   11.996  149.174   13.266   83.669   3.4763   84.899   3.7885 -1.230225 5.141706 
1 1 1   24   10   10 o   65.695   3.0280   88.013   8.1269   79.512   10.637   99.937   12.597   61.952   4.1627   69.437   4.3985 -7.484360 6.056001 
1 1 1   24   10   11 o   41.369   4.7074   39.440   7.2578   51.852   9.6660   23.398   10.989   49.990   4.6881   32.747   8.1645 17.24306 9.414744 
1 1 1   24   10   12 o  119.118   2.4350  292.710   11.833  287.623   15.562  299.682   18.219  117.923   3.1996  120.313   3.6714 -2.390099 4.869987 
1 1 1   24   10   13 o  135.471   2.5787  379.880   14.404  376.323   20.080  383.651   20.673  134.823   3.6110  136.119   3.6823 -1.295853 5.157402 
1 1 1   24   10   14 o   37.768   5.6250   27.998   7.6471   38.496   15.292   24.498   8.8306   41.871   9.1138   33.666   6.5956 8.205196 11.24998 
1 1 1   24   10   15 o   95.209   3.0031  188.058   10.759  188.601   19.794  187.830   12.817   95.174   5.0426   95.244   3.2629 -0.7037354E-01 6.006187 
1 1 1   24   10   16 o  227.388   2.9380  1078.31   25.891  1061.49   44.924  1086.67   31.681  225.769   4.8245  229.008   3.3542 -3.238998 5.875913 
1 1 1   24   10   17 o   60.847   3.6596   78.155   8.5638   74.793   14.957   79.795   10.445   59.724   6.0720   61.969   4.0868 -2.245251 7.319265 
1 1 1   24   10   18 o  110.591   2.7190  251.728   11.638  260.971   20.509  247.338   14.134  111.938   4.4421  109.245   3.1369 2.692719 5.438064 
1 1 1   24   10   19 o   76.292   2.9262  120.915   8.8542  122.193   14.726  120.192   11.081   76.508   4.6666   76.076   3.5316 0.4315262 5.852310 
1 1 1   24   10   20 o   21.535   5.8773   6.3827   7.4245   9.9637   11.163   3.5421   9.9423   23.665   8.7032   19.406   7.9010 4.258589 11.75469 
1 1 1   24   10   21 o   78.028   3.1630  127.528   10.139  119.905   14.710  134.427   13.994   75.749   4.7083   80.308   4.2250 -4.558899 6.326011 
1 1 1   24   10   22 o   45.678   4.4279   44.270   8.3303   41.470   11.740   47.109   11.822   44.186   6.4422   47.170   6.0765 -2.984085 8.855857 
1 1 1   24   10   23 o   88.238   3.3033  165.613   11.794  177.576   15.621  149.750   17.988   92.168   4.1093   84.308   5.1730 7.860176 6.606554 
1 1 1   24   10   24 o   87.992   4.0424  165.297   13.166  166.995   15.578  161.052   24.630   89.320   4.2287   86.663   6.8906 2.657166 8.084728 
1 1 1   24   10   25 o  100.650   2.9750  212.143   12.320  211.039   18.032  213.109   16.873  100.350   4.3566  100.950   4.0525 -0.5994873 5.950057 
1 1 1   24   10   26 o   48.093   4.4552   49.679   8.7594   42.605   12.442   56.629   12.333   44.550   6.7716   51.635   5.7913 -7.084686 8.910311 
1 1 1   24   10   27 o   43.343   4.9797   41.563   8.5991   38.107   12.734   44.461   11.659   41.149   7.7880   45.537   6.2078 -4.387379 9.959414 
1 1 1   24   10   28 o   44.247   5.9226   47.902   9.8764   32.062   16.279   57.129   12.424   36.782   10.314   51.712   5.8252 -14.93001 11.84524 
1 1 1   24   10   29 o   26.971   6.9834   9.9867   9.0333   27.397   18.851   4.7972   10.292   34.021   11.403   19.922   8.0651 14.09865 13.96688 
1 1 1   24   10   30 o   21.477   5.9962   7.0497   7.7847   5.8727   12.149   7.8696   10.140   21.529   8.7460   21.425   8.2052 0.1031380 11.99237 
1 1 1   24   10   31 o   64.061   3.9460   86.927   10.326  100.120   16.011   77.532   13.511   68.089   5.7015   60.032   5.4567 8.057076 7.891938 
1 1 1   24   10   32 o   24.659   6.4040   12.617   8.5737   10.938   12.416   14.148   11.853   23.865   9.0939   25.453   9.0192 -1.587519 12.80796 
1 1 1   24   10   33 o   19.588   6.4182  -6.2582   10.772  -6.2557   12.490  -6.2657   21.283   16.954   7.7937   22.221   10.199 -5.266289 12.83632 
1 1 1   24   10   34 o   28.726   8.6072   16.165   12.902   18.436   13.316 -18.5876   52.099   27.773   9.5793   29.678   14.303 -1.905094 17.21434 
1 1 1   24   10   35 o   44.831   7.4856   48.847   12.215   45.135   14.081   60.131   24.549   43.490   8.1497   46.172   12.559 -2.681961 14.97116 
1 1 1   24   10   36 o   30.840   7.4123   26.525   13.231   36.915   15.375  -3.1214   25.972   37.639   9.8060   24.041   11.118 13.59851 14.82461 
1 1 1   24   10   37 o   42.826   9.5428   60.549   20.108   42.220   30.671   74.365   26.630   35.745   14.105   49.907   12.858 -14.16190 19.08560 
1 1 1   24   10   38 o   25.722   8.2261   5.9476   19.562 -13.5708   30.066   20.276   25.760   22.948   11.009   28.496   12.226 -5.548079 16.45219 
1 1 1   24   10   39 o   25.063   8.5759  -5.1582   22.861   1.3381   48.896  -6.9755   25.862   27.821   13.514   22.304   10.561 5.517071 17.15176 
1 1 1   24   11    0 o  151.891   2.1726  476.855   19.230  476.855   19.230  476.855   19.230  151.891   3.0725  151.891   3.0725 0.000000 0.000000 
1 1 1   24   11    1 o   85.537   2.4371  151.155   8.5803  164.899   12.329  138.245   11.949   89.311   3.3470   81.763   3.5432 7.548096 4.874116 
1 1 1   24   11    2 f  230.795   2.3439  1100.99   22.309  1088.79   31.284  1113.62   31.824  229.496   3.3051  232.094   3.3244 -2.598083 4.687783 
1 1 1   24   11    3 f   33.784   4.6196   24.505   6.2553   31.553   8.9243   17.699   8.7704   38.980   5.5510   28.588   7.3858 10.39214 9.239223 
1 1 1   24   11    4 o  208.895   2.4612  900.005   20.926  917.072   32.461  887.868   27.373  210.540   3.7382  207.249   3.2023 3.290771 4.922307 
1 1 1   24   11    5 o  245.270   2.6016  1244.07   26.031  1247.71   39.892  1241.37   34.353  245.526   3.9393  245.015   3.3994 0.5109558 5.203267 
1 1 1   24   11    6 o  155.061   2.3152  497.685   14.709  502.168   19.753  492.106   22.039  155.870   3.0726  154.253   3.4641 1.617004 4.630428 
1 1 1   24   11    7 o  202.002   2.4129  844.409   19.936  847.649   26.566  840.232   30.163  202.484   3.1810  201.520   3.6290 0.9645233 4.825849 
1 1 1   24   11    8 o  271.148   2.6928  1521.31   29.835  1517.44   39.570  1526.40   45.419  270.818   3.5426  271.479   4.0564 -0.6605225 5.385550 
1 1 1   24   11    9 o   97.502   2.4548  196.269   9.8230  192.581   13.194  200.856   14.713   96.490   3.3154   98.513   3.6212 -2.022675 4.909647 
1 1 1   24   11   10 o   80.404   2.7438  134.046   8.9760  134.832   11.786  132.959   13.851   80.714   3.5403   80.094   4.1928 0.6202393 5.487568 
1 1 1   24   11   11 o   83.525   2.6747  144.766   9.0954  146.338   11.978  142.625   13.978   84.091   3.4536   82.960   4.0851 1.131454 5.349335 
1 1 1   24   11   12 o   78.062   2.8245  128.256   8.9051  114.829   13.631  138.254   11.762   74.397   4.4424   81.727   3.4893 -7.330231 5.648910 
1 1 1   24   11   13 o   57.737   3.2662   69.600   7.7106   66.100   11.519   72.442   10.379   56.384   4.9533   59.090   4.2586 -2.705818 6.532305 
1 1 1   24   11   14 o  137.992   2.7563  400.829   14.399  380.006   25.836  410.211   17.342  135.187   4.6337  140.796   2.9863 -5.608566 5.512612 
1 1 1   24   11   15 o  128.249   2.7897  339.682   13.513  345.797   24.796  337.098   16.116  128.899   4.6640  127.600   3.0622 1.299774 5.579473 
1 1 1   24   11   16 o  100.554   2.8442  210.049   11.791  202.511   16.604  217.717   16.747   98.724   4.0779  102.384   3.9659 -3.660233 5.688358 
1 1 1   24   11   17 o   19.613   5.6154   4.0402   6.8931  -1.2448   12.421   6.3923   8.2861   19.332   8.3923   19.893   7.4632 -0.5615044 11.23078 
1 1 1   24   11   18 o   35.048   5.5555   28.212   7.8911   19.770   12.638   33.606   10.102   30.143   9.2666   39.953   6.1307 -9.809963 11.11102 
1 1 1   24   11   19 f  144.716   2.4702  438.991   14.537  407.841   22.027  463.027   19.350  140.026   3.8140  149.406   3.1401 -9.379456 4.940338 
1 1 1   24   11   20 o   23.851   5.5579   9.3729   7.3698  -2.2143   10.550   20.417   10.300   17.355   7.6297   30.346   8.0839 -12.99078 11.11585 
1 1 1   24   11   21 o   92.492   2.9419  178.675   11.204  175.218   16.220  181.830   15.495   91.600   4.2934   93.383   4.0231 -1.783501 5.883748 
1 1 1   24   11   22 o   63.062   3.5386   83.715   9.1968   80.623   13.073   86.745   12.940   61.879   5.1225   64.246   4.8835 -2.366718 7.077278 
1 1 1   24   11   23 o   37.022   6.4153   31.467   9.4591   32.314   11.789   29.938   15.848   38.028   7.7789   36.016   10.204 2.012154 12.83067 
1 1 1   24   11   24 o  105.269   4.5691  245.962   16.068  253.410   18.231  220.048   34.007  110.095   4.0149  100.442   8.2089 9.653419 9.138127 
1 1 1   24   11   25 o  108.385   2.9703  244.326   13.134  256.556   20.314  235.541   17.217  110.600   4.4532  106.170   3.9318 4.430382 5.940579 
1 1 1   24   11   26 o  100.783   2.8382  211.731   11.764  227.749   17.454  198.396   15.926  104.239   4.0598   97.326   3.9674 6.913559 5.676432 
1 1 1   24   11   27 o   37.582   5.9959   32.041   8.8290   33.472   14.565   31.210   11.101   37.903   9.3702   37.260   7.4833 0.6428375 11.99172 
1 1 1   24   11   28 o   62.993   3.7997   85.390   9.7542   76.498   14.425   92.881   13.240   59.753   5.8532   66.233   4.8467 -6.479843 7.599396 
1 1 1   24   11   29 o   26.028   6.9125   12.664   9.2949   14.631   17.630   11.906   10.939   27.876   10.782   24.179   8.6539 3.696894 13.82505 
1 1 1   24   11   30 o   81.044   3.2847  139.492   10.967  138.723   15.864  140.195   15.178   80.770   4.7620   81.317   4.5256 -0.5462494 6.569416 
1 1 1   24   11   31 o   81.649   3.4688  142.239   11.591  144.361   17.556  140.599   15.433   82.017   5.1900   81.281   4.6036 0.7365723 6.937533 
1 1 1   24   11   32 o   52.480   4.4980   60.549   9.7130   60.359   14.204   60.716   13.312   52.286   6.5865   52.674   6.1274 -0.3886757 8.995944 
1 1 1   24   11   33 o   44.398   6.9564   51.521   11.996   56.580   14.577   40.908   21.115   50.081   7.0570   38.714   11.990 11.36713 13.91278 
1 1 1   24   11   34 o   44.660   7.1374   52.469   11.782   55.324   13.671   44.220   23.235   49.710   6.6677   39.609   12.622 10.10180 14.27470 
1 1 1   24   11   35 o   23.929   7.2395   6.4196   10.891   3.9701   12.397   14.702   22.797   20.152   8.5592   27.706   11.678 -7.554344 14.47896 
1 1 1   24   11   36 o   27.695   7.9291   16.734   12.954   14.532   15.241   22.464   24.584   25.512   9.9806   29.877   12.324 -4.365820 15.85820 
1 1 1   24   11   37 o   23.363   7.3024   2.2180   12.249  -3.9000   14.279   19.263   23.833   18.317   8.3878   28.409   11.956 -10.09256 14.60480 
1 1 1   24   11   38 f   24.200   7.9094  -1.3828   19.458 -23.3353   29.387   15.754   25.964   21.301   10.377   27.099   11.940 -5.797485 15.81871 
1 1 1   24   11   39 o   26.696   8.5182   12.124   19.787   24.701   29.982   2.4181   26.337   29.322   12.877   24.070   11.154 5.251749 17.03631 
1 1 1   24   12    0 o   52.811   3.1622   58.878   9.5801   58.878   9.5801   58.878   9.5801   52.811   4.4720   52.811   4.4720 0.000000 0.000000 
1 1 1   24   12    1 o  113.881   2.2082  267.965   10.369  277.286   14.818  259.024   14.513  115.822   3.1020  111.940   3.1435 3.882500 4.416372 
1 1 1   24   12    2 o  105.976   2.2412  232.162   9.7956  235.572   13.904  228.801   13.803  106.750   3.1579  105.202   3.1811 1.547318 4.482386 
1 1 1   24   12    3 o   72.969   2.9822  114.380   8.6214   91.438   13.333  130.867   11.302   66.394   4.8688   79.545   3.4451 -13.15092 5.964337 
1 1 1   24   12    4 o   58.353   2.9603   70.681   7.0773   60.656   9.9045   81.141   10.116   54.100   4.4389   62.606   3.9179 -8.506302 5.920567 
1 1 1   24   12    5 o  160.544   2.5055  532.909   16.571  497.792   23.134  569.916   23.748  155.105   3.6162  165.983   3.4690 -10.87874 5.011089 
1 1 1   24   12    6 o  177.136   2.3418  648.904   16.974  648.509   22.629  649.412   25.667  177.107   3.0979  177.166   3.5126 -0.5868530E-01 4.683512 
1 1 1   24   12    7 o  103.012   2.4139  219.139   10.197  215.949   13.659  223.155   15.324  102.183   3.2410  103.840   3.5781 -1.657745 4.827727 
1 1 1   24   12    8 o   46.810   3.6279   45.586   6.9847   46.406   9.5783   44.656   10.207   47.274   4.9125   46.346   5.3400 0.9287605 7.255877 
1 1 1   24   12    9 f  257.480   2.8400  1373.63   30.160  1379.67   42.643  1367.59   42.661  258.049   4.0067  256.911   4.0261 1.137970 5.680030 
1 1 1   24   12   10 o   62.304   3.3429   80.568   8.5888   79.622   12.011   81.558   12.286   61.932   4.7022   62.676   4.7528 -0.7440987 6.685788 
1 1 1   24   12   11 o  181.941   2.3761  682.204   17.650  665.536   23.234  704.950   27.141  179.366   3.1407  184.517   3.5664 -5.151581 4.752136 
1 1 1   24   12   12 o   85.018   2.7257  150.129   9.5304  145.563   13.887  154.194   13.103   83.774   4.0191   86.261   3.6829 -2.487518 5.451362 
1 1 1   24   12   13 o   31.859   5.7343   23.437   7.3513   15.347   14.111   26.450   8.6123   28.149   9.8523   35.570   5.8705 -7.420139 11.46868 
1 1 1   24   12   14 o  104.766   4.1209  240.369   12.852  214.066   31.644  245.565   14.064  100.638   7.6237  108.894   3.1315 -8.256325 8.241823 
1 1 1   24   12   15 o  119.636   2.8389  300.699   12.812  288.936   23.210  305.853   15.364  117.751   4.7791  121.521   3.0655 -3.770203 5.677734 
1 1 1   24   12   16 o   57.007   3.3657   67.054   7.7266   71.109   12.499   64.546   9.8299   58.325   5.1956   55.689   4.2797 2.636303 6.731308 
1 1 1   24   12   17 o   68.182   3.2911   95.021   8.5794  102.387   15.600   91.827   10.272   69.894   5.4116   66.470   3.7469 3.423714 6.582170 
1 1 1   24   12   18 o   21.995   5.7288   5.6125   6.5998   15.696   12.114   1.3559   7.8705   27.454   9.1400   16.535   6.9091 10.91903 11.45751 
1 1 1   24   12   19 o   22.063   5.5373   9.2474   6.4593   3.3212   11.078   12.300   7.9506   20.149   8.2873   23.977   7.3463 -3.827963 11.07460 
1 1 1   24   12   20 o   65.859   3.4608   90.839   9.3234  106.865   13.480   76.140   12.909   71.492   4.5716   60.225   5.1970 11.26662 6.921588 
1 1 1   24   12   21 o   86.388   3.0383  156.636   10.776  139.938   15.268  173.210   15.211   81.716   4.5301   91.059   4.0502 -9.342659 6.076694 
1 1 1   24   12   22 o   41.193   5.1106   37.139   8.4582   33.490   12.024   40.712   11.900   38.730   7.7973   43.656   6.6088 -4.926064 10.22125 
1 1 1   24   12   23 o   21.233   6.1627   2.3696   9.5589   11.460   11.125 -23.2712   18.684   24.296   8.7240   18.170   8.7069 6.126104 12.32548 
1 1 1   24   12   24 o   60.496   7.0559   82.497   12.353   82.352   13.482   83.256   30.847   62.470   5.2325   58.522   13.106 3.947788 14.11184 
1 1 1   24   12   25 o   17.577   5.4069  -2.1785   7.5047   3.6482   10.936  -7.3647   10.317   19.955   8.2238   15.200   7.0218 4.755121 10.81372 
1 1 1   24   12   26 o   85.563   3.1305  153.866   11.040  158.911   15.975  149.253   15.276   86.893   4.4574   84.234   4.3969 2.659119 6.261084 
1 1 1   24   12   27 o   42.212   5.5307   37.310   9.2010   52.589   15.309   28.669   11.512   48.996   7.5756   35.429   8.0601 13.56697 11.06141 
1 1 1   24   12   28 o   54.877   4.1692   64.430   9.4172   68.684   13.869   60.792   12.828   56.532   5.9482   53.222   5.8437 3.309666 8.338440 
1 1 1   24   12   29 o   90.093   3.6616  171.216   12.855  179.117   22.339  167.303   15.719   91.155   5.9418   89.030   4.2807 2.124886 7.323201 
1 1 1   24   12   30 o   24.847   5.4521   6.4208   7.9676   29.542   12.344 -10.0925   10.432   35.367   8.5554   14.327   6.7608 21.04053 10.90424 
1 1 1   24   12   31 o   55.527   4.3751   68.564   9.8047   59.059   14.721   76.142   13.145   51.615   6.9150   59.438   5.3619 -7.823601 8.750227 
1 1 1   24   12   32 o   29.780   6.6474   21.560   9.1919   18.788   13.157   24.204   12.847   28.129   9.5258   31.430   9.2744 -3.301285 13.29488 
1 1 1   24   12   33 o   33.788   7.4620   30.425   11.570   33.778   13.810   22.533   21.189   37.004   9.1097   30.573   11.821 6.431818 14.92399 
1 1 1   24   12   34 o   27.609   6.8367   18.653   10.872   26.842   12.746  -3.2134   20.828   32.827   9.0988   22.392   10.207 10.43540 13.67342 
1 1 1   24   12   35 o   52.704   7.6423   64.971   16.613   64.971   16.613   0.0000   0.0000   52.704   7.6423  ?   ?       ?      ? 
1 1 1   24   12   36 o   22.740   7.2211   2.0878   11.825  -0.2332   13.403   10.244   25.124   18.993   8.4616   26.488   11.704 -7.494881 14.44222 
1 1 1   24   12   37 o   32.644   8.2905   30.277   13.279   28.070   15.570   36.162   25.429   31.771   10.352   33.516   12.952 -1.744362 16.58106 
1 1 1   24   12   38 o   33.086   13.555   38.712   29.494   38.712   29.494   0.0000   0.0000   33.086   13.555  ?   ?       ?      ? 
1 1 1   24   13    0 o   25.980   6.2297   18.114   8.4550   18.114   8.4550   18.114   8.4550   25.980   8.8101   25.980   8.8101 0.000000 0.000000 
1 1 1   24   13    1 o   38.037   4.2257   30.900   6.3371   23.693   8.8925   38.337   9.0332   33.109   6.7411   42.966   5.0974 -9.856880 8.451384 
1 1 1   24   13    2 o   36.296   4.2959   27.895   6.2644   31.000   8.9239   24.878   8.7959   38.607   5.6043   33.985   6.5123 4.622574 8.591728 
1 1 1   24   13    3 o  282.561   2.5478  1652.37   29.692  1648.53   41.899  1656.26   42.082  282.231   3.5994  282.890   3.6068 -0.6587524 5.095522 
1 1 1   24   13    4 o  103.523   2.2847  221.641   9.7540  226.409   13.850  216.950   13.739  104.629   3.2095  102.416   3.2525 2.212914 4.569413 
1 1 1   24   13    5 o   74.394   2.6800  114.474   8.1990  113.004   11.143  116.209   12.107   73.884   3.6568   74.903   3.9188 -1.019051 5.359972 
1 1 1   24   13    6 o   98.117   2.4191  199.146   9.7495  198.569   13.195  199.840   14.468   97.975   3.2653   98.258   3.5701 -0.2833862 4.838222 
1 1 1   24   13    7 o  195.462   2.3953  785.866   19.077  761.776   24.937  819.862   29.623  191.917   3.1504  199.008   3.6090 -7.091980 4.790624 
1 1 1   24   13    8 o  174.597   2.1980  630.372   15.827  638.462   22.564  622.537   22.205  175.699   3.1138  173.495   3.1031 2.203278 4.396015 
1 1 1   24   13    9 o  109.684   2.6698  249.494   12.063  237.896   17.176  260.783   16.946  107.150   3.8864  112.216   3.6614 -5.065887 5.339505 
1 1 1   24   13   10 o  199.939   2.9120  814.130   23.377  767.202   29.474  893.724   38.385  192.421   3.7138  207.456   4.4861 -15.03505 5.823905 
1 1 1   24   13   11 o   66.570   2.7510   92.063   7.5295   83.351   10.610  100.901   10.687   63.375   4.0591   69.765   3.7141 -6.389393 5.501905 
1 1 1   24   13   12 o  216.850   2.4934  976.878   22.129  957.013   33.244  992.680   29.652  214.792   3.7526  218.908   3.2842 -4.115860 4.986777 
1 1 1   24   13   13 o   35.063   5.7101   29.967   7.4994   17.878   14.987   34.005   8.6618   29.758   10.166   40.368   5.2025 -10.60981 11.42022 
1 1 1   24   13   14 o   99.365   4.1573  211.083   12.286  200.852   30.804  213.018   13.398   97.342   7.6726  101.388   3.2039 -4.046448 8.314670 
1 1 1   24   13   15 o   29.715   5.9591   20.152   7.3413   14.452   14.099   22.272   8.5991   27.513   9.8271   31.917   6.7435 -4.403843 11.91830 
1 1 1   24   13   16 o  125.097   2.8468  328.417   13.631  318.199   24.109  333.218   16.527  123.437   4.7355  126.757   3.1612 -3.320145 5.693671 
1 1 1   24   13   17 o   71.605   3.0424  107.701   8.7318  103.356   13.959  110.494   11.192   70.312   4.8134   72.899   3.7224 -2.586655 6.084813 
1 1 1   24   13   18 o   93.926   2.8950  182.244   10.432  187.828   18.661  179.706   12.581   94.799   4.7726   93.054   3.2781 1.744743 5.790007 
1 1 1   24   13   19 o   23.209   5.1930   11.317   6.7266  -8.1670   12.820   18.719   7.9017   17.278   7.9252   29.141   6.7127 -11.86290 10.38600 
1 1 1   24   13   20 o   39.655   5.2216   35.824   8.1707   18.343   11.459   53.906   11.654   28.798   8.8187   50.511   5.5940 -21.71275 10.44328 
1 1 1   24   13   21 o   75.076   3.2424  118.044   10.032  123.638   14.530  112.947   13.868   76.772   4.5888   73.379   4.5821 3.392372 6.484792 
1 1 1   24   13   22 o   76.157   3.3046  122.022   10.361  126.732   14.427  117.005   14.890   77.727   4.5003   74.586   4.8403 3.141174 6.609178 
1 1 1   24   13   23 o   53.051   5.2817   64.899   10.336   72.929   12.954   50.833   17.146   58.757   5.3454   47.345   9.1111 11.41211 10.56340 
1 1 1   24   13   24 o   87.165   3.5305  157.896   12.483  148.098   16.053  172.884   19.853   83.927   4.6374   90.403   5.3246 -6.475876 7.060986 
1 1 1   24   13   25 o   68.214   3.4719   98.300   9.7605   99.516   14.118   97.187   13.509   68.590   4.9905   67.837   4.8282 0.7528915 6.943868 
1 1 1   24   13   26 o   51.500   4.5443   54.894   9.3956   66.867   15.624   48.112   11.759   55.596   6.8139   47.404   6.0145 8.191933 9.088606 
1 1 1   24   13   27 o  108.561   2.8741  247.292   12.856  233.917   17.773  261.970   18.619  105.477   4.0854  111.645   4.0435 -6.167519 5.748104 
1 1 1   24   13   28 f   50.113   4.4299   53.892   9.0949   63.298   13.444   45.956   12.350   54.206   6.0134   46.020   6.5064 8.186150 8.859732 
1 1 1   24   13   29 o   61.722   4.7219   83.660   11.242   83.016   19.592   83.976   13.726   60.873   7.8036   62.570   5.3186 -1.697113 9.443715 
1 1 1   24   13   30 o   45.993   6.3748   54.317   10.961   63.288   13.494   36.911   18.796   53.899   6.0699   38.087   11.212 15.81271 12.74953 
1 1 1   24   13   31 o   57.509   5.0533   72.281   11.576   67.536   14.422   80.876   19.408   55.416   6.3099   59.602   7.8948 -4.186218 10.10660 
1 1 1   24   13   32 o   25.619   6.8886   12.419   11.581   23.206   13.957 -11.4209   20.749   30.535   9.7880   20.703   9.6956 9.831133 13.77717 
1 1 1   24   13   33 o   20.770   6.5598  -0.1048   11.009   3.1597   13.137  -7.8048   20.176   20.409   8.7429   21.131   9.7818 -0.7216892 13.11952 
1 1 1   24   13   34 o   35.901   7.3737   35.586   11.441   38.647   13.438   27.517   21.816   39.799   8.4476   32.004   12.088 7.794762 14.74733 
1 1 1   24   13   35 o   25.709   9.9359   15.100   14.964   15.100   14.964   0.0000   0.0000   25.709   9.9359  ?   ?       ?      ? 
1 1 1   24   13   36 f   25.718   7.2318   14.378   12.826   23.546   14.640 -15.8714   26.595   29.716   10.049   21.721   10.403 7.994883 14.46355 
1 1 1   24   13   37 f   30.392   8.1274   19.070   13.004   7.8837   15.145   50.448   25.366   22.222   9.4500   38.562   13.226 -16.34052 16.25477 
1 1 1   24   13   38 o   20.782   7.1476 -20.9783   18.566  -8.4257   29.838 -28.9091   23.717   23.221   11.093   18.344   9.0161 4.876850 14.29524 
1 1 1   24   14    0 o   60.744   2.8986   77.311   10.163   77.311   10.163   77.311   10.163   60.744   4.0993   60.744   4.0993 0.000000 0.000000 
1 1 1   24   14    1 o  158.965   2.1655  522.545   14.198  525.065   20.128  520.050   20.031  159.347   3.0626  158.584   3.0625 0.7627716 4.331056 
1 1 1   24   14    2 o  123.774   2.4034  320.798   12.091  289.815   18.177  345.388   16.193  118.307   3.7251  129.240   3.0379 -10.93359 4.806817 
1 1 1   24   14    3 o   51.576   3.1619   55.202   6.7228   57.036   9.4902   53.354   9.5249   52.442   4.3876   50.710   4.5541 1.732334 6.323878 
1 1 1   24   14    4 o   99.432   2.4162  203.722   9.8630  196.107   13.225  213.264   14.805   97.360   3.2935  101.505   3.5364 -4.144722 4.832489 
1 1 1   24   14    5 o  140.665   2.2910  409.397   13.197  409.836   17.650  408.842   19.876  140.777   3.0398  140.553   3.4286 0.2241058 4.582101 
1 1 1   24   14    6 o  140.610   2.3044  408.979   13.284  408.190   17.827  409.963   19.919  140.483   3.0767  140.737   3.4315 -0.2542572 4.608871 
1 1 1   24   14    7 o  201.396   2.2596  839.206   18.769  845.761   26.652  832.757   26.436  202.176   3.1963  200.616   3.1949 1.559967 4.519242 
1 1 1   24   14    8 o   78.784   2.4992  128.616   8.1176  124.517   11.497  132.691   11.463   77.526   3.5956   80.042   3.4723 -2.516388 4.998497 
1 1 1   24   14    9 o  144.793   2.3567  433.522   13.889  430.051   18.193  438.371   21.504  144.148   3.0601  145.438   3.5848 -1.290146 4.713312 
1 1 1   24   14   10 o   58.664   3.1343   71.032   7.5077   68.098   9.8554   75.088   11.589   57.258   4.1732   60.070   4.6776 -2.811638 6.268597 
1 1 1   24   14   11 o  117.956   2.4917  292.330   11.900  264.974   18.153  312.944   15.757  112.982   3.8955  122.930   3.1079 -9.947876 4.983363 
1 1 1   24   14   12 o   42.538   5.3814   45.661   7.5248   27.360   14.955   51.865   8.7072   35.130   9.8981   49.946   4.2268 -14.81551 10.76283 
1 1 1   24   14   13 o   52.432   6.0707   50.362   8.5375   73.631   25.539   47.434   9.0587   57.153   11.235   47.711   4.6034 9.441956 12.14142 
1 1 1   24   14   14 o   17.452   5.7498  -3.0965   7.0357 -36.7640   23.555   0.2016   7.3722   19.436   9.4271   15.467   6.5858 3.968244 11.49963 
1 1 1   24   14   15 o  148.807   2.4166  461.589   14.589  449.034   22.612  470.542   19.094  146.971   3.7304  150.643   3.0732 -3.671951 4.833200 
1 1 1   24   14   16 o   36.179   4.8046   27.266   6.6571   31.306   11.651   25.308   8.1116   37.656   7.7598   34.701   5.6675 2.954369 9.609114 
1 1 1   24   14   17 o  101.297   2.5603  212.079   10.375  218.084   16.973  208.498   13.108  102.343   4.0211  100.250   3.1703 2.092903 5.120535 
1 1 1   24   14   18 o   26.504   5.8674   14.165   6.5844   17.867   12.462   12.731   7.7554   28.779   9.2512   24.229   7.2194 4.549984 11.73476 
1 1 1   24   14   19 o   59.942   3.7049   76.444   8.2493   73.933   15.328   77.468   9.7876   58.958   6.3035   60.927   3.8950 -1.968685 7.409746 
1 1 1   24   14   20 o   42.033   5.0797   40.753   8.1740   25.404   12.004   54.023   11.162   33.471   8.6373   50.594   5.3489 -17.12248 10.15938 
1 1 1   24   14   21 o   86.033   3.4781  158.713   11.825  144.587   19.241  167.287   14.990   82.624   5.6461   89.443   4.0634 -6.819016 6.956292 
1 1 1   24   14   22 o   28.871   5.8908   18.595   8.1013   7.5245   12.063   27.690   10.934   22.614   8.8703   35.129   7.7540 -12.51501 11.78159 
1 1 1   24   14   23 o   69.502   4.8100  101.677   13.788  101.677   13.788   0.0000   0.0000   69.502   4.8100  ?   ?       ?      ? 
1 1 1   24   14   24 o   28.905   6.0005   18.884   8.5918   29.075   11.341   5.1558   13.163   35.802   7.8926   22.008   9.0405 13.79449 12.00101 
1 1 1   24   14   25 o   56.408   3.9371   67.551   9.1434   73.394   13.296   62.309   12.594   58.741   5.4879   54.075   5.6469 4.665844 7.874293 
1 1 1   24   14   26 o   41.511   5.6527   39.352   9.0691   36.510   15.007   40.988   11.383   39.434   9.3659   43.587   6.3318 -4.153072 11.30538 
1 1 1   24   14   27 o   38.899   5.4590   33.932   8.5870   39.908   12.427   28.472   11.879   42.722   7.0524   35.076   8.3345 7.646111 10.91790 
1 1 1   24   14   28 o   28.301   6.2130   18.600   8.0195   16.933   12.106   19.903   10.705   27.365   9.1383   29.237   8.4201 -1.871937 12.42605 
1 1 1   24   14   29 o   23.111   6.3887   9.4163   8.8961  -4.4398   18.134   13.808   10.209   21.300   9.6357   24.921   8.3913 -3.621405 12.77739 
1 1 1   24   14   30 o   38.442   5.5061   34.298   8.5184   30.782   12.663   37.205   11.513   35.907   8.6522   40.976   6.8123 -5.068920 11.01219 
1 1 1   24   14   31 o   26.758   6.4743   16.630   8.5961   18.932   12.625   14.640   11.737   28.088   9.3300   25.429   8.9787 2.659607 12.94854 
1 1 1   24   14   32 o   28.483   7.0274   19.210   11.660   29.774   14.326  -1.5225   20.069   34.386   9.6873   22.580   10.183 11.80552 14.05478 
1 1 1   24   14   33 o   24.343   7.4945   7.7018   12.754   14.268   13.322 -64.3665   44.135   25.345   9.4720   23.340   11.617 2.005825 14.98909 
1 1 1   24   14   34 o   29.230   7.8049   21.865   13.358   28.125   17.268   12.537   21.079   32.182   10.913   26.278   11.161 5.904005 15.60972 
1 1 1   24   14   35 o   49.703   7.9864   58.944   16.372   58.944   16.372   0.0000   0.0000   49.703   7.9864  ?   ?       ?      ? 
1 1 1   24   14   36 o   17.145   5.9094 -16.6261   11.376 -16.6433   13.195 -16.5761   22.455   14.568   7.0638   19.723   9.4756 -5.154280 11.81883 
1 1 1   24   14   37 o   28.748   7.9403   23.343   13.280   24.029   15.943   21.788   24.002   29.190   10.448   28.306   11.960 0.8832760 15.88056 
1 1 1   24   15    0 o   84.794   2.4208  149.274   11.929  149.274   11.929  149.274   11.929   84.794   3.4236   84.794   3.4236 0.000000 0.000000 
1 1 1   24   15    1 o   88.689   2.3739  162.708   8.6769  153.999   12.127  171.845   12.421   86.254   3.4088   91.125   3.3048 -4.870842 4.747753 
1 1 1   24   15    2 f  154.050   2.1630  490.706   13.740  480.734   19.206  501.162   19.666  152.448   3.0545  155.652   3.0634 -3.203888 4.325985 
1 1 1   24   15    3 o  118.446   2.2088  290.274   10.790  292.220   15.234  288.315   15.286  118.846   3.1079  118.046   3.1396 0.8007050 4.417698 
1 1 1   24   15    4 o   70.123   2.7518  102.263   7.9268  106.433   10.879   97.545   11.573   71.671   3.6804   68.575   4.0919 3.095825 5.503519 
1 1 1   24   15    5 o   72.341   2.6858  108.372   7.9867  107.093   10.830  109.896   11.825   71.888   3.6528   72.793   3.9385 -0.9056625 5.371670 
1 1 1   24   15    6 o   49.430   3.2669   50.852   6.6524   48.350   9.4479   53.311   9.3685   48.211   4.7514   50.648   4.4848 -2.436642 6.533704 
1 1 1   24   15    7 o   87.658   2.3847  159.088   8.6135  169.034   12.342  149.643   12.027   90.334   3.3126   84.981   3.4314 5.353172 4.769417 
1 1 1   24   15    8 o   27.613   5.1273   16.589   5.9388   14.287   8.2589   19.054   8.5458   25.720   7.3925   29.507   7.1067 -3.787121 10.25450 
1 1 1   24   15    9 f   66.954   2.9178   93.494   7.9503   95.477   10.490   90.817   12.186   67.834   3.7495   66.073   4.4717 1.761497 5.835644 
1 1 1   24   15   10 o   41.512   3.6391   35.973   6.2302   35.609   8.8366   36.332   8.7853   41.300   5.1877   41.725   5.1050 -0.4248848 7.278274 
1 1 1   24   15   11 o   60.589   3.3467   79.157   7.9052   67.666   12.994   85.909   9.9603   56.857   5.5413   64.322   3.7544 -7.465279 6.693406 
1 1 1   24   15   12 o   84.515   3.2493  153.403   9.9954  139.210   18.889  158.923   11.780   81.488   5.6203   87.542   3.2625 -6.053650 6.498564 
1 1 1   24   15   13 o   38.638   6.5585   40.732   8.1787   14.543   23.278   44.420   8.7357   31.139   12.287   46.138   4.5907 -14.99930 13.11700 
1 1 1   24   15   14 o  115.659   2.8961  286.112   12.409  261.084   22.839  296.594   14.781  111.709   4.9571  119.609   2.9962 -7.899521 5.792258 
1 1 1   24   15   15 o   88.005   2.6838  160.815   9.4432  162.150   15.397  160.010   11.956   88.207   4.2322   87.803   3.3015 0.4034500 5.367639 
1 1 1   24   15   16 o   50.233   3.9436   56.692   7.4170   43.155   12.633   63.811   9.1622   45.112   6.7898   55.354   4.0132 -10.24143 7.887152 
1 1 1   24   15   17 o  105.842   2.5439  233.918   10.764  230.000   17.442  236.327   13.679  105.001   4.0275  106.683   3.1089 -1.681938 5.087801 
1 1 1   24   15   18 o   77.939   3.1432  131.176   9.2421  117.077   16.373  137.768   11.196   74.505   5.3283   81.373   3.3360 -6.868126 6.286475 
1 1 1   24   15   19 o   52.794   3.9623   62.076   7.7218   51.437   13.843   66.882   9.3037   49.007   6.8487   56.581   3.9868 -7.574036 7.924544 
1 1 1   24   15   20 o   13.535   4.5299 -10.4900   6.7129 -13.3799   10.154  -8.2465   8.9468   13.435   6.4327   13.636   6.3797 -0.2013454 9.059797 
1 1 1   24   15   21 o   59.655   3.8462   75.244   9.4600   74.971   13.540   75.505   13.222   59.528   5.5149   59.781   5.3626 -0.2528496 7.692346 
1 1 1   24   15   22 o   24.032   5.3626   9.6185   7.4408  -6.1581   11.021   22.835   10.087   16.233   7.4090   31.830   7.7549 -15.59715 10.72530 
1 1 1   24   15   23 o   79.406   3.7121  128.843   11.803  114.854   14.721  154.029   19.752   73.752   4.8393   85.059   5.6301 -11.30659 7.424114 
1 1 1   24   15   24 o   34.452   5.8955   27.101   8.3629   33.177   12.067   21.486   11.601   38.279   7.9047   30.624   8.7489 7.655092 11.79099 
1 1 1   24   15   25 o   25.356   6.7087   12.268   9.4676   11.106   13.704   13.329   13.096   24.903   9.5383   25.808   9.4364 -0.9043713 13.41730 
1 1 1   24   15   26 o   28.252   5.8017   18.105   8.0497   5.5532   12.080   28.128   10.796   21.387   8.7085   35.118   7.6682 -13.73127 11.60345 
1 1 1   24   15   27 o   64.120   3.9912   88.807   10.313   86.157   16.257   90.592   13.341   63.018   6.2547   65.221   4.9595 -2.203110 7.982400 
1 1 1   24   15   28 o   51.169   5.3153   62.665   10.073   45.634   16.048   73.738   12.940   43.773   9.1820   58.565   5.3573 -14.79177 10.63058 
1 1 1   24   15   29 o   33.824   7.1474   25.794   9.8366   35.073   18.951   22.372   11.508   37.004   11.342   30.644   8.6998 6.359688 14.29471 
1 1 1   24   15   30 o   17.429   5.5344  -3.0843   8.3025  -0.6044   11.965  -5.3870   11.530   18.387   8.1029   16.471   7.5407 1.915335 11.06884 
1 1 1   24   15   31 o   26.937   6.5420   15.811   8.9127   24.412   13.862   9.7496   11.637   31.247   9.7211   22.627   8.7572 8.619564 13.08395 
1 1 1   24   15   32 o   59.994   6.1237   89.430   13.305   97.626   16.399   73.640   22.762   66.481   5.9807   53.507   10.688 12.97355 12.24744 
1 1 1   24   15   33 o   55.135   6.2861   74.694   12.810   75.863   15.613   72.287   22.409   57.931   6.5346   52.340   10.740 5.590965 12.57216 
1 1 1   24   15   34 o   63.185   6.1124   89.298   14.994   74.956   17.915  122.845   27.398   56.401   7.7011   69.969   9.4941 -13.56872 12.22477 
1 1 1   24   15   35 o   28.603   8.0361   20.158   13.199   17.305   15.687   27.074   24.422   26.482   10.190   30.724   12.429 -4.241039 16.07226 
1 1 1   24   15   36 o   48.132   7.9116   69.047   15.449   74.974   19.262   58.361   25.865   54.736   8.5321   41.528   13.326 13.20870 15.82325 
1 1 1   24   16    0 o  165.894   2.1725  569.209   21.006  569.209   21.006  569.209   21.006  165.894   3.0724  165.894   3.0724 0.000000 0.000000 
1 1 1   24   16    1 o  127.462   2.1646  336.167   11.377  327.612   15.903  345.134   16.283  125.801   3.0650  129.123   3.0574 -3.321510 4.329231 
1 1 1   24   16    2 o   97.957   2.2936  198.689   9.2655  195.202   12.990  202.300   13.220   97.082   3.2442   98.831   3.2431 -1.749489 4.587225 
1 1 1   24   16    3 o   56.903   3.0891   67.773   7.1929   72.352   9.8038   62.435   10.586   59.033   4.0265   54.774   4.6857 4.259796 6.178109 
1 1 1   24   16    4 o  117.644   2.3131  286.450   11.163  284.276   15.000  289.149   16.712  117.171   3.1038  118.118   3.4305 -0.9468765 4.626245 
1 1 1   24   16    5 o  107.233   2.3561  237.137   10.369  227.596   13.879  249.187   15.599  104.823   3.2103  109.645   3.4494 -4.821861 4.712163 
1 1 1   24   16    6 o  121.874   2.1827  307.581   10.971  309.792   15.570  305.401   15.462  122.309   3.0865  121.439   3.0871 0.8700790 4.365361 
1 1 1   24   16    7 o   16.943   4.9145   1.8534   5.5398   4.1894   8.0264  -0.2718   7.6558   18.343   7.2225   15.542   6.6666 2.800755 9.828960 
1 1 1   24   16    8 o   95.069   2.4809  186.677   9.6476  181.510   12.770  193.548   14.726   93.574   3.3087   96.565   3.6974 -2.990898 4.961726 
1 1 1   24   16    9 o  152.085   2.3489  480.336   14.585  484.803   19.352  474.463   22.190  152.966   3.0674  151.203   3.5583 1.762619 4.697884 
1 1 1   24   16   10 o   43.513   3.5042   39.827   6.2424   35.274   8.9874   44.070   8.6770   41.052   5.3080   45.973   4.5762 -4.920876 7.008310 
1 1 1   24   16   11 o   99.570   2.9491  209.810   10.896  198.637   20.206  214.392   12.939   97.452   5.0271  101.689   3.0850 -4.237198 5.898236 
1 1 1   24   16   12 o   74.875   4.7214  110.171   9.9161  130.803   28.082  107.232   10.599   77.911   8.7390   71.840   3.5771 6.070518 9.442742 
1 1 1   24   16   13 o   69.766   4.6510   93.294   9.4064  117.384   25.966   89.655   10.092   73.867   8.5231   65.665   3.7262 8.201942 9.302017 
1 1 1   24   16   14 o   83.427   2.8025  147.295   9.2451  135.859   15.100  154.153   11.693   80.672   4.5382   86.181   3.2896 -5.508514 5.605078 
1 1 1   24   16   15 o   94.212   2.6774  186.996   10.056  175.530   16.196  194.188   12.827   91.712   4.2817   96.712   3.2158 -5.000534 5.354835 
1 1 1   24   16   16 o   45.118   3.9624   42.768   7.0484   43.709   11.899   42.259   8.7485   45.346   6.3620   44.889   4.7253 0.4572716 7.924859 
1 1 1   24   16   17 o   71.764   2.9756  107.246   8.4045  109.341   14.245  106.128   10.409   72.150   4.7868   71.378   3.5359 0.7724686 5.951157 
1 1 1   24   16   18 o  125.529   2.5241  332.975   12.808  301.527   19.622  356.319   16.906  120.141   3.9599  130.917   3.1310 -10.77534 5.048117 
1 1 1   24   16   19 o   53.969   3.8779   63.338   7.8852   57.095   14.018   66.227   9.5371   51.672   6.5774   56.265   4.1097 -4.593575 7.755790 
1 1 1   24   16   20 o   81.643   3.2327  140.559   10.733  135.678   16.450  144.177   14.164   80.274   4.9686   83.012   4.1369 -2.738335 6.465341 
1 1 1   24   16   21 o   20.682   5.8080   4.5962   7.7540  -1.8444   11.257   10.412   10.696   17.920   7.8795   23.444   8.5349 -5.524061 11.61598 
1 1 1   24   16   22 o   16.877   5.4867  -7.1590   8.3710  -7.9309   10.467  -5.7888   13.945   15.133   7.0194   18.622   8.4346 -3.488939 10.97338 
1 1 1   24   16   23 o   70.076   3.3927  103.853   9.7892   98.512   13.974  108.999   13.718   68.246   4.9645   71.905   4.6254 -3.659523 6.785342 
1 1 1   24   16   24 o   65.304   3.5782   90.284   9.6172   98.905   13.946   82.467   13.280   68.309   4.9500   62.299   5.1683 6.010166 7.156410 
1 1 1   24   16   25 o   46.749   5.6931   49.190   10.703   48.494   15.704   49.793   14.625   45.919   8.6082   47.579   7.4530 -1.660141 11.38629 
1 1 1   24   16   26 o  106.635   2.9210  239.789   12.838  250.687   18.212  229.025   18.100  109.090   4.0478  104.179   4.2125 4.910583 5.842086 
1 1 1   24   16   27 o   44.948   5.4720   46.503   9.7459   51.957   13.255   40.084   14.379   48.660   6.6046   41.236   8.7265 7.424156 10.94407 
1 1 1   24   16   28 f   19.269   5.6363   2.2527   7.9458  -9.8763   13.054   9.3907   10.015   16.506   7.7173   22.032   8.2167 -5.526531 11.27252 
1 1 1   24   16   29 o   26.455   6.9084   13.148   9.1573   22.803   17.373   9.4341   10.776   30.651   10.913   22.259   8.4742 8.392206 13.81687 
1 1 1   24   16   30 o   57.907   4.3428   74.953   10.019   53.294   13.972   97.877   14.374   48.629   6.9663   67.185   5.1875 -18.55612 8.685563 
1 1 1   24   16   31 o   42.707   6.4734   36.862   11.039   21.033   13.138   74.884   20.362   29.231   9.5083   56.183   8.7871 -26.95151 12.94683 
1 1 1   24   16   32 o   22.436   6.7928   5.6439   11.183   9.4681   13.823  -1.6034   19.029   23.102   9.3488   21.770   9.8574 1.332230 13.58561 
1 1 1   24   16   33 f   21.128   6.7594  -0.5701   12.121  -0.4981   15.013  -0.7051   20.543   19.853   8.8920   22.404   10.183 -2.550591 13.51880 
1 1 1   24   16   34 o   37.912   9.6931   46.749   19.065   53.974   30.910   42.314   24.220   39.154   14.468   36.670   12.903 2.483841 19.38617 
1 1 1   24   16   35 f   20.176   6.4634  -3.2775   12.570   8.7701   14.835 -33.9451   23.669   22.483   9.4458   17.868   8.8250 4.614872 12.92683 
1 1 1   24   16   36 o   21.024   9.1893   4.8110   15.109   4.8110   15.109   0.0000   0.0000   21.024   9.1893  ?   ?       ?      ? 
1 1 1   24   17    0 o   12.149   5.3464   2.0328   7.6565   2.0328   7.6565   2.0328   7.6565   12.149   7.5610   12.149   7.5610 0.000000 0.000000 
1 1 1   24   17    1 o  134.473   2.1732  374.540   12.052  379.839   17.053  369.252   17.036  135.427   3.0530  133.519   3.0936 1.908218 4.346402 
1 1 1   24   17    2 o   86.312   2.5112  155.135   8.8820  160.710   12.033  148.460   13.166   88.055   3.3132   84.569   3.7745 3.485985 5.022380 
1 1 1   24   17    3 o  147.526   2.2918  451.028   13.858  450.941   18.590  451.137   20.790  147.551   3.0547  147.502   3.4173 0.4879761E-01 4.583600 
1 1 1   24   17    4 o   25.907   4.3744   12.941   5.8832   27.715   8.2949  -2.0140   8.3456   36.394   5.5261   15.421   6.7825 20.97287 8.748734 
1 1 1   24   17    5 o  141.644   2.1713  415.563   12.683  421.485   18.133  409.892   17.745  142.629   3.0825  140.659   3.0587 1.970108 4.342530 
1 1 1   24   17    6 o   93.884   2.3059  182.632   8.9210  193.607   12.782  172.211   12.456   96.640   3.2069   91.128   3.3141 5.512421 4.611735 
1 1 1   24   17    7 o   67.807   2.6407   95.609   7.3730   89.179   10.415  102.070   10.439   65.502   3.8549   70.111   3.6101 -4.608444 5.281448 
1 1 1   24   17    8 o  118.603   2.3770  290.060   11.506  279.809   15.097  304.266   17.772  116.164   3.1510  121.043   3.5598 -4.878944 4.754071 
1 1 1   24   17    9 o   79.388   2.6614  130.157   8.6273  125.167   11.332  137.036   13.306   77.627   3.5394   81.148   3.9757 -3.520805 5.322877 
1 1 1   24   17   10 o  201.968   2.4830  847.841   20.419  844.245   31.450  850.461   26.848  201.479   3.7847  202.457   3.2152 -0.9776917 4.966014 
1 1 1   24   17   11 o   32.826   6.5829   24.636   7.7260   14.572   21.534   26.123   8.2771   30.398   11.871   35.253   5.6926 -4.855326 13.16574 
1 1 1   24   17   12 o   87.000   4.3939  158.961   10.851  160.622   29.158  158.694   11.691   86.551   8.1681   87.450   3.2414 -0.8983917 8.787778 
1 1 1   24   17   13 o  129.766   2.8932  356.936   14.820  329.171   24.295  373.392   18.703  125.461   4.6950  134.071   3.3823 -8.609810 5.786497 
1 1 1   24   17   14 o   25.814   5.5288   12.215   6.4474   22.858   10.987   6.6261   7.9624   31.912   8.2774   19.716   7.3317 12.19669 11.05760 
1 1 1   24   17   15 o   63.268   3.1580   84.716   7.8710   80.874   13.083   86.896   9.8536   61.977   5.1183   64.560   3.7005 -2.583176 6.315922 
1 1 1   24   17   16 o   38.930   4.9300   37.429   6.9283   22.155   11.833   45.397   8.5463   31.317   8.7977   46.543   4.4520 -15.22607 9.860030 
1 1 1   24   17   17 o   84.634   2.7851  151.639   9.5000  139.111   14.749  160.523   12.420   81.474   4.3890   87.793   3.4299 -6.318909 5.570248 
1 1 1   24   17   18 o   91.089   2.6657  174.707   9.6873  166.943   15.650  179.529   12.334   89.286   4.2498   92.893   3.2194 -3.606415 5.331485 
1 1 1   24   17   19 o   67.007   3.3306   92.464   8.5803   99.594   15.430   89.272   10.324   68.628   5.4513   65.386   3.8281 3.241989 6.661171 
1 1 1   24   17   20 o   55.118   4.1258   64.199   9.3374   73.224   13.814   56.608   12.670   58.696   5.7063   51.539   5.9604 7.157547 8.251521 
1 1 1   24   17   21 o   44.060   4.7458   42.847   8.3076   37.072   12.087   48.018   11.437   40.697   7.4767   47.424   5.8473 -6.726246 9.491655 
1 1 1   24   17   22 o   74.368   4.0901  121.877   12.030  136.263   15.623  100.926   18.854   80.358   4.7137   68.377   6.6855 11.98147 8.180167 
1 1 1   24   17   23 o   74.866   3.3353  119.000   10.246  106.367   14.585  131.306   14.396   70.816   4.9936   78.917   4.4228 -8.101387 6.670624 
1 1 1   24   17   24 o   25.589   6.6478   11.524   9.3913   20.065   14.467   5.3031   12.346   29.744   9.9893   21.434   8.7743 8.310413 13.29569 
1 1 1   24   17   25 o   48.413   5.1333   51.718   10.236   49.087   14.532   54.309   14.421   47.093   7.4816   49.734   7.0305 -2.640793 10.26654 
1 1 1   24   17   26 o   30.030   6.2818   21.260   8.3523   23.467   11.921   19.131   11.706   31.449   8.8285   28.611   8.9387 2.838070 12.56358 
1 1 1   24   17   27 o   26.299   6.2349   15.808   8.0320   12.890   12.336   17.955   10.583   24.882   9.1493   27.717   8.4728 -2.834436 12.46988 
1 1 1   24   17   28 o   50.935   4.4490   57.718   9.2174   49.155   13.355   65.507   12.737   46.964   6.8949   54.906   5.6246 -7.941757 8.898071 
1 1 1   24   17   29 o   20.032   6.2359   1.2893   9.1116  -0.2405   17.545   1.8543   10.662   21.699   9.6733   18.366   7.8723 3.333549 12.47177 
1 1 1   24   17   30 o   42.741   5.7690   44.155   9.7909   32.457   14.213   54.719   13.507   36.021   9.4493   49.462   6.6208 -13.44156 11.53796 
1 1 1   24   17   31 o   45.062   7.9148   54.374   14.631   50.855   20.040   58.390   21.410   43.511   11.124   46.613   11.262 -3.102539 15.82964 
1 1 1   24   17   32 f   24.481   6.7405   12.160   10.730   20.011   13.041  -4.2969   18.881   28.122   9.4840   20.840   9.5807 7.281950 13.48095 
1 1 1   24   17   33 o   29.498   8.0257   22.717   13.649   19.953   18.041   26.416   20.873   28.130   10.899   30.865   11.784 -2.735788 16.05143 
1 1 1   24   17   34 o   24.362   7.2442   11.324   12.668   16.918   15.369  -0.5318   22.373   26.094   10.074   22.631   10.413 3.462831 14.48839 
1 1 1   24   17   35 o   28.133   7.7896   17.752   12.388   9.5298   14.827   36.764   22.547   22.631   9.4718   33.635   12.369 -11.00397 15.57916 
1 1 1   24   18    0 o  147.698   2.4365  452.032   20.965  452.032   20.965  452.032   20.965  147.698   3.4458  147.698   3.4458 0.000000 0.000000 
1 1 1   24   18    1 o   20.188   5.1739   6.6338   5.6941   3.1164   7.7711   10.712   8.3673   17.454   7.0284   22.922   7.5946 -5.468576 10.34778 
1 1 1   24   18    2 o  137.613   2.2918  392.203   12.922  387.997   17.266  397.557   19.482  136.818   3.0597  138.408   3.4128 -1.589828 4.583535 
1 1 1   24   18    3 o   97.816   2.3830  197.901   9.5745  191.810   12.887  205.407   14.305   96.162   3.2492   99.469   3.4868 -3.306389 4.766005 
1 1 1   24   18    4 o   76.437   2.4880  121.241   7.8315  130.908   11.236  112.109   10.921   79.411   3.4307   73.463   3.6044 5.947762 4.976064 
1 1 1   24   18    5 o  107.506   2.2413  239.732   9.9355  239.149   14.196  240.290   13.910  107.371   3.2056  107.641   3.1332 -0.2699356 4.482522 
1 1 1   24   18    6 o  148.239   2.1573  455.620   13.189  449.038   18.593  462.287   18.712  147.158   3.0634  149.320   3.0383 -2.161942 4.314592 
1 1 1   24   18    7 o  114.921   2.2100  273.870   10.473  267.796   14.696  280.140   14.931  113.624   3.1358  116.218   3.1149 -2.593887 4.419934 
1 1 1   24   18    8 o  118.548   2.3822  292.042   11.525  293.664   15.256  289.886   17.588  118.991   3.1086  118.105   3.6107 0.8858185 4.764462 
1 1 1   24   18    9 f  103.192   2.4441  221.583   10.154  219.116   16.177  223.187   13.043  102.637   3.8214  103.747   3.0482 -1.110458 4.888211 
1 1 1   24   18   10 o  198.905   2.4870  824.120   20.117  808.897   31.001  835.193   26.440  197.185   3.8119  200.625   3.1952 -3.440170 4.973941 
1 1 1   24   18   11 o   29.361   6.5095   19.935   7.4162   4.6997   21.846   21.919   7.8844   27.043   11.417   31.680   6.2562 -4.636768 13.01900 
1 1 1   24   18   12 o   36.435   5.3819   29.112   7.0248   28.868   13.958   29.195   8.1294   35.628   9.3727   37.243   5.2924 -1.614891 10.76372 
1 1 1   24   18   13 o   62.283   3.7595   80.554   8.3883   84.359   16.827   79.296   9.6763   62.911   6.4850   61.654   3.8052 1.257038 7.518944 
1 1 1   24   18   14 o   31.288   5.3550   22.007   6.6018   21.114   11.286   22.471   8.1395   30.619   8.5887   31.958   6.3984 -1.339397 10.71008 
1 1 1   24   18   15 o   57.812   3.3800   69.508   7.7025   72.723   13.087   67.804   9.5275   58.673   5.4080   56.951   4.0561 1.721848 6.760046 
1 1 1   24   18   16 o   51.368   3.6198   53.140   7.4116   65.491   12.602   46.608   9.1640   55.642   5.4914   47.095   4.7178 8.546810 7.239686 
1 1 1   24   18   17 o  123.896   2.4697  321.568   12.272  312.205   19.650  327.555   15.714  122.253   3.8970  125.538   3.0348 -3.285156 4.939314 
1 1 1   24   18   18 o   59.418   3.4436   78.339   7.8152   62.111   13.014   87.492   9.7740   54.080   5.8344   64.757   3.6595 -10.67675 6.887121 
1 1 1   24   18   19 o   57.058   3.7280   73.724   8.0068   55.324   13.409   83.920   9.9816   50.779   6.4025   63.338   3.8209 -12.55843 7.455963 
1 1 1   24   18   20 o  113.084   3.4498  269.363   15.751  266.043   20.257  274.440   25.050  112.476   4.3667  113.692   5.3420 -1.215645 6.899639 
1 1 1   24   18   21 o   18.440   5.6210   0.2995   7.7535  -1.7288   11.833   1.8256   10.264   18.324   8.0676   18.555   7.8292 -0.2300034 11.24200 
1 1 1   24   18   22 o   67.760   4.1410   97.477   11.300   94.049   14.396  102.980   18.239   66.477   5.2507   69.042   6.4049 -2.564781 8.282052 
1 1 1   24   18   23 o   33.739   5.7732   26.786   8.0843   19.572   11.864   33.039   11.046   29.182   8.9795   38.297   7.2587 -9.115112 11.54644 
1 1 1   24   18   24 o   84.116   3.5199  151.918   11.801  145.637   19.088  155.804   15.015   82.329   5.6214   85.903   4.2380 -3.574203 7.039877 
1 1 1   24   18   25 o   61.675   4.2870   81.780   10.758   77.427   13.965   88.132   16.872   59.884   5.6542   63.465   6.4455 -3.580883 8.574041 
1 1 1   24   18   26 o   53.701   4.6866   63.528   10.333   63.541   13.984   63.513   15.335   53.876   6.2932   53.526   6.9465 0.3494606 9.373263 
1 1 1   24   18   27 o   59.539   3.9931   76.809   9.7377   79.090   14.738   75.042   12.972   60.158   5.9400   58.919   5.3382 1.239723 7.986290 
1 1 1   24   18   28 o   29.900   6.9216   21.622   9.2392   22.032   17.738   21.469   10.823   30.005   10.981   29.794   8.4294 0.2117653 13.84311 
1 1 1   24   18   29 o   32.412   6.5429   28.503   10.475   7.5949   18.361   38.590   12.754   24.447   10.401   40.376   7.9414 -15.92960 13.08588 
1 1 1   24   18   30 o   35.785   7.4165   31.763   11.218   26.537   13.814   41.883   19.223   32.284   9.6390   39.286   11.274 -7.001827 14.83292 
1 1 1   24   18   31 o   20.181   6.4151  -0.8565   10.344  -2.8084   12.471   3.4469   18.518   17.649   7.9869   22.712   10.041 -5.063110 12.83027 
1 1 1   24   18   32 o   31.705   7.8530   27.537   12.500   26.822   15.961   28.672   20.102   31.499   10.492   31.911   11.688 -0.4123440 15.70607 
1 1 1   24   18   33 o   42.265   8.4192   50.318   14.838   41.087   18.424   67.362   25.034   37.755   11.096   46.776   12.665 -9.020920 16.83834 
1 1 1   24   18   34 o   21.455   6.8556   1.9950   12.120   0.6947   14.659   4.8040   21.545   19.566   8.7734   23.344   10.537 -3.777510 13.71128 
1 1 1   24   19    0 o  118.906   2.4217  293.308   16.765  293.308   16.765  293.308   16.765  118.906   3.4249  118.906   3.4249 0.000000 0.000000 
1 1 1   24   19    1 o   94.148   2.5288  184.170   9.8187  180.371   13.822  188.040   13.950   93.164   3.5971   95.133   3.5555 -1.968407 5.057683 
1 1 1   24   19    2 o   61.336   2.9320   79.278   7.3295   89.066   10.092   68.353   10.662   65.447   3.7389   57.225   4.5174 8.221294 5.863923 
1 1 1   24   19    3 o   58.174   2.8502   70.531   6.8240   64.980   9.6146   76.165   9.6871   55.845   4.1743   60.503   3.8820 -4.657539 5.700375 
1 1 1   24   19    4 o  168.402   2.1744  587.893   15.100  599.638   21.607  576.683   21.110  170.044   3.0809  166.761   3.0692 3.282898 4.348798 
1 1 1   24   19    5 o   77.583   2.4700  125.172   7.8842  114.610   11.111  135.885   11.190   74.261   3.6275   80.906   3.3533 -6.644600 4.940032 
1 1 1   24   19    6 o  129.582   2.1621  348.184   11.555  345.649   16.237  350.784   16.446  129.106   3.0493  130.058   3.0659 -0.9515228 4.324133 
1 1 1   24   19    7 o   33.073   4.8925   24.060   6.4179   24.333   8.5593   23.709   9.7000   33.394   6.4479   32.751   7.3602 0.6432076 9.785056 
1 1 1   24   19    8 f   21.087   5.6407   5.9880   6.7880   11.788   10.665   2.0380   8.8010   24.481   8.5654   17.692   7.3418 6.789309 11.28131 
1 1 1   24   19    9 o   99.524   2.5625  210.343   10.188  187.428   16.055  225.790   13.182   94.762   4.1078  104.286   3.0647 -9.523758 5.125077 
1 1 1   24   19   10 f   44.342   6.4059   45.426   7.9588   41.213   21.841   46.071   8.5464   41.770   12.026   46.913   4.4170 -5.142948 12.81172 
1 1 1   24   19   11 o   62.629   5.1280   80.022   9.0106   90.427   25.099   78.482   9.6541   63.926   9.5196   61.332   3.8165 2.594784 10.25610 
1 1 1   24   19   12 o  114.774   2.8154  271.277   11.986  284.163   22.810  266.363   14.087  116.317   4.7546  113.230   3.0165 3.087379 5.630702 
1 1 1   24   19   13 o  110.199   2.9048  255.752   12.161  249.238   21.820  258.688   14.647  108.869   4.8593  111.530   3.1842 -2.661110 5.809651 
1 1 1   24   19   14 o   53.037   3.5736   57.232   7.4656   66.145   12.960   52.806   9.1331   55.886   5.6228   50.188   4.4122 5.698383 7.147239 
1 1 1   24   19   15 o   19.070   5.4324   3.5358   6.1373   7.0877   11.097   1.9704   7.3666   21.834   8.5232   16.307   6.7379 5.526564 10.86479 
1 1 1   24   19   16 o   86.160   2.9307  156.186   10.301  149.068   15.556  161.744   13.746   84.299   4.4743   88.021   3.7864 -3.722519 5.861349 
1 1 1   24   19   17 o   25.415   4.4514   14.461   6.6079 -12.9407   11.688   27.335   8.0111   14.912   7.0722   35.918   5.4078 -21.00591 8.902846 
1 1 1   24   19   18 o   90.153   2.9694  173.316   10.141  163.628   18.119  177.736   12.238   87.957   4.9946   92.349   3.2130 -4.391945 5.938782 
1 1 1   24   19   19 f   56.280   3.5926   68.449   7.8935   62.425   13.177   71.821   9.8580   54.049   5.9109   58.510   4.0850 -4.461441 7.185155 
1 1 1   24   19   20 o   88.726   3.6379  167.495   13.222  171.267   17.820  162.877   19.720   90.002   4.8007   87.450   5.4674 2.551491 7.275899 
1 1 1   24   19   21 o   82.020   3.8736  143.911   13.077  150.377   18.230  137.055   18.770   84.031   5.2598   80.008   5.6880 4.022728 7.747174 
1 1 1   24   19   22 o   48.972   4.7133   51.156   8.8046   77.399   13.656   32.489   11.518   60.157   5.5041   37.788   7.6527 22.36932 9.426508 
1 1 1   24   19   23 o   31.265   6.5040   21.376   8.6192   30.095   14.897   16.988   10.568   35.302   9.8548   27.228   8.4908 8.074043 13.00807 
1 1 1   24   19   24 o   33.192   5.9956   25.920   8.1060   26.350   12.964   25.644   10.387   33.146   9.1723   33.239   7.7237 -0.9299850E-01 11.99113 
1 1 1   24   19   25 o   24.397   6.0877   12.674   7.9958   5.8018   12.474   17.467   10.417   21.426   8.8011   27.367   8.4131 -5.941301 12.17532 
1 1 1   24   19   26 o   72.799   3.7621  113.484   11.239  103.455   15.012  126.276   16.954   69.213   5.2589   76.386   5.3814 -7.172585 7.524290 
1 1 1   24   19   27 o   18.677   5.5661   2.0314   7.6650  -5.1838   11.685   7.4809   10.155   16.588   7.5932   20.766   8.1406 -4.177698 11.13218 
1 1 1   24   19   28 o   68.752   3.8109  105.618   10.358   73.669   14.791  136.365   14.510   57.663   6.2190   79.841   4.4062 -22.17746 7.621753 
1 1 1   24   19   29 o   37.172   6.3220   38.141   10.586   15.643   17.673   50.730   13.220   26.947   10.683   47.396   6.7630 -20.44834 12.64404 
1 1 1   24   19   30 o   70.459   4.7180  109.571   12.732  103.864   15.265  122.617   23.077   68.686   5.3884   72.232   7.7462 -3.545914 9.436065 
1 1 1   24   19   31 o   20.131   6.3657   0.6016   10.281   1.1900   12.477  -0.6422   18.141   18.935   8.3116   21.328   9.6439 -2.392450 12.73136 
1 1 1   24   19   32 o   30.866   7.7116   25.120   12.142   18.067   15.525   36.231   19.485   26.767   10.176   34.965   11.590 -8.197874 15.42321 
1 1 1   24   19   33 o   27.689   7.8967   20.452   13.834   21.301   17.980   19.219   21.659   27.946   10.866   27.432   11.462 0.5136814 15.79340 
1 1 1   24   20    0 o  148.916   2.4156  459.754   20.957  459.754   20.957  459.754   20.957  148.916   3.4162  148.916   3.4162 0.000000 0.000000 
1 1 1   24   20    1 o   83.653   2.6420  145.580   9.1144  148.675   12.999  142.586   12.784   84.530   3.7284   82.777   3.7444 1.752350 5.284031 
1 1 1   24   20    2 o   57.103   3.0534   68.962   7.0940   59.277   10.385   77.436   9.7138   53.225   4.7305   60.981   3.8622 -7.755592 6.106842 
1 1 1   24   20    3 o  204.154   2.2701  865.282   19.112  848.228   26.807  882.914   27.257  202.106   3.2159  206.202   3.2049 -4.095749 4.540202 
1 1 1   24   20    4 o   62.138   2.7467   80.488   7.0363   79.707   10.071   81.232   9.8354   61.833   3.9488   62.443   3.8189 -0.6103516 5.493391 
1 1 1   24   20    5 o   81.149   2.5578  136.009   8.5008  146.033   12.969  128.458   11.256   83.720   3.7558   78.579   3.4732 5.141243 5.115522 
1 1 1   24   20    6 o   72.010   2.5536  108.077   7.5545  120.613   10.802   96.074   10.569   76.133   3.4400   67.886   3.7748 8.246933 5.107170 
1 1 1   24   20    7 o   85.690   2.5186  153.209   8.8505  155.549   11.949  150.365   13.173   86.465   3.3506   84.915   3.7613 1.550621 5.037294 
1 1 1   24   20    8 o  112.029   2.5792  260.869   11.866  269.186   17.733  254.125   15.968  113.596   3.7849  110.462   3.5050 3.133598 5.158493 
1 1 1   24   20    9 o   50.971   6.2328   60.867   8.4579   53.516   22.976   62.019   9.0966   47.465   11.790   54.477   4.0485 -7.012409 12.46550 
1 1 1   24   20   10 o   41.509   6.6547   34.603   7.8057   44.854   23.015   33.270   8.2975   43.270   12.310   39.747   5.0614 3.522995 13.30947 
1 1 1   24   20   11 o   82.987   3.1760  147.668   9.6665  137.163   18.147  151.830   11.422   80.547   5.4626   85.427   3.2417 -4.879326 6.352046 
1 1 1   24   20   12 o   51.618   4.4450   57.611   8.7914   54.474   15.362   59.139   10.720   50.228   7.4154   53.009   4.9034 -2.780708 8.890000 
1 1 1   24   20   13 o   93.467   3.2970  185.903   12.074  175.414   20.231  191.705   15.047   91.108   5.3838   95.825   3.8073 -4.716713 6.594020 
1 1 1   24   20   14 o   41.287   5.1859   42.506   7.2667   27.441   13.824   48.258   8.5420   34.582   9.4315   47.992   4.3155 -13.40943 10.37188 
1 1 1   24   20   15 o   22.656   5.6825   9.3452   6.1944   12.734   11.429   7.9354   7.3711   25.107   8.8604   20.205   7.1174 4.901411 11.36508 
1 1 1   24   20   16 o   32.127   5.4473   22.665   6.7103   25.247   12.146   21.530   8.0502   33.125   8.7574   31.130   6.4807 1.994640 10.89452 
1 1 1   24   20   17 o   94.259   2.7620  190.397   10.319  168.832   16.539  204.141   13.204   89.557   4.4777   98.960   3.2350 -9.402397 5.524008 
1 1 1   24   20   18 o   32.283   5.3339   21.456   6.5815   30.669   12.008   17.500   7.8686   36.658   8.1530   27.908   6.8798 8.749987 10.66789 
1 1 1   24   20   19 o   80.150   3.2490  135.692   10.739  132.896   15.151  138.516   15.224   79.305   4.6320   80.996   4.5573 -1.690796 6.498009 
1 1 1   24   20   20 o   69.991   3.7038  106.417   10.296   95.558   16.455  113.404   13.200   66.658   5.9853   73.325   4.3646 -6.667534 7.407648 
1 1 1   24   20   21 o   42.213   7.5821   42.397   12.734   47.467   21.802   39.773   15.688   43.459   11.841   40.968   9.4733 2.490829 15.16424 
1 1 1   24   20   22 o   31.330   5.8273   24.096   8.2379   11.494   12.757   33.111   10.789   24.427   9.2393   38.232   7.1038 -13.80438 11.65454 
1 1 1   24   20   23 o   64.875   4.1310   92.923   10.547   84.867   17.265   97.719   13.321   62.062   6.7449   67.687   4.7716 -5.625324 8.262056 
1 1 1   24   20   24 o   64.254   3.7179   88.702   9.8295   97.484   14.204   80.632   13.616   67.375   5.1116   61.134   5.4001 6.240349 7.435741 
1 1 1   24   20   25 o   74.582   3.3607  119.358   10.321  116.597   14.908  121.900   14.304   73.659   4.9071   75.505   4.5931 -1.845436 6.721389 
1 1 1   24   20   26 o   25.360   6.0592   12.454   8.6128   0.0349   12.056   25.398   12.308   18.594   8.1657   32.125   8.9542 -13.53158 12.11847 
1 1 1   24   20   27 o   65.958   3.6706   94.609   9.9524   90.540   14.456   98.276   13.723   64.447   5.4384   67.469   4.9314 -3.021317 7.341298 
1 1 1   24   20   28 o   78.511   3.4467  133.834   11.119  122.885   15.885  144.351   15.568   75.157   5.1245   81.864   4.6107 -6.707451 6.893450 
1 1 1   24   20   29 o   36.601   6.0574   32.502   9.0448   43.406   13.792   24.273   11.981   42.222   8.2156   30.979   8.9036 11.24322 12.11489 
1 1 1   24   20   30 o   63.268   5.6791   93.718   14.666   78.518   19.406  113.962   22.396   57.182   8.2286   69.354   7.8295 -12.17277 11.35826 
1 1 1   24   20   31 o   29.951   7.4855   24.725   12.254   32.581   16.133   14.012   18.840   34.209   10.462   25.694   10.709 8.515455 14.97091 
1 1 1   24   20   32 o   50.290   7.5089   67.409   14.583   59.247   18.087   82.572   24.653   47.211   9.6154   53.370   11.536 -6.159309 15.01776 
1 1 1   24   20   33 o   18.063   6.1216 -12.8126   12.465 -12.9330   15.547 -12.5958   20.856   16.684   7.9807   19.443   9.2846 -2.759113 12.24317 
1 1 1   24   21    0 o   18.488   6.4316   10.701   8.2754   10.701   8.2754   10.701   8.2754   18.488   9.0956   18.488   9.0956 0.000000 0.000000 
1 1 1   24   21    1 o   64.766   2.8518   88.340   7.5435   81.285   11.192   94.213   10.211   62.307   4.3552   67.224   3.6830 -4.916744 5.703665 
1 1 1   24   21    2 o   46.307   3.3862   45.224   6.4339   42.749   9.4221   47.386   8.8069   45.064   5.0693   47.549   4.4907 -2.485306 6.772351 
1 1 1   24   21    3 o   82.551   2.5173  142.043   8.5052  141.446   12.829  142.511   11.360   82.344   3.7775   82.759   3.3282 -0.4152451 5.034567 
1 1 1   24   21    4 o   37.992   3.9810   30.520   6.2184   30.717   9.1763   30.352   8.4561   38.069   5.8442   37.916   5.4073 0.1532440 7.962066 
1 1 1   24   21    5 o   38.269   4.0051   31.041   6.2734   30.606   9.4304   31.386   8.4022   37.964   6.0227   38.574   5.2812 -0.6100502 8.010197 
1 1 1   24   21    6 o   74.619   3.2837  121.681   9.2432  104.165   16.164  130.191   11.267   70.172   5.5851   79.066   3.4550 -8.893768 6.567374 
1 1 1   24   21    7 f   47.873   4.4671   49.161   8.3793   47.747   14.129   49.928   10.407   47.086   7.2754   48.660   5.1854 -1.573616 8.934159 
1 1 1   24   21    8 o   86.712   3.2352  159.391   11.080  152.061   18.305  163.631   13.921   84.892   5.2280   88.533   3.8123 -3.641090 6.470334 
1 1 1   24   21    9 o  124.611   3.8985  307.978   13.884  358.391   38.281  300.342   14.899  129.004   7.1948  120.218   3.0048 8.785828 7.797017 
1 1 1   24   21   10 o   22.822   7.1207   11.205   7.4314   0.0000   0.0000   11.205   7.4314  ?   ?    22.822   7.1207      ?      ? 
1 1 1   24   21   11 o   66.038   3.8854  102.350   8.8287   72.680   16.755  113.754   10.388   58.171   6.9837   73.906   3.4078 -15.73517 7.770792 
1 1 1   24   21   12 o   96.325   3.0160  195.375   10.717  192.125   20.245  196.641   12.632   95.423   5.1441   97.228   3.1501 -1.805237 6.031971 
1 1 1   24   21   13 o   35.308   5.6293   26.748   7.1820   29.752   14.649   25.798   8.2402   35.787   9.6877   34.829   5.7362 0.9578972 11.25857 
1 1 1   24   21   14 o   79.120   2.9445  135.512   9.0864  117.311   14.968  146.133   11.434   74.527   4.8695   83.713   3.3117 -9.185455 5.888958 
1 1 1   24   21   15 o   59.132   3.3239   72.113   7.7070   79.066   13.376   68.658   9.4295   61.035   5.3136   57.230   3.9949 3.804836 6.647784 
1 1 1   24   21   16 o   64.415   3.1836   86.020   7.9982   91.649   13.951   83.264   9.7618   65.755   5.1440   63.076   3.7523 2.678513 6.367182 
1 1 1   24   21   17 o   32.743   5.7949   26.026   7.0952   18.519   15.399   28.049   7.9945   29.185   10.286   36.300   5.3397 -7.114941 11.58983 
1 1 1   24   21   18 o   66.909   3.5900   94.335   9.8454  110.413   14.621   80.997   13.317   72.144   4.9138   61.675   5.2352 10.46922 7.180000 
1 1 1   24   21   19 o   78.460   3.2057  130.702   10.295  124.951   15.327  135.428   13.896   76.745   4.8423   80.175   4.2023 -3.429802 6.411486 
1 1 1   24   21   20 o   62.308   3.8637   86.410   9.4831   60.970   13.886  108.645   12.982   52.955   6.3577   71.661   4.3923 -18.70547 7.727376 
1 1 1   24   21   21 o   28.545   6.9736   18.628   9.9955   19.753   13.970   17.446   14.308   29.152   9.8159   27.938   9.9082 1.213486 13.94717 
1 1 1   24   21   22 o   40.261   5.9831   38.092   9.0005   36.527   16.535   38.751   10.729   38.387   10.250   42.134   6.1741 -3.746738 11.96629 
1 1 1   24   21   23 f   20.712   5.7797   6.0676   7.6889  -1.3210   11.839   11.457   10.112   18.137   8.0231   23.287   8.3218 -5.149229 11.55949 
1 1 1   24   21   24 o   44.150   4.9039   43.680   8.8753   43.933   13.292   43.476   11.923   44.067   7.3132   44.233   6.5352 -0.1660957 9.807773 
1 1 1   24   21   25 o   17.114   5.2498  -2.9640   7.7026 -17.3882   12.141   6.7532   9.9650   13.955   6.7684   20.272   8.0268 -6.317978 10.49952 
1 1 1   24   21   26 o   45.279   5.4383   48.095   9.7899   53.405   13.436   42.084   14.294   48.817   6.6731   41.742   8.5891 7.074776 10.87669 
1 1 1   24   21   27 o   24.528   6.1828   10.507   8.7596  -0.5065   11.745   24.315   13.150   18.058   7.9892   30.999   9.4382 -12.94149 12.36555 
1 1 1   24   21   28 o   20.326   5.9510   4.9081   8.1291   10.293   12.625   1.0945   10.625   22.875   9.0419   17.777   7.7396 5.097931 11.90197 
1 1 1   24   21   29 o   46.339   6.5904   50.901   11.688   41.639   14.291   69.614   20.314   40.770   8.7599   51.908   9.8487 -11.13819 13.18080 
1 1 1   24   21   30 o   21.830   6.9366   1.8250   13.033   1.8462   18.631   1.8046   18.238   21.916   9.8539   21.745   9.7656 0.1707706 13.87324 
1 1 1   24   21   31 o   33.819   7.4851   33.604   12.229   41.859   16.362   23.157   18.407   38.899   10.107   28.739   11.043 10.16039 14.97016 
1 1 1   24   21   32 o   51.651   7.1537   81.068   14.244  101.589   17.976   46.440   23.351   65.964   6.6073   37.337   12.690 28.62673 14.30743 
1 1 1   24   22    0 o   42.931   3.6173   39.991   8.7184   39.991   8.7184   39.991   8.7184   42.931   5.1156   42.931   5.1156 0.000000 0.000000 
1 1 1   24   22    1 o   65.866   2.8047   90.849   7.5760   88.776   11.258   92.564   10.242   65.127   4.1911   66.604   3.7284 -1.477325 5.609474 
1 1 1   24   22    2 o   55.211   3.0899   63.941   7.0010   63.287   10.402   64.482   9.4657   54.906   4.5934   55.516   4.1340 -0.6093178 6.179771 
1 1 1   24   22    3 o  142.463   2.5100  423.374   14.735  441.512   20.762  404.967   20.915  145.579   3.4578  139.348   3.6391 6.230850 5.019962 
1 1 1   24   22    4 o   88.677   2.5141  164.001   9.1188  163.275   13.795  164.564   12.153   88.441   3.7817   88.914   3.3139 -0.4733124 5.028248 
1 1 1   24   22    5 o   57.153   3.2370   67.517   7.4603   73.493   12.077   63.830   9.4867   59.079   4.9564   55.226   4.1649 3.853104 6.473972 
1 1 1   24   22    6 o  134.140   3.5697  375.107   19.750   0.0000   0.0000  375.107   19.750  ?   ?   134.140   3.5697      ?      ? 
1 1 1   24   22    7 o   53.241   3.9705   57.826   8.2683   66.989   14.578   53.480   10.039   56.055   6.3054   50.427   4.8270 5.627243 7.940920 
1 1 1   24   22    8 o  167.164   3.6589  584.945   19.389  596.535   45.639  582.393   21.418  166.967   6.6274  167.362   3.1028 -0.3952789 7.317778 
1 1 1   24   22    9 o   76.372   4.8104  136.604   10.222  109.279   26.240  141.492   11.098   70.298   9.0503   82.445   3.2638 -12.14711 9.620792 
1 1 1   24   22   10 o  116.307   2.8288  289.957   12.316  266.398   22.301  300.294   14.773  112.442   4.8088  120.171   2.9806 -7.728973 5.657604 
1 1 1   24   22   11 o   40.776   4.9238   34.569   7.2503   41.053   14.091   32.234   8.4553   42.552   8.3272   39.000   5.2566 3.552437 9.847512 
1 1 1   24   22   12 o  117.992   2.9712  298.074   13.657  273.882   22.978  311.287   16.982  113.840   4.8938  122.144   3.3709 -8.304268 5.942435 
1 1 1   24   22   13 o   68.236   3.6223  102.657   8.8751   90.028   16.901  107.465   10.429   64.743   6.3292   71.728   3.5251 -6.984764 7.244682 
1 1 1   24   22   14 o   93.383   2.8738  182.044   10.975  190.148   16.788  175.998   14.503   95.100   4.2802   91.666   3.8360 3.434189 5.747571 
1 1 1   24   22   15 o   90.505   2.7873  178.617   9.8827  146.435   15.820  199.214   12.656   83.270   4.6064   97.741   3.1395 -14.47113 5.574500 
1 1 1   24   22   16 o   18.224   5.3400   1.9008   6.0534   6.8548   11.257  -0.1143   7.1798   21.549   8.5316   14.900   6.4244 6.648932 10.67995 
1 1 1   24   22   17 o   32.782   5.2621   22.908   6.5889   29.623   11.791   19.859   7.9450   35.853   8.1575   29.711   6.6495 6.142653 10.52430 
1 1 1   24   22   18 o  111.227   2.6930  262.928   12.162  239.571   18.388  281.088   16.214  106.572   4.1834  115.882   3.3925 -9.309563 5.386097 
1 1 1   24   22   19 o   46.034   4.7762   48.123   8.5628   40.610   13.047   53.808   11.349   42.060   7.8085   50.009   5.5022 -7.949688 9.552372 
1 1 1   24   22   20 o   47.256   5.3963   50.980   9.9705   52.450   12.870   48.773   15.768   48.958   6.3739   45.555   8.7095 3.402908 10.79265 
1 1 1   24   22   21 f   40.215   5.5751   38.082   8.6455   33.817   14.338   40.519   10.837   37.346   9.3345   43.084   6.0987 -5.738266 11.15014 
1 1 1   24   22   22 o   57.978   4.9602   68.285   10.493   90.897   21.410   61.136   12.038   62.853   8.2588   53.104   5.4961 9.748890 9.920422 
1 1 1   24   22   23 o   97.810   2.9665  203.392   11.949  211.295   17.500  196.490   16.354   99.535   4.2628   96.084   4.1266 3.450455 5.933030 
1 1 1   24   22   24 o   35.252   5.7907   29.382   8.3775   39.602   12.471   20.977   11.309   41.126   7.6332   29.378   8.7100 11.74857 11.58140 
1 1 1   24   22   25 o   44.875   4.8032   45.128   8.8496   47.495   13.275   43.235   11.873   45.796   7.0280   43.954   6.5491 1.842556 9.606424 
1 1 1   24   22   26 o   18.128   5.5874   0.5427   7.7240   3.7841   12.152  -1.6545   10.005   19.909   8.4657   16.346   7.2944 3.563828 11.17477 
1 1 1   24   22   27 o   24.139   6.5189   12.612   9.2591   16.681   12.385   7.4570   13.941   26.167   9.2250   22.111   9.2133 4.056526 13.03785 
1 1 1   24   22   28 o   14.035   4.7748 -12.9038   7.9131 -13.4167   12.580 -12.5680   10.179   14.898   7.1403   13.172   6.3413 1.726336 9.549629 
1 1 1   24   22   29 o   25.324   7.0081   15.120   10.513   15.751   13.382   14.102   16.992   25.378   9.4917   25.269   10.313 0.1091976 14.01625 
1 1 1   24   22   30 o   39.989   9.1385   49.797   16.316   64.926   28.949   42.753   19.752   42.475   14.129   37.503   11.594 4.971951 18.27706 
1 1 1   24   22   31 o   33.040   7.3324   31.893   12.861   47.798   17.246   11.961   19.306   41.468   10.163   24.612   10.573 16.85616 14.66479 
1 1 1   24   23    0 o   47.388   3.8305   48.643   10.230   48.643   10.230   48.643   10.230   47.388   5.4171   47.388   5.4171 0.000000 0.000000 
1 1 1   24   23    1 o   39.324   3.9811   32.699   6.4279   32.113   8.6570   33.419   9.5962   38.976   5.3852   39.672   5.8648 -0.6951828 7.962167 
1 1 1   24   23    2 o  119.563   2.6952  299.329   12.505  296.046   21.655  300.972   15.316  118.813   4.4191  120.312   3.0866 -1.498413 5.390302 
1 1 1   24   23    3 o   44.386   4.2846   40.802   7.2014   44.854   13.354   39.140   8.5515   45.642   7.0938   43.131   4.8072 2.511044 8.569137 
1 1 1   24   23    4 f  113.931   2.3523  270.881   10.967  265.657   16.488  275.026   14.686  112.869   3.5419  114.993   3.0965 -2.123314 4.704599 
1 1 1   24   23    5 o   44.690   4.1952   38.393   7.0949   53.444   13.728   32.909   8.2874   49.899   6.6706   39.481   5.0894 10.41796 8.390408 
1 1 1   24   23    6 o  140.301   2.7700  415.046   15.437  399.738   25.254  424.177   19.505  137.932   4.4391  142.671   3.3147 -4.738998 5.540089 
1 1 1   24   23    7 o   63.141   3.6915   82.965   9.1614   89.358   15.755   79.699   11.261   64.714   5.9028   61.567   4.4346 3.146343 7.383034 
1 1 1   24   23    8 o   69.386   4.7448  109.191   9.6983   95.772   23.842  111.852   10.616   65.587   8.8138   73.184   3.5171 -7.597176 9.489605 
1 1 1   24   23    9 o   43.540   5.1673   48.634   7.4450   29.159   14.114   56.143   8.7634   35.354   9.4832   51.726   4.1076 -16.37249 10.33461 
1 1 1   24   23   10 o   49.079   4.7738   55.352   8.6883   43.596   14.303   62.227   10.938   43.893   8.2021   54.265   4.8869 -10.37135 9.547614 
1 1 1   24   23   11 o   25.588   5.7600   14.880   6.5937   9.0737   13.296   16.774   7.5932   23.828   9.3219   27.348   6.7684 -3.520113 11.51993 
1 1 1   24   23   12 o   26.176   6.0263   14.496   6.7123   15.198   13.927   14.284   7.6607   27.109   9.7581   25.243   7.0743 1.866110 12.05259 
1 1 1   24   23   13 o   71.567   3.0243  109.260   8.5054  103.016   14.155  112.789   10.641   69.704   4.9236   73.430   3.5134 -3.726112 6.048582 
1 1 1   24   23   14 o   57.265   3.5528   73.100   7.6791   60.183   13.216   79.684   9.4353   52.875   6.0600   61.656   3.7103 -8.781418 7.105689 
1 1 1   24   23   15 o   68.847   3.1421  102.793   8.3679   91.739   14.138  108.753   10.381   65.610   5.2247   72.084   3.4918 -6.473160 6.284105 
1 1 1   24   23   16 o   65.473   3.0839   86.198   7.9487  105.532   13.937   76.877   9.6769   70.483   4.7942   60.463   3.8805 10.01998 6.167864 
1 1 1   24   23   17 o   84.729   2.8244  152.841   9.5946  144.824   15.254  158.089   12.342   82.632   4.4757   86.825   3.4464 -4.192604 5.648861 
1 1 1   24   23   18 o   58.806   3.5660   77.491   7.8770   64.657   13.709   83.816   9.6242   54.501   6.0989   63.111   3.6974 -8.610535 7.132082 
1 1 1   24   23   19 o   34.415   5.5937   26.663   7.7919   36.852   12.148   19.541   10.156   39.979   7.6460   28.850   8.1667 11.12873 11.18736 
1 1 1   24   23   20 o   56.235   4.3692   68.956   9.9586   67.435   12.895   71.204   15.676   55.763   5.6067   56.706   6.7026 -0.9428864 8.738403 
1 1 1   24   23   21 o   48.795   5.5923   59.180   9.7486   44.374   16.897   66.567   11.935   42.131   9.8929   55.460   5.2178 -13.32917 11.18462 
1 1 1   24   23   22 f   33.092   6.0268   23.814   8.3526   40.613   14.058   14.647   10.384   41.031   8.5828   25.154   8.4631 15.87745 12.05357 
1 1 1   24   23   23 o   80.254   3.8988  138.070   12.452  131.209   15.532  150.413   20.834   78.034   4.8260   82.475   6.1247 -4.441078 7.797520 
1 1 1   24   23   24 o   65.198   3.6370   92.473   9.7368   91.860   14.420   92.987   13.200   64.833   5.3927   65.564   4.8815 -0.7308121 7.273959 
1 1 1   24   23   25 o  121.025   2.8389  312.113   14.040  320.259   21.457  306.013   18.568  122.134   4.2595  119.916   3.7541 2.217766 5.677771 
1 1 1   24   23   26 f   93.509   3.0245  189.813   11.550  166.305   16.717  211.286   15.977   87.587   4.6275   99.432   3.8958 -11.84492 6.049085 
1 1 1   24   23   27 o   55.465   4.9205   72.186   10.951   77.490   14.381   64.865   16.894   58.749   5.9349   52.181   7.8499 6.567844 9.840947 
1 1 1   24   23   28 o   87.792   4.3180  179.161   14.260  186.398   17.297  163.810   25.193   92.470   4.5353   83.115   7.3492 9.354836 8.635985 
1 1 1   24   23   29 o   40.484   7.1259   44.542   11.556   42.353   14.522   48.321   19.081   40.276   8.9718   40.692   11.073 -0.4164925 14.25181 
1 1 1   24   24    0 f   14.083   5.7376   5.4305   7.5762   5.4305   7.5762   5.4305   7.5762   14.083   8.1142   14.083   8.1142 0.000000 0.000000 
1 1 1   24   24    1 o   35.159   4.1714   26.750   5.9203   28.182   8.4392   25.363   8.3074   36.377   5.6249   33.941   6.1614 2.435936 8.342775 
1 1 1   24   24    2 o   87.694   2.4066  160.519   8.7018  155.941   12.300  165.106   12.312   86.427   3.4507   88.960   3.3556 -2.532799 4.813229 
1 1 1   24   24    3 o   42.872   3.7272   39.740   6.4480   31.794   9.3754   46.872   8.8824   38.577   5.8925   47.168   4.5658 -8.591228 7.454401 
1 1 1   24   24    4 f  153.215   2.7080  496.408   16.168  475.790   27.528  507.267   19.978  150.369   4.4386  156.062   3.1037 -5.693222 5.416092 
1 1 1   24   24    5 o   92.882   3.6809  185.789   13.860  212.108   18.975  155.685   20.294  100.331   4.5855   85.433   5.7593 14.89803 7.361793 
1 1 1   24   24    6 o   58.442   3.7858   71.447   8.7776   76.525   14.765   68.672   10.916   59.812   5.9852   57.071   4.6374 2.740963 7.571555 
1 1 1   24   24    7 o   55.269   6.4888   85.083   10.256   46.616   23.029   94.600   11.455   43.412   12.300   67.126   4.1373 -23.71395 12.97755 
1 1 1   24   24    8 o   33.908   6.4995   25.235   7.3810   25.488   20.008   25.195   7.9411   33.443   11.730   34.374   5.6013 -0.9310951 12.99894 
1 1 1   24   24    9 o   58.864   3.9107   80.131   8.1464   60.755   15.123   88.052   9.6691   52.861   6.9364   64.867   3.6141 -12.00570 7.821481 
1 1 1   24   24   10 o   72.732   3.3908  116.763   8.9600  101.433   16.713  122.947   10.614   68.754   5.8936   76.711   3.3548 -7.957214 6.781519 
1 1 1   24   24   11 f   61.881   3.5824   78.690   8.2682   87.833   15.788   75.235   9.7054   63.909   5.9897   59.852   3.9316 4.057507 7.164824 
1 1 1   24   24   12 o   26.509   5.8590   16.296   6.8278   10.939   13.700   18.066   7.8757   24.740   9.5220   28.278   6.8296 -3.537918 11.71804 
1 1 1   24   24   13 f  102.311   2.5681  221.707   10.436  210.601   17.003  228.419   13.219   99.993   4.1228  104.628   3.0632 -4.635880 5.136169 
1 1 1   24   24   14 o   27.061   5.5053   14.520   6.2856   24.956   11.209   9.7323   7.5915   32.688   8.2990   21.434   7.2360 11.25339 11.01059 
1 1 1   24   24   15 o   19.689   5.4511   3.2592   6.0257   13.034   11.514  -0.4272   7.0713   24.822   8.8793   14.556   6.3257 10.26590 10.90217 
1 1 1   24   24   16 o   26.979   4.7912   18.240   6.6099  -1.5882   11.477   28.083   8.0857   17.845   7.8962   36.113   5.4287 -18.26768 9.582317 
1 1 1   24   24   17 o   20.767   5.3926   8.4897   6.2358   0.0896   11.815   11.733   7.3415   18.677   8.1458   22.858   7.0686 -4.181053 10.78513 
1 1 1   24   24   18 o   40.081   4.7632   36.673   6.8648   34.461   12.664   37.594   8.1692   38.220   8.2736   41.942   4.7224 -3.722393 9.526476 
1 1 1   24   24   19 o   70.827   3.7831  110.045   10.879  119.604   14.632   98.228   16.268   74.672   4.7509   66.982   5.8887 7.690842 7.566221 
1 1 1   24   24   20 f   20.256   5.8311   5.8321   7.6359   3.4302   12.071   7.4346   9.8595   19.917   8.4520   20.594   8.0354 -0.6763611 11.66213 
1 1 1   24   24   21 o   63.538   4.3257   92.520   10.474   78.820   17.782   99.798   12.960   58.881   7.3223   68.196   4.6077 -9.315422 8.651447 
1 1 1   24   24   22 o   46.264   5.5801   55.246   9.2508   35.879   15.639   65.670   11.473   37.477   9.9506   55.051   5.0531 -17.57405 11.16013 
1 1 1   24   24   23 o   25.941   6.3618   16.062   8.6458   9.5001   13.550   20.568   11.229   23.027   9.2778   28.856   8.7072 -5.829489 12.72370 
1 1 1   24   24   24 o   42.795   5.1723   43.639   8.7080   37.652   13.089   48.394   11.664   39.123   8.3650   46.466   6.0860 -7.343029 10.34468 
1 1 1   24   24   25 o   82.474   3.2647  148.865   10.983  133.430   16.152  162.141   14.980   78.096   5.0145   86.852   4.1819 -8.755051 6.529421 
1 1 1   24   24   26 o   27.250   6.4187   18.555   8.4506   22.717   12.720   15.266   11.306   29.486   9.3329   25.014   8.8145 4.471594 12.83741 
1 1 1   24   24   27 o   73.799   3.5179  120.021   10.695  128.530   15.442  112.177   14.826   76.380   4.9018   71.219   5.0473 5.161201 7.035843 
1 1 1   24   24   28 o   28.597   9.1493   6.4588   12.404   0.8594   12.911   73.602   44.709   18.686   8.3164   38.508   16.300 -19.82247 18.29863 
1 1 1   24   25    0 o   8.9950   4.4289  -7.3526   8.3267  -7.3526   8.3267  -7.3526   8.3267   8.9950   6.2635   8.9950   6.2635 0.000000 0.000000 
1 1 1   24   25    1 o   52.758   3.1629   58.861   6.8591   63.161   9.5900   54.357   9.8144   54.795   4.2434   50.722   4.6914 4.073151 6.325793 
1 1 1   24   25    2 o  116.232   2.2263  281.513   10.669  273.375   14.862  290.166   15.325  114.500   3.1470  117.963   3.1499 -3.463005 4.452604 
1 1 1   24   25    3 o   59.382   3.1480   72.512   7.5044   82.317   12.390   66.830   9.4312   62.362   4.8170   56.402   4.0542 5.959778 6.296040 
1 1 1   24   25    4 o   41.612   4.8941   41.283   7.1304   31.364   13.021   45.531   8.5217   36.762   8.7197   46.462   4.4470 -9.699711 9.788162 
1 1 1   24   25    5 o   87.324   2.9535  164.001   9.8706  150.443   17.169  170.695   12.064   84.220   4.9426   90.429   3.2345 -6.209183 5.906913 
1 1 1   24   25    6 o   37.864   6.4318   36.166   8.4883   25.488   19.909   38.538   9.3839   33.213   11.698   42.515   5.3515 -9.302399 12.86355 
1 1 1   24   25    7 o  100.059   4.0140  229.212   12.161  191.749   28.603  237.479   13.436   93.400   7.4250  106.719   3.0525 -13.31866 8.027992 
1 1 1   24   25    8 o   37.215   5.1352   30.604   6.7334   31.458   13.461   30.319   7.7760   36.650   8.9766   37.780   4.9903 -1.130550 10.27043 
1 1 1   24   25    9 o   28.001   4.9195   21.021   6.6239  -1.6667   13.028   28.930   7.6922   19.123   8.4398   36.879   5.0572 -17.75623 9.838978 
1 1 1   24   25   10 o   30.295   5.3745   23.143   6.6328   12.255   13.056   26.930   7.7006   25.074   9.3757   35.515   5.2571 -10.44050 10.74897 
1 1 1   24   25   11 o  105.054   2.9130  232.889   11.550  232.664   21.071  232.986   13.810  104.535   4.8871  105.572   3.1716 -1.037010 5.826046 
1 1 1   24   25   12 o   26.288   4.8023   17.158   6.3134   0.1467   11.087   25.321   7.6802   18.250   7.9259   34.326   5.4248 -16.07583 9.604567 
1 1 1   24   25   13 o   42.931   4.4198   41.674   7.0613   37.510   12.092   43.829   8.6986   40.480   7.5193   45.381   4.6474 -4.900589 8.839613 
1 1 1   24   25   14 o   94.259   2.8194  188.192   10.867  183.326   16.349  192.042   14.545   93.005   4.2620   95.513   3.6921 -2.507294 5.638797 
1 1 1   24   25   15 o   54.107   3.8205   63.432   8.3398   61.641   13.108   64.650   10.810   53.198   5.9742   55.016   4.7639 -1.818573 7.641040 
1 1 1   24   25   16 o   55.745   3.7458   68.845   7.9486   61.926   13.821   72.264   9.7164   53.075   6.3135   58.415   4.0329 -5.339741 7.491649 
1 1 1   24   25   17 o   39.321   4.9484   36.322   7.0324   32.202   12.794   38.106   8.4180   36.534   8.6287   42.108   4.8471 -5.573650 9.896881 
1 1 1   24   25   18 o   42.924   5.2684   46.225   8.4634   27.639   13.083   59.601   11.099   33.388   9.2039   52.461   5.1294 -19.07325 10.53672 
1 1 1   24   25   19 o   48.420   4.8583   52.365   9.5990   50.416   12.604   55.057   14.811   47.608   6.4190   49.231   7.2943 -1.623203 9.716522 
1 1 1   24   25   20 o   52.580   4.8349   63.618   9.7055   57.807   16.720   66.571   11.919   49.805   8.1394   55.355   5.2206 -5.549965 9.669767 
1 1 1   24   25   21 o   25.927   6.1097   16.212   7.9588   9.9607   12.596   20.365   10.268   22.929   9.0417   28.926   8.2197 -5.996862 12.21946 
1 1 1   24   25   22 o   80.634   3.3946  141.639   11.198  136.844   16.745  145.518   15.061   79.107   5.1322   82.162   4.4444 -3.055695 6.789135 
1 1 1   24   25   23 o   22.962   5.8723   10.636   8.2824  -3.8628   13.468   19.453   10.503   17.948   8.1915   27.976   8.4165 -10.02793 11.74469 
1 1 1   24   25   24 o   26.543   6.3848   17.191   8.2462   20.313   12.957   15.065   10.691   28.140   9.4536   24.945   8.5843 3.194822 12.76955 
1 1 1   24   25   25 o   36.748   5.8049   33.118   8.6143   43.770   13.087   24.974   11.443   42.319   7.7846   31.177   8.6133 11.14195 11.60985 
1 1 1   24   25   26 o   30.659   6.1205   25.015   8.5532   15.875   12.593   32.843   11.653   25.155   9.2451   36.162   8.0230 -11.00742 12.24094 
1 1 1   24   25   27 o   45.417   5.1334   50.250   9.1901   42.170   13.395   57.436   12.632   40.816   8.2410   50.019   6.1231 -9.202808 10.26678 
1 1 1   24   26    0 o   14.644   5.8047   6.3237   7.4655   6.3237   7.4655   6.3237   7.4655   14.644   8.2090   14.644   8.2090 0.000000 0.000000 
1 1 1   24   26    1 o   57.923   2.8031   70.747   6.6729   64.991   9.5350   76.272   9.3416   55.551   4.1617   60.295   3.7564 -4.744835 5.606249 
1 1 1   24   26    2 o   49.546   3.5078   50.879   6.9675   57.577   11.539   47.035   8.7411   51.918   5.3885   47.174   4.4926 4.743824 7.015697 
1 1 1   24   26    3 f   34.921   4.8022   26.895   6.4141   27.476   11.077   26.601   7.8671   34.562   7.9381   35.280   5.4066 -0.7180862 9.604363 
1 1 1   24   26    4 o   82.021   2.7373  142.807   8.8695  136.048   14.640  146.726   11.148   80.240   4.4236   83.803   3.2255 -3.563042 5.474676 
1 1 1   24   26    5 o   54.061   4.2045   66.004   8.4643   55.246   14.941   71.088   10.272   50.096   7.2312   58.027   4.2918 -7.931046 8.408929 
1 1 1   24   26    6 o  129.745   3.8454  369.163   17.189  344.590   35.269  376.818   19.685  125.441   6.8170  134.048   3.5606 -8.607269 7.690849 
1 1 1   24   26    7 o   28.113   6.7761   14.827   7.1020   23.330   19.488   13.524   7.6265   31.774   11.528   24.453   7.1258 7.320894 13.55221 
1 1 1   24   26    8 o   21.472   5.7529   6.7597   6.2012   13.586   12.588   4.5725   7.1257   25.473   9.2612   17.472   6.8273 8.001156 11.50577 
1 1 1   24   26    9 o   12.312   4.2842 -13.4392   5.6347 -10.4392   11.856 -14.3144   6.4042   15.459   7.2681   9.1643   4.5379 6.294697 8.568372 
1 1 1   24   26   10 o   24.701   5.8315   13.190   6.4069   13.448   12.751   13.103   7.4102   25.371   9.3062   24.030   7.0301 1.340542 11.66308 
1 1 1   24   26   11 o   45.461   4.5213   43.515   7.4492   49.168   14.866   41.620   8.6078   46.747   7.7103   44.176   4.7244 2.571503 9.042613 
1 1 1   24   26   12 o   41.879   4.8204   42.876   7.0121   31.204   12.715   47.977   8.4059   36.206   8.6359   47.553   4.2859 -11.34662 9.640892 
1 1 1   24   26   13 o   44.786   4.4970   46.108   7.2054   40.544   13.036   48.556   8.6464   41.790   7.8514   47.783   4.3873 -5.992840 8.994060 
1 1 1   24   26   14 o   49.858   3.7926   50.747   7.1777   61.915   13.521   46.364   8.4697   53.074   6.1766   46.642   4.4028 6.432430 7.585186 
1 1 1   24   26   15 o   82.021   2.9258  143.580   9.4305  141.611   15.873  144.654   11.724   81.190   4.7403   82.852   3.4309 -1.661980 5.851573 
1 1 1   24   26   16 o   61.979   3.3767   82.640   8.0522   82.723   14.166   82.601   9.7872   61.527   5.5822   62.431   3.8009 -0.9039764 6.753331 
1 1 1   24   26   17 o   32.903   5.3096   27.112   6.6820   19.936   12.536   29.959   7.8974   28.622   9.2871   37.184   5.1494 -8.562302 10.61918 
1 1 1   24   26   18 o   50.884   4.4822   59.967   8.8793   47.750   14.086   68.022   11.438   45.670   7.4782   56.099   4.9434 -10.42834 8.964379 
1 1 1   24   26   19 o   19.055   5.8123   1.4800   8.4149   5.6188   12.097  -2.4000   11.713   20.716   8.6031   17.394   7.8179 3.321745 11.62462 
1 1 1   24   26   20 o   27.681   5.9089   19.966   8.7342   0.2238   15.409   29.312   10.602   20.380   9.0766   34.983   7.5680 -14.60290 11.81775 
1 1 1   24   26   21 o   21.944   6.0221   9.6693   7.7906   6.7353   12.684   11.447   9.8724   21.254   8.8164   22.635   8.2058 -1.380585 12.04423 
1 1 1   24   26   22 o   19.152   5.7898   2.1938   8.0091   8.2143   12.809  -1.6707   10.262   21.892   8.9468   16.413   7.3514 5.479145 11.57964 
1 1 1   24   26   23 o   14.572   4.9222 -11.1682   7.8518  -7.8258   12.993 -13.0909   9.8547   16.419   7.6839   12.724   6.1539 3.694763 9.844402 
1 1 1   24   26   24 o   21.285   6.1301   8.2417   8.5616   4.4577   13.281   10.933   11.200   20.247   8.7337   22.323   8.6045 -2.075972 12.26030 
1 1 1   24   26   25 o   42.393   6.9294   43.799   11.044   35.676   13.042   64.381   20.761   37.093   8.6792   47.693   10.805 -10.60025 13.85886 
1 1 1   24   27    0 o   64.942   2.5991   88.655   9.7731   88.655   9.7731   88.655   9.7731   64.942   3.6756   64.942   3.6756 0.000000 0.000000 
1 1 1   24   27    1 o   20.178   5.3790   6.9510   5.8048   9.2983   10.143   5.8079   7.0784   22.102   8.2641   18.255   6.8877 3.846849 10.75806 
1 1 1   24   27    2 o   32.971   4.9471   24.946   6.3064   22.798   10.834   26.047   7.7559   31.144   8.2883   34.799   5.4038 -3.655672 9.894283 
1 1 1   24   27    3 f   75.689   2.8328  121.650   8.5090  118.246   13.972  123.657   10.728   74.592   4.5415   76.786   3.3874 -2.194313 5.665648 
1 1 1   24   27    4 o   23.511   5.4508   12.445   6.0404   9.2244   10.600   13.993   7.3506   22.243   8.4201   24.780   6.9243 -2.537188 10.90154 
1 1 1   24   27    5 o   29.501   6.3961   19.422   7.5836   22.251   15.970   18.598   8.6172   30.620   10.494   28.383   7.3152 2.237782 12.79215 
1 1 1   24   27    6 o   36.663   5.8055   25.447   7.6053   47.105   16.058   19.183   8.6353   44.502   9.0568   28.825   7.2658 15.67719 11.61107 
1 1 1   24   27    7 o   54.762   3.9977   67.410   7.8071   59.446   14.970   70.385   9.1500   51.757   7.0126   57.766   3.8404 -6.009026 7.995306 
1 1 1   24   27    8 o   28.167   5.3352   20.309   6.5548   7.9400   13.251   24.316   7.5423   22.770   9.1747   33.564   5.4483 -10.79435 10.67045 
1 1 1   24   27    9 o   61.736   3.5630   79.797   8.0631   86.307   15.697   77.464   9.3977   62.868   6.0535   60.605   3.7597 2.263500 7.126062 
1 1 1   24   27   10 o  143.501   3.1099  431.521   18.406   0.0000   0.0000  431.521   18.406  ?   ?   143.501   3.1099      ?      ? 
1 1 1   24   27   11 o   52.406   3.9929   63.190   7.6489   51.506   13.762   68.413   9.2009   47.979   6.9545   56.833   3.9252 -8.854206 7.985735 
1 1 1   24   27   12 o   64.934   3.2951   93.230   8.0977   82.829   14.185   98.257   9.8625   61.616   5.5818   68.252   3.5036 -6.635403 6.590224 
1 1 1   24   27   13 o  104.612   3.2457  240.609   12.328  221.545   23.347  247.979   14.517  100.651   5.6239  108.573   3.2418 -7.921890 6.491351 
1 1 1   24   27   14 o   88.258   3.5472  178.390   11.001  147.403   21.138  189.901   12.883   81.528   6.2861   94.987   3.2885 -13.45843 7.094326 
1 1 1   24   27   15 o   42.653   5.7749   45.239   7.7656   38.713   17.469   46.847   8.6693   38.548   10.639   46.758   4.4953 -8.210125 11.54989 
1 1 1   24   27   16 o   24.145   5.9217   12.170   6.5215   16.466   12.832   10.674   7.5723   26.488   9.3843   21.803   7.2249 4.685089 11.84334 
1 1 1   24   27   17 o   46.429   4.1827   46.983   7.3481   49.822   13.462   45.778   8.7697   46.779   6.9776   46.079   4.6144 0.7002831 8.365396 
1 1 1   24   27   18 o   18.562   5.7720   0.1480   8.6145  -3.2271   12.084   3.6354   12.284   17.279   7.8368   19.845   8.4764 -2.565601 11.54404 
1 1 1   24   27   19 o   30.186   6.5805   23.554   8.7747   21.508   15.765   24.473   10.562   28.868   10.383   31.503   8.0875 -2.635036 13.16102 
1 1 1   24   27   20 f   35.678   5.8359   32.318   8.3680   27.163   13.165   35.812   10.840   32.354   9.3431   39.003   6.9955 -6.648506 11.67175 
1 1 1   24   27   21 o   47.176   4.6359   49.987   8.9018   62.628   13.623   40.567   11.760   52.460   6.2961   41.891   6.8062 10.56910 9.271792 
1 1 1   24   27   22 o   52.196   4.5236   64.595   9.3160   50.215   14.086   75.775   12.420   45.911   7.4391   58.481   5.1491 -12.57051 9.047296 
1 1 1   24   27   23 o   54.640   4.7102   73.177   9.5730   49.213   14.271   92.782   12.908   44.396   8.0918   64.884   4.8234 -20.48784 9.420382 
1 1 1   24   27   24 o   34.479   6.2326   32.731   9.0559   24.558   14.631   37.806   11.530   29.636   10.045   39.321   7.3805 -9.684477 12.46514 
1 1 1   24   28    0 o   63.582   3.3401   86.206   12.230   86.206   12.230   86.206   12.230   63.582   4.7236   63.582   4.7236 0.000000 0.000000 
1 1 1   24   28    1 o   34.793   5.1831   28.214   7.3586   19.622   10.551   36.351   10.268   28.813   8.3771   40.773   6.1058 -11.95942 10.36617 
1 1 1   24   28    2 o   20.545   4.9568   8.1463   6.0018  -5.2469   10.387   14.860   7.3537   15.651   7.1621   25.439   6.8544 -9.788038 9.913574 
1 1 1   24   28    3 o   43.152   4.0049   38.616   6.8163   46.769   11.871   34.605   8.3257   46.168   6.2339   40.136   5.0294 6.031876 8.009808 
1 1 1   24   28    4 f   64.662   3.7921   83.675   8.4109  103.122   18.569   78.655   9.4341   68.277   6.5941   61.046   3.7469 7.230747 7.584294 
1 1 1   24   28    5 o   24.141   5.4067   13.959   7.3860 -11.4324   15.571   21.330   8.3899   17.839   8.3686   30.442   6.8481 -12.60249 10.81339 
1 1 1   24   28    6 o   33.597   5.2193   27.496   6.7595   21.365   11.966   30.369   8.1919   29.732   8.9920   37.462   5.3018 -7.729605 10.43869 
1 1 1   24   28    7 o   22.342   5.1388   11.478   6.1260  -0.5366   11.150   16.672   7.3316   17.808   7.8360   26.876   6.6503 -9.067581 10.27763 
1 1 1   24   28    8 o   32.760   5.2970   25.028   6.6366   24.281   12.220   25.341   7.9038   31.460   8.9764   34.059   5.6265 -2.598675 10.59403 
1 1 1   24   28    9 o   46.326   5.2284   56.618   7.7250   35.911   15.147   63.897   8.9808   37.807   9.6738   54.845   3.9702 -17.03862 10.45682 
1 1 1   24   28   10 o   31.546   5.4380   24.229   6.6164   20.150   12.870   25.694   7.7137   28.754   9.4140   34.338   5.4465 -5.584831 10.87598 
1 1 1   24   28   11 f   30.185   5.5433   22.304   6.6033   19.134   12.481   23.536   7.7815   28.137   9.2733   32.233   6.0762 -4.096159 11.08669 
1 1 1   24   28   12 o   33.837   5.1518   31.642   6.8292   13.553   12.534   39.279   8.1442   24.906   9.2112   42.769   4.6170 -17.86279 10.30354 
1 1 1   24   28   13 o   58.497   3.4266   70.808   7.7033   82.587   14.065   65.761   9.2070   61.415   5.5528   55.579   4.0164 5.835930 6.853107 
1 1 1   24   28   14 o   94.314   2.8363  195.084   10.553  167.620   16.873  212.726   13.524   88.182   4.6393  100.446   3.2643 -12.26299 5.672680 
1 1 1   24   28   15 f   26.239   5.3750   18.132   6.6706   5.6799   12.622   22.958   7.8577   20.903   8.7429   31.576   6.2548 -10.67320 10.74992 
1 1 1   24   28   16 o   81.249   3.0095  140.145   9.4176  146.974   16.735  136.980   11.393   82.103   4.9421   80.395   3.4358 1.707413 6.019068 
1 1 1   24   28   17 o   24.629   6.0514   11.208   7.8273   24.895   12.989   3.4030   9.8081   31.045   9.3641   18.212   7.6675 12.83310 12.10278 
1 1 1   24   28   18 o   31.641   6.9858   24.705   10.423   38.652   16.330   15.116   13.541   37.925   10.212   25.357   9.5350 12.56798 13.97168 
1 1 1   24   28   19 o   28.993   5.5311   21.162   8.3488   1.9500   12.640   36.031   11.120   19.164   8.3898   38.822   7.2100 -19.65891 11.06219 
1 1 1   24   28   20 o   64.332   3.9573   96.049   9.9844   67.473   14.590  121.216   13.693   54.042   6.5458   74.623   4.4489 -20.58062 7.914555 
1 1 1   24   28   21 o   40.356   5.6297   41.054   9.0776   33.720   13.436   47.215   12.313   35.688   9.0999   45.023   6.6308 -9.335049 11.25947 
1 1 1   24   28   22 o   72.242   3.6608  117.521   10.708  108.181   16.311  124.596   14.196   69.091   5.7240   75.393   4.5653 -6.301888 7.321623 
1 1 1   24   29    0 f   14.122   6.1095   4.4501   9.5991   4.4501   9.5991   4.4501   9.5991   14.122   8.6402   14.122   8.6402 0.000000 0.000000 
1 1 1   24   29    1 o   25.892   5.8738   15.702   7.1573   18.267   10.213   13.227   10.033   27.617   8.2975   24.167   8.3161 3.450064 11.74764 
1 1 1   24   29    2 f   29.908   5.7523   21.563   7.2920   20.241   10.663   22.724   9.9942   28.952   8.4228   30.865   7.8366 -1.913330 11.50457 
1 1 1   24   29    3 o   32.695   4.9918   28.700   6.5906   12.322   11.391   36.941   8.0803   23.942   8.7938   41.448   4.7267 -17.50524 9.983656 
1 1 1   24   29    4 o   23.851   6.1496   11.740   6.6754   11.425   15.906   11.807   7.3545   24.971   10.055   22.730   7.0824 2.241039 12.29921 
1 1 1   24   29    5 o   19.769   5.9850   2.5367   6.8960   8.0094   16.181   1.3221   7.6230   23.741   9.9119   15.797   6.7107 7.944190 11.96992 
1 1 1   24   29    6 o   58.692   3.2720   70.806   7.5608   84.639   13.201   64.054   9.2234   62.517   5.1198   54.867   4.0758 7.649536 6.544051 
1 1 1   24   29    7 o   21.595   5.6600   8.8149   6.1589   11.788   11.680   7.6697   7.2485   23.718   8.8681   19.471   7.0355 4.246294 11.31995 
1 1 1   24   29    8 o   44.950   4.6642   50.984   7.1830   32.808   12.518   59.906   8.7705   36.828   8.4241   53.071   4.0068 -16.24350 9.328456 
1 1 1   24   29    9 o   98.759   2.7287  210.666   10.548  195.023   17.587  219.453   13.182   95.357   4.4718  102.162   3.1284 -6.805466 5.457439 
1 1 1   24   29   10 o   54.308   3.8046   64.669   7.8175   63.811   14.082   65.052   9.3987   53.415   6.3920   55.200   4.1282 -1.784912 7.609219 
1 1 1   24   29   11 o   41.244   4.7823   39.085   7.1505   38.521   13.108   39.323   8.5317   39.889   8.2402   42.599   4.8559 -2.709351 9.564531 
1 1 1   24   29   12 o   69.553   3.2039  103.547   8.5707  106.760   15.198  102.049   10.378   69.785   5.2804   69.321   3.6299 0.4639664 6.407767 
1 1 1   24   29   13 o   45.280   4.5824   48.555   7.4778   41.983   13.224   51.644   9.0665   41.663   7.9864   48.896   4.4957 -7.233063 9.164850 
1 1 1   24   29   14 o   21.733   5.3869   10.689   6.6033  -1.4670   12.392   15.509   7.8034   17.995   8.0678   25.471   7.1404 -7.476431 10.77383 
1 1 1   24   29   15 o   45.103   4.2725   43.810   7.3956   51.030   13.492   40.709   8.8425   47.053   6.9522   43.152   4.9682 3.900406 8.544931 
1 1 1   24   29   16 o   41.021   5.2973   46.981   7.5928   25.111   13.694   56.689   9.1236   30.815   9.6746   51.227   4.3182 -20.41246 10.59459 
1 1 1   24   29   17 o   31.072   6.3001   24.953   8.3936   25.751   13.236   24.417   10.855   31.107   9.4686   31.038   8.3132 0.6908226E-01 12.60012 
1 1 1   24   29   18 o   64.279   4.3382   97.573   10.624   83.433   17.952  105.195   13.180   59.205   7.3516   69.352   4.6079 -10.14644 8.676334 
1 1 1   24   29   19 o   64.570   3.8756   96.356   9.9007   70.787   14.482  118.791   13.566   55.384   6.3400   73.756   4.4594 -18.37207 7.751293 
1 1 1   24   29   20 o   55.516   4.1549   71.523   9.2669   59.495   13.807   81.382   12.501   50.461   6.6343   60.570   5.0039 -10.10885 8.309762 
1 1 1   24   30    0 o   44.412   4.6600   44.850   11.290   44.850   11.290   44.850   11.290   44.412   6.5903   44.412   6.5903 0.000000 0.000000 
1 1 1   24   30    1 o   34.149   5.4756   28.039   7.6130   21.380   10.767   34.697   10.766   29.606   8.4184   38.691   7.0042 -9.085512 10.95113 
1 1 1   24   30    2 o   34.104   5.4853   27.745   7.5348   28.489   10.934   27.072   10.398   34.491   7.8610   33.718   7.6522 0.7729759 10.97050 
1 1 1   24   30    3 o   28.439   5.0976   19.200   8.4575 -10.3285   14.098   35.803   10.571   16.874   7.9306   40.004   6.4069 -23.13079 10.19527 
1 1 1   24   30    4 o   59.459   4.1754   85.865   8.4963   62.404   16.142   94.857   9.9926   52.010   7.5248   66.908   3.6211 -14.89822 8.350731 
1 1 1   24   30    5 o   45.772   4.1443   45.658   7.5960   49.414   12.492   43.454   9.5682   46.909   6.4566   44.636   5.1974 2.273392 8.288525 
1 1 1   24   30    6 o   83.549   2.8764  150.011   9.4021  146.212   15.914  152.049   11.654   82.251   4.6909   84.846   3.3301 -2.595100 5.752769 
1 1 1   24   30    7 o   23.690   5.6157   13.314   6.3497   9.6909   11.776   14.799   7.5397   22.365   8.7665   25.016   7.0208 -2.651068 11.23133 
1 1 1   24   30    8 o   31.359   5.4407   19.414   6.7472   38.960   12.744   11.802   7.9534   40.151   7.9768   22.568   7.4009 17.58255 10.88135 
1 1 1   24   30    9 o   20.930   4.9642   8.8010   6.5281 -12.1990   12.194   17.237   7.7288   14.924   7.1194   26.936   6.9201 -12.01139 9.928384 
1 1 1   24   30   10 o   64.415   3.3198   87.581   8.4051   98.442   14.560   82.153   10.293   66.903   5.2766   61.927   4.0300 4.975574 6.639584 
1 1 1   24   30   11 f   53.121   3.6901   59.350   7.5870   69.976   13.678   54.628   9.1183   55.931   5.9293   50.311   4.3943 5.619469 7.380135 
1 1 1   24   30   12 o   15.990   4.6827  -0.8592   6.2189 -22.6938   11.492   8.1823   7.3953   12.331   6.1013   19.649   7.1053 -7.317434 9.365427 
1 1 1   24   30   13 o   53.311   3.9805   66.372   8.0541   53.673   13.497   73.394   10.037   48.251   6.7821   58.371   4.1691 -10.11991 7.961025 
1 1 1   24   30   14 o   29.039   5.6827   21.679   6.7546   18.494   12.860   22.893   7.9375   26.862   9.4054   31.216   6.3806 -4.353653 11.36548 
1 1 1   24   30   15 o   16.332   5.1798  -0.5206   6.3832  -0.2529   12.692  -0.6113   7.3852   18.310   8.1901   14.354   6.3437 3.956080 10.35954 
1 1 1   24   30   16 o   37.921   5.3012   38.331   7.3296   26.716   13.247   43.455   8.7992   31.412   9.4526   44.429   4.8019 -13.01716 10.60237 
1 1 1   24   30   17 o   22.322   6.5162   9.5128   9.8418   4.8230   15.618   12.602   12.675   21.250   9.3140   23.394   9.1157 -2.144035 13.03249 
1 1 1   24   30   18 o   33.474   5.7229   30.354   8.4841   16.525   13.216   40.047   11.065   25.427   9.4477   41.521   6.4613 -16.09437 11.44586 
1 1 1   24   31    0 o   18.363   6.9156   11.418   10.044   11.418   10.044   11.418   10.044   18.363   9.7802   18.363   9.7802 0.000000 0.000000 
1 1 1   24   31    1 o   29.926   5.7500   22.114   7.5518   29.318   10.729   15.041   10.631   34.823   7.6770   25.028   8.5623 9.794933 11.50000 
1 1 1   24   31    2 o   18.093   5.3800   1.0866   7.4092  -8.2358   10.901   9.0895   10.101   14.883   6.9883   21.303   8.1818 -6.419416 10.76007 
1 1 1   24   31    3 o   31.499   6.0789   26.832   8.6266   14.740   14.572   33.355   10.704   25.461   9.8147   37.537   7.1753 -12.07590 12.15783 
1 1 1   24   31    4 o   15.880   5.0521  -2.3304   6.9624  -4.7415   10.428  -0.3915   9.3519   15.525   7.1309   16.234   7.1585 -0.7098179 10.10418 
1 1 1   24   31    5 o   20.311   5.8808   5.9337   7.8455   3.1915   10.524   9.3646   11.771   18.556   7.8839   22.065   8.7279 -3.508671 11.76152 
1 1 1   24   31    6 o   26.443   5.5583   17.812   6.6553   11.813   11.541   20.802   8.1463   23.244   8.7888   29.642   6.8069 -6.398077 11.11653 
1 1 1   24   31    7 o   43.475   4.2532   41.654   7.1558   44.832   12.626   40.150   8.6854   44.081   6.9445   42.868   4.9123 1.212360 8.506310 
1 1 1   24   31    8 o   31.363   5.5601   22.640   6.7338   29.132   12.316   19.872   8.0423   33.843   8.7567   28.883   6.8541 4.959757 11.12020 
1 1 1   24   31    9 o   36.646   5.2014   35.368   7.1868   22.779   12.362   41.795   8.8328   29.615   9.1748   43.677   4.9031 -14.06219 10.40281 
1 1 1   24   31   10 o   20.530   5.6319   7.6902   6.4312   11.625   11.429   5.8669   7.7797   22.891   8.7244   18.169   7.1244 4.721853 11.26375 
1 1 1   24   31   11 o   17.794   5.3635   3.0298   6.3473   4.2437   11.962   2.5539   7.4887   19.568   8.3616   16.019   6.7196 3.548870 10.72705 
1 1 1   24   31   12 o   40.200   4.8436   37.969   7.3517   38.703   12.691   37.598   9.0190   39.340   8.0918   41.059   5.3257 -1.719254 9.687130 
1 1 1   24   31   13 o   55.088   3.8161   70.078   7.9948   61.250   13.705   74.631   9.8430   51.429   6.4613   58.747   4.0623 -7.318260 7.632244 
1 1 1   24   31   14 o   74.912   3.1829  126.650   9.0975  110.937   15.583  134.775   11.205   70.363   5.3696   79.460   3.4191 -9.096466 6.365745 
1 1 1   24   31   15 o   26.191   5.7166   18.204   6.8143   12.587   12.876   20.389   8.0313   23.401   9.1683   28.982   6.8306 -5.580570 11.43312 
1 1 1   24   32    0 o   88.358   2.8289  165.400   14.512  165.400   14.512  165.400   14.512   88.358   4.0007   88.358   4.0007 0.000000 0.000000 
1 1 1   24   32    1 o   25.264   5.9743   15.700   7.4169   12.487   10.488   18.916   10.490   23.180   8.4493   27.347   8.4485 -4.166534 11.94855 
1 1 1   24   32    2 o   52.290   5.2106   69.917   9.7210   47.668   15.856   83.317   12.305   42.929   9.2295   61.651   4.8392 -18.72265 10.42121 
1 1 1   24   32    3 o   23.669   6.1510   13.299   8.2419   4.8347   14.482   17.354   10.023   21.040   9.0980   26.297   8.2804 -5.256872 12.30197 
1 1 1   24   32    4 o   16.570   5.0063  -4.4581   7.2139 -20.4228   10.541   9.6058   9.8937   11.863   5.8647   21.277   8.1152 -9.414084 10.01258 
1 1 1   24   32    5 o   58.482   4.0314   76.339   9.6370   72.723   12.696   81.254   14.802   57.119   5.3894   59.845   5.9969 -2.726753 8.062741 
1 1 1   24   32    6 o   41.974   4.9806   42.998   8.1041   31.897   11.900   52.599   11.067   35.501   8.2795   48.446   5.5386 -12.94488 9.961226 
1 1 1   24   32    7 o   65.970   3.2005   98.644   8.2348   80.935   13.218  109.878   10.528   60.242   5.3197   71.698   3.5600 -11.45600 6.401058 
1 1 1   24   32    8 o   69.657   3.1071  106.210   8.4651  103.909   14.318  107.446   10.496   68.457   5.0712   70.858   3.5914 -2.401314 6.214114 
1 1 1   24   32    9 o   58.092   3.4731   74.333   7.9698   75.356   13.315   73.762   9.9486   57.837   5.5819   58.347   4.1341 -0.5097504 6.946151 
1 1 1   24   32   10 o   30.899   5.5495   23.417   6.7331   26.168   11.987   22.149   8.1382   31.454   8.8614   30.344   6.6832 1.109118 11.09904 
1 1 1   24   32   11 o   53.945   6.0315   92.310   10.579   33.880   18.550  120.476   12.879   33.410   11.311   74.480   4.1926 -41.06981 12.06298 
1 1 1   24   33    0 o   26.506   7.4618   22.281   11.152   22.281   11.152   22.281   11.152   26.506   10.553   26.506   10.553 0.000000 0.000000 
1 1 1   24   33    1 o   50.722   4.1638   58.553   8.7085   60.135   12.472   57.048   12.166   51.394   5.8836   50.050   5.8934 1.344070 8.327576 
1 1 1   24   33    2 o   21.918   6.2963   8.3995   8.5189   14.976   14.626   5.0224   10.480   24.846   9.7602   18.991   7.9568 5.855009 12.59257 
1 1 1   24   33    3 o   45.922   4.4306   48.426   8.3703   53.340   12.256   44.131   11.459   48.172   6.1685   43.673   6.3617 4.498047 8.861271 
1 1 1   24   33    4 o   24.432   5.9202   14.774   7.5459   8.7125   11.054   20.063   10.326   20.998   8.4083   27.866   8.3365 -6.867979 11.84050 
1 1 1   24   33    5 o   43.910   5.2409   46.159   9.1597   36.970   12.338   57.443   13.672   38.292   8.0667   49.528   6.6930 -11.23608 10.48183 
1 1 1   24   33    6 o   49.061   4.3494   56.460   8.5345   44.463   12.508   66.912   11.675   43.331   6.9985   54.791   5.1661 -11.45966 8.698734 
1 1 1   25    0    1 o  343.606   2.8402  2439.33   56.907  2439.33   56.907  2439.33   56.907  343.606   4.0167  343.606   4.0167 0.000000 0.000000 
1 1 1   25    0    2 o  202.751   2.2598  849.160   26.710  849.160   26.710  849.160   26.710  202.751   3.1959  202.751   3.1959 0.000000 0.000000 
1 1 1   25    0    3 o   36.772   4.6755   30.539   9.0643   30.539   9.0643   30.539   9.0643   36.772   6.6122   36.772   6.6122 0.000000 0.000000 
1 1 1   25    0    4 f   99.373   2.3312  204.519   13.478  204.519   13.478  204.519   13.478   99.373   3.2967   99.373   3.2967 0.000000 0.000000 
1 1 1   25    0    5 o   12.161   5.4363   1.1963   8.2552   1.1963   8.2552   1.1963   8.2552   12.161   7.6881   12.161   7.6881 0.000000 0.000000 
1 1 1   25    0    6 o  131.892   2.4776  359.904   19.030  359.904   19.030  359.904   19.030  131.892   3.5039  131.892   3.5039 0.000000 0.000000 
1 1 1   25    0    7 o  152.469   2.5167  480.766   22.354  480.766   22.354  480.766   22.354  152.469   3.5591  152.469   3.5591 0.000000 0.000000 
1 1 1   25    0    8 o  255.083   3.4109  1346.38   50.708  1346.38   50.708  1346.38   50.708  255.083   4.8237  255.083   4.8237 0.000000 0.000000 
1 1 1   25    0    9 o  137.155   2.9899  389.768   23.868  389.768   23.868  389.768   23.868  137.155   4.2283  137.155   4.2283 0.000000 0.000000 
1 1 1   25    0   10 o   99.875   2.6184  206.867   15.206  206.867   15.206  206.867   15.206   99.875   3.7030   99.875   3.7030 0.000000 0.000000 
1 1 1   25    0   11 o   18.153   6.5499   10.056   8.7399   10.056   8.7399   10.056   8.7399   18.153   9.2629   18.153   9.2629 0.000000 0.000000 
1 1 1   25    0   12 o   88.683   2.4751  163.188   12.758  163.188   12.758  163.188   12.758   88.683   3.5003   88.683   3.5003 0.000000 0.000000 
1 1 1   25    0   13 o  111.694   2.3356  258.322   15.186  258.322   15.186  258.322   15.186  111.694   3.3030  111.694   3.3030 0.000000 0.000000 
1 1 1   25    0   14 o   73.968   2.7074  113.966   11.610  113.966   11.610  113.966   11.610   73.968   3.8289   73.968   3.8289 0.000000 0.000000 
1 1 1   25    0   15 o  161.024   2.2143  536.088   20.780  536.088   20.780  536.088   20.780  161.024   3.1315  161.024   3.1315 0.000000 0.000000 
1 1 1   25    0   16 o  191.074   2.6836  755.529   29.882  755.529   29.882  755.529   29.882  191.074   3.7952  191.074   3.7952 0.000000 0.000000 
1 1 1   25    0   17 o  167.772   3.2731  584.130   31.975  584.130   31.975  584.130   31.975  167.772   4.6288  167.772   4.6288 0.000000 0.000000 
1 1 1   25    0   18 o   62.381   3.2253   81.875   11.591   81.875   11.591   81.875   11.591   62.381   4.5613   62.381   4.5613 0.000000 0.000000 
1 1 1   25    0   19 o  160.913   2.6570  536.595   24.908  536.595   24.908  536.595   24.908  160.913   3.7576  160.913   3.7576 0.000000 0.000000 
1 1 1   25    0   20 o   49.649   4.3937   53.648   12.184   53.648   12.184   53.648   12.184   49.649   6.2136   49.649   6.2136 0.000000 0.000000 
1 1 1   25    0   21 o   49.049   4.4314   52.509   12.112   52.509   12.112   52.509   12.112   49.049   6.2670   49.049   6.2670 0.000000 0.000000 
1 1 1   25    0   22 o   20.245   7.3472   12.789   11.034   12.789   11.034   12.789   11.034   20.245   10.391   20.245   10.391 0.000000 0.000000 
1 1 1   25    0   23 o   79.443   3.0618  132.088   14.091  132.088   14.091  132.088   14.091   79.443   4.3300   79.443   4.3300 0.000000 0.000000 
1 1 1   25    0   24 o  112.166   2.7085  261.862   17.674  261.862   17.674  261.862   17.674  112.166   3.8304  112.166   3.8304 0.000000 0.000000 
1 1 1   25    0   25 o   12.722   6.2228 -11.7343   15.746 -11.7343   15.746 -11.7343   15.746   12.722   8.8004   12.722   8.8004 0.000000 0.000000 
1 1 1   25    0   26 o   36.364   7.3232   34.061   13.459   34.061   13.459   34.061   13.459   36.364   10.357   36.364   10.357 0.000000 0.000000 
1 1 1   25    0   27 o   43.198   5.5036   42.857   12.530   42.857   12.530   42.857   12.530   43.198   7.7832   43.198   7.7832 0.000000 0.000000 
1 1 1   25    0   28 o   16.026   6.7260   6.4582   10.937   6.4582   10.937   6.4582   10.937   16.026   9.5120   16.026   9.5120 0.000000 0.000000 
1 1 1   25    0   29 o   17.497   7.1750   8.5518   11.967   8.5518   11.967   8.5518   11.967   17.497   10.147   17.497   10.147 0.000000 0.000000 
1 1 1   25    0   30 f   21.516   7.9765   15.055   13.201   15.055   13.201   15.055   13.201   21.516   11.281   21.516   11.281 0.000000 0.000000 
1 1 1   25    0   31 o   42.547   6.1134   42.994   13.428   42.994   13.428   42.994   13.428   42.547   8.6456   42.547   8.6456 0.000000 0.000000 
1 1 1   25    0   32 o   13.587   6.1538   1.4652   10.995   1.4652   10.995   1.4652   10.995   13.587   8.7028   13.587   8.7028 0.000000 0.000000 
1 1 1   25    0   33 o   33.723   7.0538   30.217   12.066   30.217   12.066   30.217   12.066   33.723   9.9756   33.723   9.9756 0.000000 0.000000 
1 1 1   25    0   34 o   50.477   8.2806   65.109   21.208   65.109   21.208   65.109   21.208   50.477   11.710   50.477   11.710 0.000000 0.000000 
1 1 1   25    0   35 f   57.293   7.9147   81.362   23.560   81.362   23.560   81.362   23.560   57.293   11.193   57.293   11.193 0.000000 0.000000 
1 1 1   25    0   36 o   22.671   9.7168   16.701   23.782   16.701   23.782   16.701   23.782   22.671   13.742   22.671   13.742 0.000000 0.000000 
1 1 1   25    0   37 o   37.216   10.748   47.344   22.967   47.344   22.967   47.344   22.967   37.216   15.201   37.216   15.201 0.000000 0.000000 
1 1 1   25    1    0 o  194.022   2.2419  777.646   25.357  777.646   25.357  777.646   25.357  194.022   3.1706  194.022   3.1706 0.000000 0.000000 
1 1 1   25    1    1 o  152.391   2.1690  479.730   13.633  479.998   19.318  479.463   19.241  152.433   3.0727  152.349   3.0622 0.8404541E-01 4.338033 
1 1 1   25    1    2 o  118.726   2.2150  291.195   10.845  298.375   15.398  284.127   15.277  120.179   3.1064  117.271   3.1585 2.907845 4.430073 
1 1 1   25    1    3 o  158.176   2.1835  516.815   14.244  513.257   19.996  520.480   20.294  157.624   3.0758  158.727   3.1000 -1.103088 4.366924 
1 1 1   25    1    4 o  112.509   2.2388  261.345   10.385  251.383   14.489  271.866   14.891  110.305   3.1849  114.713   3.1474 -4.408493 4.477624 
1 1 1   25    1    5 o   55.889   3.1453   64.734   7.2408   61.569   10.314   67.811   10.168   54.534   4.5855   57.245   4.3065 -2.711048 6.290679 
1 1 1   25    1    6 o  222.232   2.3266  1020.52   21.325  1026.07   30.239  1015.03   30.076  222.833   3.2902  221.631   3.2903 1.201767 4.653108 
1 1 1   25    1    7 o  116.447   2.5913  280.200   12.442  273.727   17.343  287.063   17.859  115.063   3.6545  117.831   3.6749 -2.768005 5.182632 
1 1 1   25    1    8 o  141.018   2.7806  411.449   15.956  411.878   20.929  410.854   24.655  141.142   3.5953  140.895   4.2428 0.2470551 5.561212 
1 1 1   25    1    9 o   77.806   3.4004  125.428   10.886  137.353   15.592  114.087   15.206   81.426   4.6427   74.185   4.9696 7.240631 6.800868 
1 1 1   25    1   10 o   91.215   2.6814  172.075   10.082  164.092   14.127  180.361   14.392   89.055   3.8462   93.374   3.7371 -4.319046 5.362788 
1 1 1   25    1   11 o   97.145   2.5042  195.585   9.9608  191.756   14.936  198.651   13.368   96.268   3.7616   98.021   3.3065 -1.752586 5.008313 
1 1 1   25    1   12 o   49.796   3.4246   51.481   7.0210   47.842   9.9063   55.155   9.9524   48.016   5.0022   51.575   4.6787 -3.559128 6.849206 
1 1 1   25    1   13 o   60.309   2.9661   75.354   7.3774   74.821   10.365   75.902   10.503   60.093   4.1819   60.524   4.2074 -0.4309616 5.932115 
1 1 1   25    1   14 o   67.129   2.7838   93.321   7.7065   91.860   10.799   94.836   11.001   66.594   3.9318   67.664   3.9419 -1.069511 5.567575 
1 1 1   25    1   15 o   27.050   5.3135   15.633   6.3967   21.568   8.9996   9.5742   9.0937   31.497   7.0978   22.603   7.9093 8.894054 10.62707 
1 1 1   25    1   16 o   88.906   3.0106  163.823   11.028  174.733   15.824  153.520   15.378   91.791   4.1797   86.021   4.3343 5.770157 6.021253 
1 1 1   25    1   17 o  114.776   3.3932  274.043   16.061  274.409   22.901  273.688   22.531  114.844   4.8348  114.708   4.7624 0.1360703 6.786394 
1 1 1   25    1   18 o  153.518   2.6233  488.615   16.599  495.254   23.991  482.521   22.988  154.504   3.7649  152.531   3.6541 1.972565 5.246632 
1 1 1   25    1   19 o   44.126   4.4691   40.966   8.1141   44.147   11.470   37.778   11.480   45.876   6.0619   42.376   6.5683 3.500126 8.938126 
1 1 1   25    1   20 o   28.191   5.9089   17.019   7.6338   10.841   10.845   23.087   10.747   24.090   8.6173   32.292   8.0871 -8.202158 11.81777 
1 1 1   25    1   21 o   82.140   3.0324  140.602   10.267  147.514   14.636  133.905   14.406   84.141   4.2174   80.138   4.3584 4.003014 6.064776 
1 1 1   25    1   22 o   29.234   6.0580   18.783   7.8048   20.695   10.914   16.781   11.166   30.553   8.3998   27.916   8.7315 2.636665 12.11593 
1 1 1   25    1   23 o   91.036   2.9220  172.829   10.970  173.902   15.444  171.736   15.586   91.329   4.1000   90.743   4.1644 0.5862045 5.843984 
1 1 1   25    1   24 o   69.549   3.3579  101.584   9.6255  102.781   13.413  100.312   13.821   69.998   4.6460   69.100   4.8495 0.8981705 6.715856 
1 1 1   25    1   25 f   59.937   5.7797   80.736   13.413  101.865   18.769   58.686   19.174   69.053   6.5902   50.821   9.4969 18.23195 11.55947 
1 1 1   25    1   26 o  106.514   3.6133  242.348   15.346  252.872   19.629  225.800   24.613  109.855   4.3322  103.172   5.7841 6.683350 7.226616 
1 1 1   25    1   27 o   40.444   5.4878   36.184   8.8986   46.699   12.906   26.654   12.286   46.683   6.7030   34.205   8.6910 12.47731 10.97561 
1 1 1   25    1   28 o   50.665   4.2469   55.089   8.7334   43.441   12.145   67.564   12.568   44.924   6.5545   56.406   5.4023 -11.48223 8.493876 
1 1 1   25    1   29 o   47.357   4.7007   48.357   9.1774   50.318   13.169   46.505   12.797   48.302   6.6105   46.412   6.6849 1.889126 9.401370 
1 1 1   25    1   30 o   71.430   8.3218  123.451   23.866  132.958   33.473  113.620   34.037   75.329   10.774   67.531   12.686 7.797745 16.64362 
1 1 1   25    1   31 o   46.191   4.6846   46.628   8.8695   51.471   12.416   41.581   12.675   48.813   6.1670   43.570   7.0532 5.243088 9.369131 
1 1 1   25    1   32 o   37.794   5.6395   33.145   8.5145   31.998   12.102   34.269   11.982   37.049   8.1420   38.539   7.8055 -1.489811 11.27906 
1 1 1   25    1   33 o   24.299   6.3439   11.200   8.5056   17.288   12.893   6.5079   11.318   27.478   9.4286   21.121   8.4902 6.356840 12.68788 
1 1 1   25    1   34 o   45.246   7.0011   46.502   11.303   42.705   12.915   58.923   23.360   43.552   7.1900   46.941   12.015 -3.389137 14.00229 
1 1 1   25    1   35 o   28.588   8.1433   16.773   14.874   11.102   20.581   22.973   21.520   26.392   11.109   30.783   11.910 -4.390921 16.28665 
1 1 1   25    1   36 o   53.589   8.1883   76.392   17.606   63.482   24.035   91.339   25.862   47.910   12.146   59.268   10.984 -11.35774 16.37654 
1 1 1   25    1   37 o   23.473   7.3543  -9.9146   16.371   22.912   22.694 -45.5293   23.638   29.954   12.029   16.992   8.4647 12.96194 14.70858 
1 1 1   25    2    0 o   49.003   3.5252   51.149   9.8371   51.149   9.8371   51.149   9.8371   49.003   4.9854   49.003   4.9854 0.000000 0.000000 
1 1 1   25    2    1 o  274.416   2.5164  1556.11   28.474  1576.09   40.793  1537.13   39.765  276.129   3.5818  272.703   3.5354 3.425873 5.032754 
1 1 1   25    2    2 o  140.354   2.1904  406.932   12.680  411.706   18.005  402.236   17.859  141.171   3.0923  139.537   3.1032 1.633987 4.380881 
1 1 1   25    2    3 o   84.523   2.4954  147.778   8.6876  156.876   12.305  138.736   12.267   87.125   3.4243   81.922   3.6306 5.202820 4.990723 
1 1 1   25    2    4 o  188.122   2.2243  731.125   17.258  727.680   24.294  734.634   24.520  187.675   3.1385  188.568   3.1527 -0.8930817 4.448600 
1 1 1   25    2    5 o   32.752   4.8530   23.153   6.3432   22.668   9.1119   23.610   8.8357   32.391   7.0229   33.113   6.6996 -0.7217522 9.706002 
1 1 1   25    2    6 o  303.092   2.6501  1898.66   33.116  1870.64   46.096  1928.54   47.607  300.789   3.7157  305.395   3.7796 -4.606171 5.300126 
1 1 1   25    2    7 o  206.888   2.9002  885.636   24.347  885.950   31.714  885.187   37.992  206.993   3.7148  206.783   4.4547 0.2102051 5.800323 
1 1 1   25    2    8 o   97.082   2.9390  195.891   11.626  200.895   15.408  189.275   17.716   98.556   3.7905   95.607   4.4927 2.949242 5.878095 
1 1 1   25    2    9 o  310.022   3.7717  1994.17   48.227  1992.03   68.063  1996.32   68.344  309.858   5.3257  310.186   5.3421 -0.3281860 7.543319 
1 1 1   25    2   10 o  111.995   2.4293  258.137   11.133  268.698   16.981  250.174   14.744  113.979   3.6121  110.011   3.2494 3.967964 4.858603 
1 1 1   25    2   11 o  131.764   2.7266  367.000   14.079  333.400   23.366  386.151   17.640  126.849   4.4661  136.680   3.1292 -9.831413 5.453284 
1 1 1   25    2   12 o  211.231   2.3085  922.612   20.112  921.117   28.408  924.113   28.478  211.060   3.2634  211.403   3.2661 -0.3424835 4.617060 
1 1 1   25    2   13 o   82.335   2.5429  140.252   8.6327  145.259   12.313  135.412   12.107   83.783   3.5632   80.888   3.6289 2.894821 5.085781 
1 1 1   25    2   14 o  190.468   2.2613  750.122   17.762  737.815   24.847  762.982   25.399  188.872   3.1896  192.064   3.2064 -3.191376 4.522670 
1 1 1   25    2   15 o  236.615   2.4004  1158.36   23.424  1143.06   32.882  1174.12   33.376  235.029   3.3921  238.200   3.3973 -3.170349 4.800845 
1 1 1   25    2   16 o   25.125   6.2880   11.850   7.6185   9.0625   14.824   12.850   8.8810   25.429   9.8721   24.821   7.7908 0.6078320 12.57599 
1 1 1   25    2   17 o   92.393   2.8484  177.164   10.836  177.322   14.899  176.987   15.788   92.454   3.9073   92.332   4.1457 0.1219254 5.696829 
1 1 1   25    2   18 o   63.227   3.4596   84.770   8.8562   71.957   13.146   95.416   11.983   58.699   5.4301   67.754   4.2883 -9.054298 6.919184 
1 1 1   25    2   19 o  103.831   2.7423  223.577   11.731  238.561   16.925  209.719   16.276  107.184   3.8284  100.478   3.9274 6.706108 5.484671 
1 1 1   25    2   20 o   96.830   2.8131  195.157   11.219  183.391   15.866  206.924   15.866   93.883   4.0974   99.776   3.8556 -5.892433 5.626220 
1 1 1   25    2   21 o  111.624   2.6752  259.020   12.312  269.303   17.578  249.117   17.249  113.808   3.7448  109.441   3.8214 4.366966 5.350395 
1 1 1   25    2   22 o  154.071   2.9353  496.870   18.038  504.093   22.874  484.990   29.336  155.764   3.5604  152.378   4.6677 3.386261 5.870636 
1 1 1   25    2   23 o  102.523   3.0378  218.259   12.673  226.632   19.753  212.402   16.521  104.093   4.6009  100.954   3.9678 3.138992 6.075510 
1 1 1   25    2   24 o   87.169   3.1796  157.138   11.354  137.012   15.124  183.126   17.187   80.846   4.5358   93.492   4.4571 -12.64611 6.359184 
1 1 1   25    2   25 o   81.042   4.0847  136.324   12.364  132.512   14.577  146.096   23.343   79.511   4.4451   82.574   6.8542 -3.062859 8.169399 
1 1 1   25    2   26 o   46.626   5.7131   47.773   10.181   48.823   17.325   47.219   12.583   46.241   9.4042   47.011   6.4898 -0.7699471 11.42615 
1 1 1   25    2   27 o   78.412   3.3884  128.878   10.937  139.789   16.005  119.319   14.981   81.524   4.7599   75.299   4.8236 6.224915 6.776762 
1 1 1   25    2   28 o  138.838   2.6497  403.070   15.159  379.930   21.209  427.240   21.675  134.729   3.8167  142.947   3.6763 -8.218430 5.299314 
1 1 1   25    2   29 o   23.652   6.2560   9.5620   8.6272   2.3189   12.907   15.411   11.599   20.644   8.7491   26.660   8.9445 -6.016136 12.51198 
1 1 1   25    2   30 o   70.654   3.6674  106.126   10.674  107.945   15.532  104.497   14.694   71.184   5.2902   70.125   5.0806 1.059044 7.334771 
1 1 1   25    2   31 o   28.601   6.2152   18.027   8.3623   26.206   12.281   10.956   11.419   33.443   8.7884   23.759   8.7909 9.683231 12.43045 
1 1 1   25    2   32 o   52.370   6.1024   70.897   11.025   45.740   19.568   82.598   13.345   42.672   11.036   62.068   5.2129 -19.39555 12.20490 
1 1 1   25    2   33 o   61.752   4.0258   82.394   10.231   86.350   15.083   79.022   13.925   63.065   5.7986   60.439   5.5860 2.626297 8.051553 
1 1 1   25    2   34 o   16.353   5.5648 -14.5046   9.7210 -13.7617   11.452 -16.4201   18.389   14.193   6.8050   18.514   8.8069 -4.321389 11.12964 
1 1 1   25    2   35 o   24.648   7.5733   5.4568   14.201   2.4504   18.807   9.4459   21.663   23.069   10.163   26.228   11.231 -3.158495 15.14667 
1 1 1   25    2   36 o   25.668   7.9127   5.7122   15.676   17.331   24.310  -2.5585   20.510   28.990   12.130   22.347   10.164 6.642895 15.82549 
1 1 1   25    2   37 o   35.247   10.370   38.934   23.286   42.872   48.171   37.733   26.601   35.432   15.895   35.063   13.323 0.3696480 20.73971 
1 1 1   25    2   38 o   30.959   12.852   26.398   26.984   0.0000   0.0000   26.398   26.984  ?   ?    30.959   12.852      ?      ? 
1 1 1   25    3    0 o  212.903   2.2890  936.306   28.411  936.306   28.411  936.306   28.411  212.903   3.2371  212.903   3.2371 0.000000 0.000000 
1 1 1   25    3    1 o  119.880   2.2314  296.925   11.032  294.128   15.630  299.703   15.574  119.315   3.1762  120.444   3.1351 -1.128464 4.462853 
1 1 1   25    3    2 f  211.153   2.2843  921.083   19.892  911.612   27.893  930.885   28.376  210.050   3.2197  212.256   3.2413 -2.206070 4.568640 
1 1 1   25    3    3 o   62.486   2.9026   80.764   7.4744   85.233   10.652   76.429   10.491   64.193   4.0233   60.780   4.1848 3.412830 5.805122 
1 1 1   25    3    4 o  224.287   2.3287  1039.42   21.541  1047.27   30.631  1031.74   30.300  225.124   3.2989  223.450   3.2877 1.673920 4.657441 
1 1 1   25    3    5 o  189.365   2.2364  740.832   17.466  746.194   24.847  735.595   24.557  190.041   3.1701  188.688   3.1555 1.352936 4.472868 
1 1 1   25    3    6 o  112.451   2.4017  261.189   11.069  259.909   14.829  262.799   16.635  112.154   3.2057  112.749   3.5772 -0.5946274 4.803483 
1 1 1   25    3    7 o   36.103   5.4253   29.288   7.9429   37.684   10.584   18.461   12.018   42.594   6.0246   29.612   9.0245 12.98252 10.85068 
1 1 1   25    3    8 o  112.263   2.8219  259.147   12.908  250.854   16.867  270.870   20.053  110.133   3.7132  114.392   4.2502 -4.258781 5.643717 
1 1 1   25    3    9 o   27.922   6.0663   16.024   7.6605   13.293   10.247   19.484   11.534   25.673   8.3997   30.171   8.7549 -4.498096 12.13268 
1 1 1   25    3   10 o  228.750   2.5382  1079.05   23.657  1102.88   36.584  1061.92   31.014  230.865   3.8421  226.635   3.3179 4.229431 5.076411 
1 1 1   25    3   11 o   56.732   3.3048   66.907   7.6671   65.262   11.546   68.205   10.255   56.086   4.9911   57.379   4.3332 -1.292839 6.609669 
1 1 1   25    3   12 o  105.405   2.3423  229.598   10.179  236.668   14.633  222.967   14.170  106.976   3.3164  103.834   3.3087 3.141922 4.684660 
1 1 1   25    3   13 o   62.060   2.9260   79.830   7.4863   82.357   10.573   77.290   10.601   63.050   4.0658   61.070   4.2089 1.980015 5.852021 
1 1 1   25    3   14 o   33.522   4.9756   24.576   6.6548   27.691   9.1866   21.136   9.6534   35.901   6.4409   31.144   7.5855 4.756582 9.951137 
1 1 1   25    3   15 f   37.391   4.4912   29.546   6.7418   33.969   9.8107   25.589   9.2802   40.374   5.8916   34.408   6.7804 5.965641 8.982493 
1 1 1   25    3   16 o   62.522   3.9313   80.380   9.0945   83.940   17.371   79.036   10.674   63.321   6.6512   61.722   4.1931 1.599190 7.862633 
1 1 1   25    3   17 f  114.081   2.5333  265.498   11.717  248.101   15.040  292.359   18.689  109.441   3.3320  118.720   3.8168 -9.278954 5.066534 
1 1 1   25    3   18 o  103.745   2.6871  222.555   11.425  230.297   17.275  216.536   15.232  105.312   3.9771  102.178   3.6144 3.133583 5.374109 
1 1 1   25    3   19 o   81.129   3.5720  137.389   11.951  134.599   16.790  140.255   17.014   80.291   5.0702   81.968   5.0327 -1.676941 7.143921 
1 1 1   25    3   20 o   63.535   3.7140   84.730   9.6687   82.269   14.402   86.748   13.045   62.634   5.5751   64.437   4.9086 -1.803055 7.428095 
1 1 1   25    3   21 o   68.953   3.3545   99.733   9.3981   78.839   13.058  122.185   13.536   61.349   5.1608   76.558   4.2869 -15.20946 6.709067 
1 1 1   25    3   22 o   25.175   5.8999   11.763   7.7131   20.350   11.019   3.5149   10.800   30.315   8.4806   20.035   8.2047 10.27963 11.79989 
1 1 1   25    3   23 o   53.195   4.0499   59.688   8.8840   61.219   12.657   58.201   12.473   53.874   5.6962   52.517   5.7584 1.357632 8.099715 
1 1 1   25    3   24 o   54.134   4.1478   62.169   9.2508   63.809   12.905   60.435   13.268   54.911   5.6981   53.358   6.0289 1.552711 8.295530 
1 1 1   25    3   25 o   45.849   6.4932   53.634   10.637   61.505   12.535   33.392   20.103   53.899   5.6388   37.798   11.698 16.10160 12.98648 
1 1 1   25    3   26 o  111.577   3.1874  253.260   14.126  290.427   24.019  233.606   17.467  117.445   4.9586  105.710   4.0061 11.73490 6.374705 
1 1 1   25    3   27 f  104.828   3.0460  230.807   12.993  227.731   20.002  233.052   17.088  104.076   4.6598  105.579   3.9242 -1.502907 6.092053 
1 1 1   25    3   28 o   61.317   3.7988   80.459   9.5231   70.417   13.709   89.823   13.238   57.449   5.7859   65.185   4.9241 -7.736103 7.597533 
1 1 1   25    3   29 o   68.061   6.8564  110.800   13.391   97.834   32.098  113.532   14.734   62.852   12.817   73.271   4.8756 -10.41858 13.71273 
1 1 1   25    3   30 o   83.276   3.2374  146.620   11.108  145.527   16.031  147.630   15.407   82.929   4.6869   83.624   4.4671 -0.6946106 6.474727 
1 1 1   25    3   31 o   46.878   5.1457   47.246   9.5853   39.148   12.308   59.728   15.281   41.605   7.4459   52.151   7.1043 -10.54522 10.29132 
1 1 1   25    3   32 o   16.201   5.2259  -6.7473   7.9297 -12.9389   11.136  -0.3777   11.295   14.229   6.7918   18.173   7.9442 -3.944787 10.45174 
1 1 1   25    3   33 o   49.636   4.4191   53.956   9.0303   58.075   12.872   49.964   12.672   51.593   6.0490   47.679   6.4438 3.913860 8.838181 
1 1 1   25    3   34 o   43.287   6.9753   52.949   11.551   60.317   13.371   31.275   22.933   52.268   6.2026   34.306   12.496 17.96257 13.95057 
1 1 1   25    3   35 o   43.473   7.9405   52.761   15.338   68.948   20.318   31.314   23.387   52.833   9.6809   34.114   12.589 18.71832 15.88099 
1 1 1   25    3   36 o   70.130   6.5574  120.498   18.680  102.595   26.877  137.226   25.980   63.936   10.192   76.324   8.2531 -12.38766 13.11472 
1 1 1   25    3   37 o   35.363   9.7196   41.144   24.220 -19.1602   52.591   57.378   27.286   28.274   13.797   42.453   13.694 -14.17853 19.43925 
1 1 1   25    3   38 o   35.611   13.487   41.125   27.203   0.0000   0.0000   41.125   27.203  ?   ?    35.611   13.487      ?      ? 
1 1 1   25    4    0 o   57.874   3.1063   70.378   10.347   70.378   10.347   70.378   10.347   57.874   4.3930   57.874   4.3930 0.000000 0.000000 
1 1 1   25    4    1 o  165.543   2.1921  566.121   14.966  568.134   21.330  564.169   21.003  165.831   3.1185  165.255   3.0815 0.5761261 4.384174 
1 1 1   25    4    2 o  144.424   2.1890  430.915   13.039  432.943   18.432  428.883   18.448  144.765   3.0870  144.083   3.1044 0.6819305 4.378028 
1 1 1   25    4    3 o  333.852   2.7948  2304.63   38.475  2330.83   55.102  2279.69   53.747  335.697   3.9797  332.007   3.9250 3.689880 5.589601 
1 1 1   25    4    4 o  173.520   2.2087  620.834   15.791  653.395   22.940  591.506   21.771  177.836   3.1275  169.205   3.1196 8.630936 4.417397 
1 1 1   25    4    5 o  170.558   2.2173  601.074   15.596  604.777   21.960  597.305   22.155  171.091   3.1120  170.026   3.1593 1.065048 4.434589 
1 1 1   25    4    6 o  163.089   2.3383  551.373   15.637  566.979   21.179  532.672   23.184  165.655   3.0998  160.523   3.5017 5.131912 4.676661 
1 1 1   25    4    7 o  151.111   2.7714  475.964   17.066  499.243   22.793  446.260   25.747  155.391   3.5564  146.832   4.2515 8.558243 5.542862 
1 1 1   25    4    8 o   99.433   2.9310  205.256   11.870  208.676   15.672  200.654   18.179  100.438   3.7831   98.428   4.4780 2.010124 5.862089 
1 1 1   25    4    9 o  191.608   2.6054  759.328   20.588  752.164   28.853  766.758   29.385  190.690   3.6686  192.526   3.7006 -1.835983 5.210878 
1 1 1   25    4   10 o  119.274   2.4062  295.494   11.742  282.772   17.544  305.817   15.803  116.915   3.6382  121.633   3.1501 -4.718430 4.812445 
1 1 1   25    4   11 o  135.448   2.3488  380.090   13.036  372.921   19.485  385.897   17.538  134.268   3.5186  136.629   3.1123 -2.361832 4.697571 
1 1 1   25    4   12 o  216.023   2.4831  968.066   22.007  938.434   32.564  992.978   29.858  212.932   3.7079  219.115   3.3038 -6.183029 4.966262 
1 1 1   25    4   13 o   45.052   3.8108   42.348   6.9803   33.605   9.6938   51.764   10.060   40.172   5.8506   49.932   4.8847 -9.759224 7.621681 
1 1 1   25    4   14 o  124.254   2.4363  316.339   12.327  300.889   16.032  338.678   19.278  120.607   3.2229  127.901   3.6545 -7.293953 4.872629 
1 1 1   25    4   15 o   37.314   6.2221   35.854   8.7642   14.579   18.794   41.766   9.9073   29.825   11.230   44.803   5.3615 -14.97756 12.44413 
1 1 1   25    4   16 o   71.795   3.6287  102.801   9.7006  117.898   18.729   97.265   11.340   75.114   6.0453   68.477   4.0153 6.637245 7.257331 
1 1 1   25    4   17 o  158.631   2.6347  521.704   17.234  508.783   24.095  535.239   24.660  156.620   3.7300  160.642   3.7220 -4.022446 5.269372 
1 1 1   25    4   18 o   75.633   2.9928  121.327   9.0534  107.704   14.204  130.648   11.749   71.900   4.7899   79.366   3.5893 -7.466103 5.985510 
1 1 1   25    4   19 o   51.419   3.8484   54.078   7.9754   61.129   13.010   49.833   10.095   53.986   5.8429   48.852   5.0100 5.133747 7.696758 
1 1 1   25    4   20 o   76.150   3.1795  121.454   9.9309  107.673   14.116  134.961   13.974   71.801   4.7666   80.498   4.2090 -8.697060 6.358905 
1 1 1   25    4   21 o  166.772   2.6806  578.475   18.438  578.268   26.066  578.682   26.085  166.743   3.7902  166.802   3.7916 -0.5911255E-01 5.361129 
1 1 1   25    4   22 o  109.635   2.6894  250.113   12.158  244.880   17.265  255.259   17.122  108.483   3.8588  110.786   3.7472 -2.303253 5.378822 
1 1 1   25    4   23 o   57.429   3.7658   69.484   8.8880   68.872   13.098   70.007   12.101   57.142   5.5574   57.716   5.0833 -0.5742188 7.531580 
1 1 1   25    4   24 o   77.487   3.9815  129.408   12.097  135.579   15.171  118.632   20.046   80.403   4.5748   74.572   6.5177 5.830978 7.962957 
1 1 1   25    4   25 o   31.866   6.7431   20.638   9.3459   32.500   16.009   14.505   11.511   37.445   10.123   26.287   8.9101 11.15837 13.48611 
1 1 1   25    4   26 o   84.494   3.6014  146.392   12.062  165.187   20.551  136.516   14.897   88.311   5.6424   80.677   4.4770 7.633720 7.202807 
1 1 1   25    4   27 o   76.797   3.4237  124.234   10.791  124.757   16.088  123.807   14.548   76.862   5.0749   76.731   4.5970 0.1316605 6.847406 
1 1 1   25    4   28 o   85.440   3.2926  153.658   11.585  142.193   16.055  166.113   16.733   82.086   4.7421   88.794   4.5691 -6.708443 6.585155 
1 1 1   25    4   29 o   49.481   4.4200   53.265   8.8868   44.221   12.783   61.724   12.363   45.158   6.8636   53.803   5.5711 -8.645187 8.839996 
1 1 1   25    4   30 o   40.901   5.4145   37.875   8.8069   34.631   13.355   40.372   11.715   38.661   8.5975   43.142   6.5841 -4.480858 10.82902 
1 1 1   25    4   31 f   21.860   6.0384   5.7546   8.5214   14.423   11.855  -3.5127   12.258   25.848   9.0313   17.872   8.0176 7.976088 12.07673 
1 1 1   25    4   32 o   40.792   5.4241   38.113   8.8802   34.116   12.893   41.721   12.249   38.093   8.4293   43.491   6.8285 -5.397915 10.84812 
1 1 1   25    4   33 o   48.417   4.7417   52.066   9.3683   43.730   13.203   60.519   13.295   44.225   7.2382   52.609   6.1274 -8.383816 9.483490 
1 1 1   25    4   34 o   25.673   7.0559   13.776   10.600   17.667   12.156   1.4273   21.655   27.273   9.1565   24.072   10.738 3.200975 14.11177 
1 1 1   25    4   35 o   20.357   6.7343 -11.2463   14.127  -7.3237   20.047 -15.1164   19.912   21.187   9.7876   19.527   9.2524 1.659857 13.46864 
1 1 1   25    4   36 o   65.934   7.1492  109.720   18.672   90.488   26.178  129.639   26.642   58.410   11.275   73.458   8.7934 -15.04843 14.29838 
1 1 1   25    4   37 o   32.405   9.8825   28.373   21.601   23.403   52.339   29.394   23.714   32.637   15.321   32.173   12.487 0.4636345 19.76498 
1 1 1   25    4   38 o   23.753   11.024  -2.1744   25.862   0.0000   0.0000  -2.1744   25.862  ?   ?    23.753   11.024      ?      ? 
1 1 1   25    5    0 o  247.554   2.4176  1265.90   34.893  1265.90   34.893  1265.90   34.893  247.554   3.4189  247.554   3.4189 0.000000 0.000000 
1 1 1   25    5    1 o  374.719   3.0038  2905.30   46.420  2890.25   65.209  2920.77   66.097  373.740   4.2303  375.698   4.2656 -1.957947 6.007541 
1 1 1   25    5    2 f  314.461   2.7035  2044.70   35.061  2031.33   49.212  2058.49   49.963  313.421   3.8070  315.502   3.8396 -2.081268 5.406975 
1 1 1   25    5    3 o  157.959   2.1895  515.444   14.264  521.800   20.274  509.214   20.073  158.923   3.0930  156.995   3.0999 1.929001 4.379085 
1 1 1   25    5    4 o   72.076   2.7007  107.382   8.0263  104.067   11.220  110.856   11.486   70.937   3.8349   73.216   3.8038 -2.279144 5.401419 
1 1 1   25    5    5 o  143.138   2.3468  422.883   13.743  419.080   18.274  427.834   20.852  142.417   3.1110  143.859   3.5144 -1.441559 4.693559 
1 1 1   25    5    6 o  136.239   2.3567  383.599   13.161  383.227   17.655  384.066   19.744  136.182   3.1432  136.296   3.5122 -0.1146240 4.713347 
1 1 1   25    5    7 o  162.185   3.0140  544.513   20.160  552.173   28.659  537.010   28.365  163.316   4.2547  161.055   4.2702 2.260223 6.028020 
1 1 1   25    5    8 o  267.144   2.8866  1476.05   31.786  1445.60   44.029  1509.18   45.935  264.280   4.0394  270.008   4.1248 -5.727936 5.773252 
1 1 1   25    5    9 o  128.115   2.5745  339.617   13.599  343.523   19.059  335.567   19.410  128.872   3.5858  127.359   3.6951 1.512917 5.148934 
1 1 1   25    5   10 o  120.729   2.4380  300.045   12.043  290.875   15.946  312.219   18.373  118.610   3.2597  122.847   3.6263 -4.236763 4.875986 
1 1 1   25    5   11 o  101.584   2.4865  212.201   10.348  224.197   15.730  203.049   13.739  104.086   3.6642   99.082   3.3621 5.003487 4.972929 
1 1 1   25    5   12 o   74.293   2.8157  114.296   8.5716  114.566   12.884  114.082   11.481   74.353   4.2014   74.233   3.7499 0.1204224 5.631446 
1 1 1   25    5   13 o  157.722   2.2184  514.433   14.430  509.191   20.309  519.778   20.508  156.910   3.1381  158.533   3.1365 -1.622971 4.436794 
1 1 1   25    5   14 o   79.429   2.5939  130.682   8.4939  134.457   11.973  126.858   12.051   80.590   3.6022   78.268   3.7332 2.321671 5.187769 
1 1 1   25    5   15 o   45.781   5.0875   46.198   8.3240   41.133   15.326   48.317   9.9137   43.356   8.8695   48.206   4.9861 -4.850517 10.17499 
1 1 1   25    5   16 o   47.538   4.5980   45.619   8.1587   51.530   15.626   43.403   9.5662   49.428   7.6649   45.649   5.0809 3.778812 9.195974 
1 1 1   25    5   17 o  110.726   2.7335  255.273   12.442  236.874   17.854  272.643   17.348  106.800   4.0533  114.653   3.6687 -7.852585 5.467011 
1 1 1   25    5   18 o   55.415   3.8756   64.183   8.8555   65.687   12.702   62.762   12.353   56.044   5.4950   54.786   5.4668 1.258022 7.751175 
1 1 1   25    5   19 o   83.105   2.9517  145.099   10.018  128.895   14.649  159.335   13.731   78.641   4.5163   87.570   3.8016 -8.928963 5.903330 
1 1 1   25    5   20 o   46.949   4.6863   46.440   9.0383   52.581   13.183   40.993   12.416   49.906   6.4046   43.992   6.8428 5.913368 9.372505 
1 1 1   25    5   21 o   28.481   6.3978   12.465   8.7634   30.963   15.319   3.4660   10.685   37.035   9.8553   19.928   8.1607 17.10769 12.79551 
1 1 1   25    5   22 o  130.453   2.6526  353.732   14.255  347.457   19.615  360.755   20.753  129.250   3.6795  131.656   3.8218 -2.406082 5.305181 
1 1 1   25    5   23 o  105.782   2.8660  233.562   12.496  222.150   17.464  245.537   17.889  103.118   4.1061  108.446   3.9995 -5.328064 5.732017 
1 1 1   25    5   24 o  123.358   3.5083  321.366   16.288  323.223   19.458  317.018   29.773  124.464   3.7904  122.253   5.9047 2.210609 7.016569 
1 1 1   25    5   25 o   64.834   3.5491   88.181   9.4589   98.899   13.828   78.757   12.967   68.555   4.8906   61.112   5.1445 7.443092 7.098185 
1 1 1   25    5   26 o  100.603   3.3848  211.098   13.559  219.319   22.473  206.393   17.003  101.891   5.3477   99.314   4.1509 2.576889 6.769593 
1 1 1   25    5   27 o   44.971   4.6478   43.651   8.5720   38.995   12.226   48.153   12.022   42.486   6.9771   47.455   6.1421 -4.969032 9.295509 
1 1 1   25    5   28 o   17.020   5.4814  -5.5507   8.2412  -6.6639   13.407  -4.8746   10.449   17.955   8.1859   16.086   7.2921 1.869198 10.96288 
1 1 1   25    5   29 o   34.918   5.6863   28.212   8.1236   20.903   11.573   35.312   11.406   30.135   8.7769   39.702   7.2320 -9.567007 11.37256 
1 1 1   25    5   30 o   44.895   4.7644   43.655   8.7280   45.143   13.434   42.568   11.481   45.398   7.1749   44.392   6.2707 1.005684 9.528896 
1 1 1   25    5   31 o   41.596   5.7736   39.672   9.4549   37.930   12.400   42.092   14.613   40.742   7.6607   42.450   8.6402 -1.707909 11.54721 
1 1 1   25    5   32 o   60.986   3.8548   80.213   9.6736   86.780   13.746   73.769   13.616   63.559   5.2435   58.412   5.6517 5.146881 7.709531 
1 1 1   25    5   33 o   31.222   7.1891   19.953   9.8676   13.912   11.587   35.899   18.824   25.160   8.9171   37.284   11.279 -12.12430 14.37820 
1 1 1   25    5   34 o   24.781   6.3560   12.199   10.199   22.768   11.819 -18.6340   20.186   30.504   8.8653   19.059   9.1106 11.44493 12.71204 
1 1 1   25    5   35 o   27.634   8.0519   12.580   15.103   2.7247   20.285   24.839   22.623   23.745   10.503   31.523   12.207 -7.777143 16.10375 
1 1 1   25    5   36 o   34.999   8.6528   35.676   16.174   43.359   20.491   22.978   26.341   39.315   11.740   30.684   12.715 8.631006 17.30552 
1 1 1   25    5   37 o   24.735   8.0173  -3.3005   20.166 -98.4290   49.287   15.827   22.101   22.052   11.148   27.418   11.525 -5.366350 16.03459 
1 1 1   25    5   38 o   22.313   10.570  -9.9750   25.961   0.0000   0.0000  -9.9750   25.961  ?   ?    22.313   10.570      ?      ? 
1 1 1   25    5   39 o   22.545   10.721  -8.6067   27.215   0.0000   0.0000  -8.6067   27.215  ?   ?    22.545   10.721      ?      ? 
1 1 1   25    6    0 o  399.992   3.1394  3306.96   73.226  3306.96   73.226  3306.96   73.226  399.992   4.4398  399.992   4.4398 0.000000 0.000000 
1 1 1   25    6    1 o  102.400   2.3264  216.651   9.8244  212.738   13.781  220.695   14.009  101.460   3.2933  103.341   3.2868 -1.880478 4.652809 
1 1 1   25    6    2 o  115.193   2.2585  274.201   10.730  277.118   15.180  271.290   15.168  115.807   3.1781  114.580   3.2097 1.226540 4.516943 
1 1 1   25    6    3 o  279.699   2.5476  1616.67   29.378  1589.46   40.869  1645.77   42.259  277.271   3.5737  282.128   3.6317 -4.857025 5.095191 
1 1 1   25    6    4 o   61.268   3.1352   77.508   7.8662   76.001   10.470   79.461   11.919   60.599   4.1891   61.937   4.6659 -1.337559 6.270471 
1 1 1   25    6    5 o   80.855   3.0190  135.322   9.5631  135.296   11.806  135.372   16.308   80.892   3.5386   80.818   4.8925 0.7383728E-01 6.038074 
1 1 1   25    6    6 o  207.446   2.4665  891.608   20.991  908.648   28.418  871.148   31.140  209.663   3.2863  205.230   3.6788 4.432846 4.932936 
1 1 1   25    6    7 o   53.692   4.2101   60.149   9.2742   66.961   13.085   53.272   13.147   56.783   5.5870   50.600   6.2996 6.183544 8.420168 
1 1 1   25    6    8 o  141.831   2.5337  415.873   14.818  404.525   20.695  427.811   21.226  139.847   3.5879  143.816   3.5785 -3.969727 5.067454 
1 1 1   25    6    9 o   89.579   2.6385  165.809   9.6584  167.740   14.731  164.353   12.791   90.016   3.9677   89.142   3.4792 0.8742676 5.277069 
1 1 1   25    6   10 o  124.783   2.2450  321.804   11.551  327.243   16.576  316.670   16.104  125.806   3.1947  123.761   3.1550 2.045052 4.489985 
1 1 1   25    6   11 o  104.890   2.4242  226.977   10.417  232.960   15.756  222.330   13.886  106.098   3.6005  103.683   3.2471 2.414726 4.848444 
1 1 1   25    6   12 o  177.309   2.3743  648.581   17.196  663.545   26.337  637.460   22.704  179.050   3.5663  175.568   3.1354 3.481979 4.748652 
1 1 1   25    6   13 o  161.461   2.3607  540.036   15.611  533.752   23.432  545.052   20.933  160.583   3.5380  162.340   3.1264 -1.756424 4.721400 
1 1 1   25    6   14 o   85.087   2.6891  150.938   9.3376  142.575   14.041  157.569   12.503   82.929   4.1053   87.246   3.4745 -4.316971 5.378237 
1 1 1   25    6   15 o  119.210   2.8970  297.003   13.149  289.180   23.521  300.559   15.859  117.918   4.8362  120.502   3.1910 -2.584473 5.794054 
1 1 1   25    6   16 o  109.327   2.5070  247.282   11.126  250.474   17.395  245.073   14.473  109.874   3.8385  108.780   3.2258 1.094238 5.013986 
1 1 1   25    6   17 o   49.207   5.0661   50.459   9.8246   53.158   16.721   49.036   12.142   50.047   8.1003   48.367   6.0865 1.680859 10.13218 
1 1 1   25    6   18 o   84.340   2.9969  147.969   10.418  148.415   15.021  147.555   14.461   84.450   4.3125   84.231   4.1626 0.2189636 5.993770 
1 1 1   25    6   19 f   47.160   4.2596   47.729   8.0885   41.097   12.293   52.792   10.741   44.092   6.7595   50.227   5.1851 -6.134777 8.519180 
1 1 1   25    6   20 o   71.593   3.5959  105.555   10.475   97.245   13.547  117.911   16.519   68.203   4.8159   74.984   5.3414 -6.781418 7.191851 
1 1 1   25    6   21 o  208.861   2.5316  905.852   21.801  880.991   30.377  932.257   31.306  205.910   3.5768  211.813   3.5836 -5.903351 5.063149 
1 1 1   25    6   22 o   80.238   3.0768  134.504   10.178  139.471   14.456  129.623   14.333   81.721   4.2890   78.755   4.4124 2.966759 6.153507 
1 1 1   25    6   23 o   75.727   3.1546  120.383   9.8269  129.709   13.855  110.945   13.940   78.734   4.2667   72.719   4.6477 6.014931 6.309168 
1 1 1   25    6   24 o   70.555   4.6225  107.296   11.935  108.570   14.038  103.974   22.670   71.892   4.7342   69.217   7.9409 2.675697 9.245070 
1 1 1   25    6   25 o   93.174   2.9345  182.076   11.247  168.573   16.008  195.241   15.806   89.696   4.3272   96.653   3.9650 -6.956711 5.869030 
1 1 1   25    6   26 o   22.289   6.5116   3.9303   8.8027   9.1225   16.865   1.9861   10.320   25.796   10.366   18.781   7.8838 7.015329 13.02328 
1 1 1   25    6   27 o   31.557   5.7997   22.107   8.2735   9.9442   11.464   35.328   11.953   23.431   8.7807   39.683   7.5792 -16.25200 11.59931 
1 1 1   25    6   28 o   69.370   4.2028  102.545   11.485  104.127   19.369  101.687   14.264   69.416   6.7652   69.324   4.9886 0.9180450E-01 8.405543 
1 1 1   25    6   29 f   27.841   6.1545   17.187   8.0371   12.028   11.183   22.698   11.559   24.376   8.7473   31.305   8.6602 -6.928961 12.30907 
1 1 1   25    6   30 o  116.923   3.3812  292.382   15.990  304.399   20.952  275.618   24.747  120.176   4.2270  113.669   5.2785 6.506340 6.762429 
1 1 1   25    6   31 o   36.874   5.5704   31.549   8.5420   18.135   11.919   45.714   12.248   28.024   9.0518   45.724   6.4947 -17.69993 11.14072 
1 1 1   25    6   32 o   38.869   6.0077   36.006   9.2850   38.111   12.244   33.156   14.243   40.723   7.5685   37.015   9.3320 3.708218 12.01540 
1 1 1   25    6   33 o   33.837   7.5730   27.845   10.558   27.464   11.853   29.310   23.228   33.841   8.5027   33.832   12.534 0.8518219E-02 15.14593 
1 1 1   25    6   34 o   41.511   7.2152   44.803   11.376   46.438   13.066   39.680   23.127   45.385   6.9802   37.637   12.630 7.748699 14.43045 
1 1 1   25    6   35 o   28.429   7.3828   19.101   10.652   19.791   12.325   17.063   21.177   28.452   9.2061   28.406   11.544 0.4642105E-01 14.76557 
1 1 1   25    6   36 o   50.652   9.4049   76.050   19.673   80.706   30.831   72.853   25.551   50.724   14.184   50.580   12.354 0.1444893 18.80986 
1 1 1   25    6   37 o   33.050   9.8246   33.046   23.112   2.8425   53.396   40.009   25.638   30.288   14.567   35.813   13.187 -5.524509 19.64928 
1 1 1   25    6   38 o   35.225   10.134   46.074   23.853   27.000   53.865   50.727   26.604   31.742   15.092   38.708   13.529 -6.965973 20.26803 
1 1 1   25    6   39 o   50.709   13.487   84.687   28.697   0.0000   0.0000   84.687   28.697  ?   ?    50.709   13.487      ?      ? 
1 1 1   25    7    0 o   83.022   3.0505  143.560   14.681  143.560   14.681  143.560   14.681   83.022   4.3140   83.022   4.3140 0.000000 0.000000 
1 1 1   25    7    1 o   84.974   2.7230  148.437   9.4152  143.954   12.263  154.872   14.694   83.440   3.5635   86.508   4.1183 -3.068420 5.445956 
1 1 1   25    7    2 f   76.056   2.7959  119.455   8.7274  121.907   13.062  117.477   11.730   76.749   4.1263   75.364   3.7739 1.385506 5.591784 
1 1 1   25    7    3 o  210.239   2.4648  910.703   21.129  893.569   27.734  934.404   32.618  207.929   3.2339  212.550   3.7207 -4.621719 4.929697 
1 1 1   25    7    4 o  116.667   2.3931  281.021   11.429  278.399   15.225  284.405   17.300  116.062   3.1806  117.273   3.5766 -1.211388 4.786232 
1 1 1   25    7    5 o  135.222   2.3585  377.574   13.061  374.379   17.431  381.664   19.722  134.590   3.1402  135.854   3.5198 -1.264832 4.716943 
1 1 1   25    7    6 o  129.909   2.7525  345.832   14.494  331.794   18.667  367.141   22.999  126.658   3.5733  133.161   4.1875 -6.503235 5.504902 
1 1 1   25    7    7 o  121.030   2.5974  303.087   12.959  304.452   18.059  301.639   18.607  121.317   3.6092  120.742   3.7363 0.5750275 5.194872 
1 1 1   25    7    8 o   64.272   3.2911   85.465   8.6894   75.317   12.007   96.625   12.591   60.261   4.8309   68.283   4.4708 -8.022156 6.582243 
1 1 1   25    7    9 o   36.547   4.7683   28.073   7.0068   33.344   10.427   23.733   9.4612   40.006   6.3195   33.088   7.1422 6.917881 9.536599 
1 1 1   25    7   10 o   92.724   2.4428  177.906   9.3257  164.267   13.075  192.031   13.305   89.096   3.5580   96.351   3.3482 -7.254700 4.885656 
1 1 1   25    7   11 o  181.813   2.3949  684.746   17.811  677.348   26.896  690.524   23.769  180.898   3.6048  182.728   3.1538 -1.830185 4.789721 
1 1 1   25    7   12 o   92.668   2.8168  175.648   10.374  186.280   17.370  169.754   12.934   94.767   4.4440   90.569   3.4625 4.198547 5.633669 
1 1 1   25    7   13 o  157.259   2.5661  511.902   16.632  507.967   23.055  516.173   24.018  156.639   3.5686  157.879   3.6884 -1.239227 5.132201 
1 1 1   25    7   14 o  131.408   2.6327  357.023   14.245  344.983   19.471  370.887   20.894  129.041   3.6584  133.776   3.7869 -4.734924 5.265406 
1 1 1   25    7   15 o   94.506   3.0871  181.440   11.028  195.945   20.486  175.522   13.086   96.972   5.1221   92.040   3.4472 4.932617 6.174109 
1 1 1   25    7   16 o  120.208   2.7315  299.996   13.538  293.821   19.235  306.060   19.059  118.970   3.9200  121.446   3.8049 -2.475677 5.462905 
1 1 1   25    7   17 o  170.896   2.5549  604.030   17.926  625.574   26.848  586.698   24.081  173.597   3.7498  168.195   3.4713 5.401657 5.109843 
1 1 1   25    7   18 o   29.613   5.8888   18.240   7.8676   28.232   11.729   10.066   10.608   35.714   8.1432   23.511   8.5088 12.20333 11.77759 
1 1 1   25    7   19 o  131.609   2.4362  358.581   12.936  364.720   20.629  354.602   16.606  132.445   3.7764  130.773   3.0788 1.671097 4.872408 
1 1 1   25    7   20 o   43.683   5.3542   41.438   9.2485   42.055   12.064   40.560   14.404   44.592   6.5593   42.775   8.4643 1.817146 10.70833 
1 1 1   25    7   21 o  108.739   2.7054  245.662   12.093  219.199   16.754  274.448   17.474  102.601   3.9591  114.878   3.6879 -12.27755 5.410714 
1 1 1   25    7   22 o   29.392   5.4974   18.437   7.5908   31.556   10.848   5.8486   10.626   37.814   7.2187   20.970   8.2932 16.84410 10.99483 
1 1 1   25    7   23 f   86.836   3.2078  156.434   11.424  142.333   15.205  174.709   17.310   82.410   4.4736   91.261   4.5987 -8.851509 6.415699 
1 1 1   25    7   24 o   70.132   4.1790  106.560   11.445  111.801   14.300   97.222   19.090   72.936   4.7536   67.328   6.8745 5.607628 8.357917 
1 1 1   25    7   25 o   27.819   6.0817   17.082   7.7509   14.307   11.148   19.680   10.784   26.053   8.7689   29.585   8.4293 -3.531975 12.16331 
1 1 1   25    7   26 o   84.570   3.8374  156.800   12.436  135.796   21.180  167.851   15.363   79.634   6.4486   89.506   4.1615 -9.872162 7.674773 
1 1 1   25    7   27 o  107.658   3.1500  247.256   13.671  225.910   21.163  262.544   17.910  103.352   4.9647  111.963   3.8785 -8.610199 6.300020 
1 1 1   25    7   28 o   23.716   6.1642   10.770   7.9240   9.2963   11.885   11.950   10.632   23.226   8.8860   24.205   8.5455 -0.9793110 12.32833 
1 1 1   25    7   29 o   26.591   6.0868   15.335   7.8602   9.8969   11.015   20.976   11.220   23.051   8.6133   30.131   8.6026 -7.079367 12.17350 
1 1 1   25    7   30 o   56.022   4.0347   67.321   9.2951   74.662   13.426   60.562   12.882   59.025   5.5148   53.019   5.8909 6.005947 8.069443 
1 1 1   25    7   31 f   20.486   5.8163   5.2465   7.6746   0.8818   10.795   9.7064   10.913   18.306   7.8854   22.666   8.5521 -4.360161 11.63261 
1 1 1   25    7   32 o   35.811   6.3130   30.364   9.1851   28.028   11.962   33.721   14.337   34.342   8.4928   37.280   9.3429 -2.937946 12.62606 
1 1 1   25    7   33 o   62.465   5.4229   81.551   12.127   74.406   13.823  105.413   25.263   58.351   5.7439   66.579   9.2000 -8.228020 10.84586 
1 1 1   25    7   34 o   59.150   5.6308   78.626   12.152   76.041   14.172   85.803   23.615   58.840   5.8396   59.460   9.6293 -0.6197624 11.26165 
1 1 1   25    7   35 o   27.478   7.1279   18.327   10.574   22.000   12.089   6.3652   21.815   29.792   9.0447   25.164   11.019 4.627916 14.25582 
1 1 1   25    7   36 o   21.378   7.1743 -16.5240   17.692 -40.3897   28.554  -1.6532   22.540   19.714   9.7285   23.042   10.547 -3.328365 14.34855 
1 1 1   25    7   37 o   33.038   10.184   30.608   22.717   41.066   53.361   28.292   25.105   34.534   15.959   31.543   12.657 2.991003 20.36861 
1 1 1   25    7   38 f   58.243   10.465  133.118   27.318  104.493   51.920  144.076   32.123   43.838   17.975   72.648   10.721 -28.80968 20.92962 
1 1 1   25    7   39 o   50.603   14.052   88.049   30.370   0.0000   0.0000   88.049   30.370  ?   ?    50.603   14.052      ?      ? 
1 1 1   25    8    0 o  326.694   2.7602  2205.65   52.581  2205.65   52.581  2205.65   52.581  326.694   3.9036  326.694   3.9036 0.000000 0.000000 
1 1 1   25    8    1 f   93.165   2.4048  179.379   9.2383  175.842   12.900  183.102   13.236   92.223   3.3915   94.106   3.4102 -1.883110 4.809556 
1 1 1   25    8    2 o   63.203   3.4817   86.091   8.6007   95.283   10.941   71.219   13.916   67.857   3.9091   58.549   5.7626 9.308323 6.963344 
1 1 1   25    8    3 o   66.547   3.2387   90.542   8.6287   86.923   10.861   96.735   14.208   64.802   4.0637   68.292   5.0442 -3.490852 6.477469 
1 1 1   25    8    4 o   45.105   4.4883   42.395   7.9696   55.998   11.954   31.512   10.693   51.923   5.5820   38.288   7.0301 13.63493 8.976679 
1 1 1   25    8    5 o   54.793   3.7386   62.267   8.3684   62.728   12.764   61.919   11.083   54.947   5.6323   54.640   4.9178 0.3071442 7.477117 
1 1 1   25    8    6 o  111.006   2.6116  254.992   11.955  260.190   16.887  249.769   16.926  112.144   3.6510  109.867   3.7352 2.277039 5.223137 
1 1 1   25    8    7 o  152.553   2.5164  481.322   15.831  474.405   22.144  488.552   22.640  151.434   3.5454  153.672   3.5721 -2.237701 5.032887 
1 1 1   25    8    8 o   33.684   5.3538   25.018   7.3058   30.401   10.104   19.121   10.576   37.617   6.7610   29.751   8.3030 7.866074 10.70756 
1 1 1   25    8    9 o  136.595   2.5850  385.343   14.542  371.242   19.920  401.435   21.279  133.932   3.6060  139.258   3.7048 -5.326065 5.170036 
1 1 1   25    8   10 o   81.337   2.6058  136.916   8.7390  132.358   12.246  141.646   12.475   79.956   3.7134   82.718   3.6565 -2.762764 5.211526 
1 1 1   25    8   11 o  101.471   2.3494  212.988   9.8287  221.220   13.998  204.983   13.804  103.409   3.2821   99.534   3.3624 3.874969 4.698760 
1 1 1   25    8   12 o   88.393   2.6113  161.511   9.4578  164.283   14.266  159.338   12.633   89.049   3.8842   87.737   3.4911 1.311638 5.222537 
1 1 1   25    8   13 o  123.544   2.6403  318.058   12.921  309.583   21.355  322.953   16.228  122.155   4.2385  124.933   3.1494 -2.778305 5.280510 
1 1 1   25    8   14 f   75.730   3.4745  118.286   9.8542  121.992   18.396  116.796   11.670   76.409   5.8374   75.050   3.7700 1.359047 6.948962 
1 1 1   25    8   15 o   83.024   2.7753  141.947   9.3375  149.012   14.793  137.268   12.039   84.683   4.2354   81.364   3.5874 3.318703 5.550556 
1 1 1   25    8   16 o  158.059   2.3906  516.770   15.227  523.057   24.339  512.727   19.518  158.761   3.7170  157.356   3.0074 1.405472 4.781260 
1 1 1   25    8   17 o  146.825   2.5687  445.945   15.517  469.167   22.947  426.382   21.062  150.316   3.7013  143.334   3.5627 6.981735 5.137336 
1 1 1   25    8   18 o   56.426   3.9491   67.441   8.9956   51.221   12.586   84.377   12.862   49.313   6.1883   63.539   4.9078 -14.22642 7.898197 
1 1 1   25    8   19 o   20.170   5.6097   4.4281   6.6054   9.0711   11.250   1.9853   8.1601   23.206   8.6980   17.134   7.0865 6.071890 11.21934 
1 1 1   25    8   20 o  102.481   3.2020  218.123   13.038  215.165   16.328  223.328   21.659  101.688   3.8930  103.274   5.0849 -1.586006 6.404048 
1 1 1   25    8   21 o   75.223   3.1548  118.458   9.7423  132.975   13.902  104.449   13.657   79.811   4.2233   70.634   4.6877 9.176437 6.309591 
1 1 1   25    8   22 f   77.948   3.1260  127.446   10.009  113.435   14.054  141.865   14.257   73.535   4.6338   82.361   4.1971 -8.825546 6.252007 
1 1 1   25    8   23 o   68.176   4.4143   95.981   11.224   92.156   13.187  106.040   21.382   66.213   4.8286   70.140   7.3911 -3.926758 8.828615 
1 1 1   25    8   24 o   62.543   3.6641   82.451   9.3689   97.537   13.572   68.717   12.949   68.096   4.8323   56.989   5.5092 11.10631 7.328196 
1 1 1   25    8   25 o   35.064   5.8712   27.748   8.3709   31.067   12.119   24.720   11.576   37.122   8.1398   33.006   8.4634 4.116009 11.74246 
1 1 1   25    8   26 o   63.688   4.3725   88.516   10.677   81.892   18.506   91.821   13.071   61.403   7.3073   65.973   4.8038 -4.569363 8.744923 
1 1 1   25    8   27 o   51.156   7.3234   85.901   12.629   19.130   30.617   99.590   13.863   33.668   13.804   68.645   4.8964 -34.97747 14.64674 
1 1 1   25    8   28 o   62.462   3.7868   82.706   9.6973   86.489   14.656   79.760   12.933   63.640   5.5837   61.283   5.1167 2.356953 7.573552 
1 1 1   25    8   29 o   42.713   5.3486   39.885   9.0154   56.413   13.777   27.506   11.923   50.997   6.5500   34.429   8.4573 16.56780 10.69711 
1 1 1   25    8   30 o   64.949   3.7007   90.180   9.9007   96.694   14.225   84.059   13.789   67.269   5.1270   62.629   5.3380 4.640648 7.401440 
1 1 1   25    8   31 o   61.623   3.9864   82.558   10.047   71.642   14.327   93.122   14.094   57.374   6.0544   65.873   5.1875 -8.498650 7.972805 
1 1 1   25    8   32 o   50.864   4.9518   54.415   10.084   44.138   12.572   72.960   16.888   44.594   6.8351   57.134   7.1668 -12.53924 9.903648 
1 1 1   25    8   33 o   35.599   7.7805   28.592   11.071   23.595   12.617   45.306   23.076   30.934   9.2065   40.264   12.545 -9.330282 15.56102 
1 1 1   25    8   34 o   31.706   7.5954   24.732   10.864   24.190   12.481   26.430   22.070   31.288   9.1153   32.124   12.152 -0.8359184 15.19079 
1 1 1   25    8   35 o   53.846   7.0688   75.981   14.001   81.603   17.070   64.425   24.474   59.914   6.9078   47.778   12.335 12.13521 14.13758 
1 1 1   25    8   36 o   28.855   8.5394   16.829   18.660  -7.6100   29.833   32.536   23.917   24.390   11.486   33.320   12.639 -8.929745 17.07877 
1 1 1   25    8   37 o   30.771   9.0498   20.120   18.910   48.927   31.273   3.5149   23.743   37.275   14.375   24.267   10.997 13.00823 18.09961 
1 1 1   25    8   38 o   30.230   9.7777   22.122   23.716   45.280   49.671   15.284   26.991   33.325   15.399   27.136   12.053 6.188799 19.55533 
1 1 1   25    8   39 o   55.736   13.738  102.760   31.378   0.0000   0.0000  102.760   31.378  ?   ?    55.736   13.738      ?      ? 
1 1 1   25    9    0 o   82.663   2.7866  142.132   13.367  142.132   13.367  142.132   13.367   82.663   3.9409   82.663   3.9409 0.000000 0.000000 
1 1 1   25    9    1 o  236.107   2.5574  1152.62   24.688  1148.92   32.800  1157.47   37.498  235.717   3.3738  236.497   3.8443 -0.7803650 5.114850 
1 1 1   25    9    2 o   69.431   2.9507   99.112   8.4176   91.487   11.324  108.530   12.585   66.470   4.1304   72.391   4.2149 -5.921043 5.901337 
1 1 1   25    9    3 o  199.338   2.5787  822.008   21.200  811.572   29.846  832.638   30.120  198.060   3.6536  200.616   3.6402 -2.556412 5.157482 
1 1 1   25    9    4 o   59.636   3.7366   73.044   9.0673   69.247   11.766   78.597   14.229   57.774   4.9376   61.498   5.6098 -3.723660 7.473270 
1 1 1   25    9    5 o   93.728   3.0071  183.007   11.401  187.479   14.847  176.582   17.797   95.176   3.7823   92.281   4.6760 2.895027 6.014262 
1 1 1   25    9    6 o  117.177   2.5755  284.106   12.445  282.987   17.409  285.276   17.797  116.945   3.6093  117.409   3.6752 -0.4646072 5.151086 
1 1 1   25    9    7 o   96.969   2.6986  194.685   10.792  195.287   15.155  194.065   15.371   97.124   3.7831   96.814   3.8495 0.3108063 5.397273 
1 1 1   25    9    8 o   88.223   2.8008  161.285   10.187  164.490   14.291  157.973   14.524   89.121   3.8878   87.324   4.0327 1.797470 5.601611 
1 1 1   25    9    9 o   66.167   3.5717   91.489   9.0419   89.496   16.048   92.416   10.944   65.543   5.9366   66.790   3.9729 -1.247345 7.143315 
1 1 1   25    9   10 o  112.864   2.5365  267.208   11.597  241.813   17.651  286.499   15.384  108.036   3.9612  117.693   3.1692 -9.657249 5.072925 
1 1 1   25    9   11 f  101.175   2.4842  210.344   10.317  196.707   13.793  227.664   15.544   97.489   3.4304  104.861   3.5941 -7.372498 4.968383 
1 1 1   25    9   12 o  116.189   2.4170  279.322   11.512  281.091   17.286  277.913   15.431  116.494   3.5978  115.883   3.2286 0.6110229 4.834035 
1 1 1   25    9   13 o   30.978   5.4209   21.489   6.8858   17.446   10.739   24.312   8.9730   28.486   8.4973   33.469   6.7334 -4.983082 10.84172 
1 1 1   25    9   14 o  109.652   3.6006  247.833   13.056  255.469   29.254  245.933   14.589  110.343   6.4280  108.962   3.2463 1.380287 7.201265 
1 1 1   25    9   15 o  119.277   2.4824  296.320   12.012  287.486   18.604  302.636   15.731  117.683   3.8329  120.871   3.1555 -3.188744 4.964733 
1 1 1   25    9   16 o   85.281   2.7036  147.138   9.2559  167.835   15.299  135.188   11.625   89.838   4.1289   80.724   3.4915 9.113876 5.407294 
1 1 1   25    9   17 o   54.324   3.8393   62.235   8.5436   55.846   12.343   68.112   11.838   51.569   5.8033   57.079   5.0283 -5.510494 7.678696 
1 1 1   25    9   18 f   45.375   4.6311   44.506   8.2799   34.496   11.638   54.765   11.782   39.685   7.3820   51.065   5.5942 -11.37967 9.262211 
1 1 1   25    9   19 o  143.770   2.4137  427.235   13.966  438.088   22.471  420.403   17.828  145.149   3.7535  142.392   3.0356 2.756607 4.827394 
1 1 1   25    9   20 o   42.218   5.3499   37.456   8.9882   32.626   11.467   45.152   14.474   38.490   7.4928   45.945   7.6384 -7.454575 10.69983 
1 1 1   25    9   21 o   55.188   4.3531   66.544   9.5657   74.866   12.568   55.082   14.749   59.656   5.1078   50.720   7.0503 8.936287 8.706106 
1 1 1   25    9   22 o   58.717   3.9162   72.535   9.4508   64.643   12.927   81.595   13.851   55.268   5.6712   62.167   5.4022 -6.898563 7.832325 
1 1 1   25    9   23 o  112.226   3.1295  257.464   13.912  241.695   17.183  287.468   23.702  107.577   3.8728  116.875   4.9170 -9.297112 6.259027 
1 1 1   25    9   24 o   51.128   4.0924   55.447   8.6136   59.957   12.298   51.104   12.068   53.214   5.6032   49.043   5.9663 4.170620 8.184879 
1 1 1   25    9   25 o   27.689   6.0156   16.979   7.7953   11.146   11.420   22.068   10.666   24.180   8.8166   31.199   8.1866 -7.018951 12.03130 
1 1 1   25    9   26 o   40.840   5.3276   38.765   8.5134   23.622   12.319   52.608   11.778   32.016   8.9705   49.664   5.7501 -17.64838 10.65525 
1 1 1   25    9   27 o   93.659   3.7764  189.465   13.772  176.459   23.247  196.496   17.094   90.649   6.2179   96.669   4.2873 -6.019547 7.552706 
1 1 1   25    9   28 o   93.633   3.1304  183.047   11.949  197.464   18.619  172.953   15.580   96.614   4.6726   90.653   4.1671 5.960869 6.260817 
1 1 1   25    9   29 f   24.930   5.8508   12.337   7.9921   0.4308   11.974   21.904   10.733   19.116   8.2691   30.745   8.2794 -11.62981 11.70154 
1 1 1   25    9   30 o   44.913   5.3122   47.112   9.2361   33.704   13.520   58.846   12.648   37.698   8.8472   52.128   5.8827 -14.42962 10.62446 
1 1 1   25    9   31 o   23.826   6.2134   10.251   8.4056   17.855   12.319   3.6271   11.498   27.753   9.2162   19.900   8.3358 7.852669 12.42673 
1 1 1   25    9   32 o   50.550   6.9297   69.312   11.985   76.756   13.905   47.800   23.638   59.372   5.6785   41.729   12.643 17.64280 13.85935 
1 1 1   25    9   33 o   25.164   7.3968   8.2897   10.913   5.0937   12.442   18.951   22.724   20.818   8.6917   29.510   11.971 -8.691866 14.79358 
1 1 1   25    9   34 o   44.211   7.4405   46.658   12.159   41.707   14.149   60.638   23.775   41.531   8.5452   46.890   12.183 -5.358681 14.88097 
1 1 1   25    9   35 o   26.858   7.8174   14.532   13.036   13.551   15.462   16.943   24.244   25.287   10.003   28.429   12.016 -3.141335 15.63483 
1 1 1   25    9   36 o   27.096   8.5091   9.0835   18.649   22.182   29.596   0.4576   24.017   30.262   13.046   23.930   10.928 6.332569 17.01814 
1 1 1   25    9   37 o   25.112   8.1365   4.1758   18.521   8.7596   29.924   1.3295   23.580   26.682   12.190   23.543   10.780 3.138905 16.27297 
1 1 1   25    9   38 o   45.955   11.344   86.334   25.383  108.090   51.145   79.225   29.237   43.885   17.900   48.025   13.940 -4.139519 22.68742 
1 1 1   25   10    0 f   85.086   3.4418  151.201   16.953  151.201   16.953  151.201   16.953   85.086   4.8674   85.086   4.8674 0.000000 0.000000 
1 1 1   25   10    1 o   70.348   3.0755  102.757   8.8900   92.256   12.536  113.381   12.609   66.708   4.5563   73.987   4.1320 -7.278839 6.150911 
1 1 1   25   10    2 o  111.494   2.5512  257.210   11.731  258.879   16.627  255.555   16.555  111.855   3.6040  111.133   3.6117 0.7211761 5.102302 
1 1 1   25   10    3 o   99.819   2.6108  206.179   10.747  207.820   15.355  204.604   15.047  100.205   3.7154   99.432   3.6690 0.7737350 5.221662 
1 1 1   25   10    4 o  332.329   3.2143  2290.17   44.058  2290.52   62.396  2289.81   62.218  332.353   4.5519  332.306   4.5396 0.4626465E-01 6.428661 
1 1 1   25   10    5 o  116.023   2.4274  279.239   11.534  271.923   17.247  285.157   15.513  114.620   3.6483  117.426   3.2031 -2.805099 4.854859 
1 1 1   25   10    6 o   52.305   4.5422   60.717   9.1146   44.904   14.683   70.630   11.626   46.279   7.6926   58.331   4.8323 -12.05222 9.084457 
1 1 1   25   10    7 o  115.106   2.5838  274.113   12.261  263.323   17.120  285.478   17.569  112.779   3.6805  117.434   3.6273 -4.655113 5.167587 
1 1 1   25   10    8 o  108.899   2.4464  245.227   10.893  246.882   16.551  243.963   14.469  109.199   3.6749  108.600   3.2302 0.5985794 4.892730 
1 1 1   25   10    9 o   24.300   5.6260   11.097   6.5987   16.719   10.146   6.9758   8.6870   27.952   8.2401   20.648   7.6621 7.303963 11.25196 
1 1 1   25   10   10 o   42.883   3.8017   38.380   6.7036   35.559   9.5861   41.081   9.3780   41.318   5.6252   44.448   5.1155 -3.130466 7.603385 
1 1 1   25   10   11 o   89.302   2.4545  165.105   9.0377  159.422   12.667  170.998   12.899   87.734   3.5004   90.870   3.4417 -3.135986 4.909027 
1 1 1   25   10   12 o   37.897   4.5660   29.973   6.9334   34.563   10.781   26.735   9.0542   40.609   6.4366   35.185   6.4778 5.423992 9.131945 
1 1 1   25   10   13 o   83.382   3.1397  145.416   10.685  138.100   16.086  151.193   14.294   81.438   4.7890   85.327   4.0616 -3.888527 6.279386 
1 1 1   25   10   14 o  156.418   2.7227  516.287   16.655  480.582   27.949  535.947   20.739  151.979   4.4588  160.857   3.1260 -8.878510 5.445427 
1 1 1   25   10   15 o   73.502   2.9879  111.153   8.8316  117.845   14.343  107.067   11.208   75.201   4.6245   71.803   3.7846 3.398499 5.975710 
1 1 1   25   10   16 o  123.504   2.4644  319.671   12.256  301.576   19.258  331.988   15.889  120.443   3.8768  126.565   3.0437 -6.122131 4.928886 
1 1 1   25   10   17 o   19.643   5.7089   3.0108   7.4120   4.5674   10.983   1.7090   10.044   20.685   8.3463   18.601   7.7913 2.083778 11.41775 
1 1 1   25   10   18 o   32.144   5.9479   23.005   7.9762   22.805   11.345   23.201   11.216   32.006   8.4646   32.281   8.3582 -0.2749252 11.89578 
1 1 1   25   10   19 o   55.209   3.5502   63.980   7.8154   63.248   12.757   64.420   9.8885   54.845   5.6395   55.573   4.3142 -0.7281418 7.100427 
1 1 1   25   10   20 o   90.980   5.0214  196.333   14.628  211.105   16.605  145.128   30.914  100.583   4.0026   81.376   9.2108 19.20662 10.04285 
1 1 1   25   10   21 o   87.436   3.2932  160.728   11.684  162.177   15.261  158.676   18.162   88.054   4.2021   86.819   5.0719 1.234497 6.586495 
1 1 1   25   10   22 o   65.212   3.7651   91.760   9.8807  108.797   13.560   72.477   14.427   72.009   4.5658   58.414   5.9881 13.59514 7.530167 
1 1 1   25   10   23 o   27.184   6.8365   14.257   9.2598   12.268   11.419   18.077   15.824   24.890   8.8489   29.478   10.423 -4.587881 13.67306 
1 1 1   25   10   24 o   28.186   6.0540   17.748   7.9257   11.612   11.849   22.716   10.662   24.670   8.9829   31.702   8.1186 -7.032135 12.10797 
1 1 1   25   10   25 o   29.075   6.1796   18.893   7.9693   21.423   12.071   16.938   10.610   30.620   8.9770   27.531   8.4950 3.088856 12.35928 
1 1 1   25   10   26 o   39.604   6.0496   35.124   9.2918   38.968   15.547   32.988   11.589   40.923   9.4082   38.284   7.6075 2.638103 12.09916 
1 1 1   25   10   27 o   67.074   4.4346   97.778   11.474   94.340   19.886   99.493   14.048   65.648   7.3443   68.501   4.9721 -2.852303 8.869102 
1 1 1   25   10   28 o   53.021   4.2277   60.983   9.1069   56.954   13.834   64.065   12.098   51.245   6.5454   54.798   5.3529 -3.553001 8.455458 
1 1 1   25   10   29 o   20.716   6.0000   4.8076   8.0093   7.1194   12.780   3.3122   10.278   22.357   9.0095   19.074   7.9264 3.282997 11.99997 
1 1 1   25   10   30 o   61.089   3.9287   81.190   9.7797   68.062   13.939   93.916   13.724   55.937   6.0419   66.241   5.0234 -10.30408 7.857443 
1 1 1   25   10   31 o   32.426   6.2056   25.524   8.5623   21.675   12.915   28.543   11.437   30.049   9.3890   34.803   8.1167 -4.754221 12.41111 
1 1 1   25   10   32 o   29.149   7.4947   14.838   10.724   7.5935   12.441   35.793   21.159   21.963   8.8757   36.334   12.079 -14.37091 14.98934 
1 1 1   25   10   33 o   26.196   8.2565   9.4394   12.566   12.117   12.980 -30.5682   50.173   24.310   9.2895   28.082   13.652 -3.771822 16.51301 
1 1 1   25   10   34 o   55.285   6.3101   70.826   12.413   67.061   14.474   81.295   24.136   54.723   6.4129   55.847   10.869 -1.124081 12.62015 
1 1 1   25   10   35 o   28.858   8.0588   18.941   12.944   15.579   15.180   27.896   24.778   26.004   10.019   31.712   12.625 -5.708277 16.11769 
1 1 1   25   10   36 o   30.380   8.9007   18.566   18.905   45.982   29.550  -0.4314   24.598   36.949   14.041   23.810   10.942 13.13842 17.80148 
1 1 1   25   10   37 o   32.257   9.0133   32.180   19.390   10.828   29.607   48.216   25.657   26.770   12.189   37.745   13.281 -10.97516 18.02661 
1 1 1   25   10   38 o   24.508   8.5249 -14.0710   21.553   18.911   49.883 -21.6415   23.899   29.655   14.215   19.362   9.4152 10.29334 17.04988 
1 1 1   25   11    0 o  149.570   2.4633  462.875   21.464  462.875   21.464  462.875   21.464  149.570   3.4837  149.570   3.4837 0.000000 0.000000 
1 1 1   25   11    1 o   56.806   3.3543   67.053   7.8335   73.789   11.142   60.469   11.016   59.646   4.5290   53.965   4.9491 5.681183 6.708662 
1 1 1   25   11    2 o  100.673   2.5982  209.906   10.783  203.793   15.323  215.902   15.176   99.213   3.7447  102.133   3.6027 -2.920036 5.196397 
1 1 1   25   11    3 o   33.827   5.0875   24.852   6.8807   23.437   9.7743   26.242   9.6879   32.824   7.3971   34.830   6.9869 -2.006607 10.17510 
1 1 1   25   11    4 o  133.893   2.3577  371.695   12.931  363.657   19.343  378.190   17.387  132.555   3.5380  135.232   3.1174 -2.677139 4.715423 
1 1 1   25   11    5 f   88.572   3.0776  161.973   11.104  167.073   17.220  158.344   14.527   89.726   4.6533   87.419   4.0290 2.306602 6.155158 
1 1 1   25   11    6 o  159.529   2.7672  522.931   17.851  506.448   22.915  548.373   28.469  156.420   3.5519  162.637   4.2442 -6.216965 5.534361 
1 1 1   25   11    7 o  191.486   2.8355  760.113   22.047  761.560   28.779  758.058   34.303  191.788   3.6382  191.184   4.3502 0.6040497 5.671055 
1 1 1   25   11    8 o  136.169   2.3839  384.976   13.281  373.318   19.924  394.298   17.817  134.275   3.5976  138.064   3.1289 -3.789185 4.767881 
1 1 1   25   11    9 o  193.881   2.2598  777.711   18.069  786.464   25.794  769.276   25.319  194.949   3.2080  192.812   3.1838 2.137054 4.519683 
1 1 1   25   11   10 o   67.041   2.8019   93.229   7.7471   91.978   10.941   94.487   10.971   66.588   3.9839   67.494   3.9410 -0.9060593 5.603885 
1 1 1   25   11   11 o  158.659   2.2106  520.917   14.462  508.427   20.180  534.103   20.735  156.706   3.1223  160.612   3.1301 -3.906570 4.421136 
1 1 1   25   11   12 o   70.059   2.9320  102.977   8.3467   95.232   12.664  108.924   11.098   67.656   4.5384   72.462   3.7134 -4.805855 5.863999 
1 1 1   25   11   13 o  126.837   2.6701  337.960   13.359  319.598   22.107  348.521   16.766  123.962   4.3239  129.711   3.1340 -5.748253 5.340239 
1 1 1   25   11   14 o  100.186   2.8560  209.789   11.142  205.177   19.117  212.161   13.711   99.212   4.6720  101.160   3.2861 -1.947723 5.711911 
1 1 1   25   11   15 o  121.972   2.4363  306.419   11.954  319.251   19.326  298.468   15.214  123.945   3.7805  119.998   3.0739 3.946365 4.872516 
1 1 1   25   11   16 o   36.994   4.8148   26.701   6.9365   43.158   11.914   18.262   8.5316   45.212   6.3891   28.775   7.2048 16.43710 9.629678 
1 1 1   25   11   17 o   62.813   3.5572   82.621   9.2006   88.623   13.091   76.762   12.934   65.096   4.8758   60.529   5.1807 4.567074 7.114320 
1 1 1   25   11   18 o  114.371   3.0844  275.499   14.253  287.444   18.630  258.639   22.133  117.536   3.8431  111.207   4.8255 6.329094 6.168849 
1 1 1   25   11   19 o   35.657   5.4526   27.802   7.8012   36.003   11.725   21.289   10.450   40.464   7.2939   30.850   8.1068 9.613607 10.90513 
1 1 1   25   11   20 o   78.993   3.1247  130.588   10.165  132.759   14.831  128.664   13.961   79.584   4.5182   78.402   4.3174 1.181984 6.249364 
1 1 1   25   11   21 o   63.676   4.1019   83.038   10.361   75.999   12.776   96.560   17.708   60.049   5.1586   67.304   6.3790 -7.254791 8.203816 
1 1 1   25   11   22 o   95.508   3.7872  187.853   13.720  180.624   16.315  205.311   25.354   92.870   4.2595   98.146   6.2634 -5.275620 7.574488 
1 1 1   25   11   23 o   38.455   5.3283   33.022   8.2762   50.885   12.082   17.228   11.361   48.931   5.9865   27.979   8.8162 20.95218 10.65659 
1 1 1   25   11   24 o   21.837   5.9389   7.4730   7.6506   4.0758   11.123   10.523   10.540   20.276   8.3177   23.397   8.4791 -3.120378 11.87771 
1 1 1   25   11   25 o   36.009   5.7689   29.911   8.3868   25.227   12.299   33.983   11.466   33.068   8.8452   38.950   7.4083 -5.881126 11.53777 
1 1 1   25   11   26 o   19.960   6.0286   0.8095   8.6183   5.1801   13.800  -1.9849   11.035   22.334   9.2246   17.587   7.7643 4.746725 12.05726 
1 1 1   25   11   27 o   22.239   6.4151   6.3318   8.6759   5.1382   16.168   6.8145   10.282   23.514   9.8691   20.964   8.1985 2.550491 12.83023 
1 1 1   25   11   28 f   43.630   5.2703   45.033   8.7809   27.941   12.915   59.726   11.974   34.448   8.9935   52.812   5.4973 -18.36459 10.54051 
1 1 1   25   11   29 o   28.529   5.7674   18.385   8.6667  -0.0677   13.238   32.225   11.465   19.661   8.5973   37.397   7.6900 -17.73601 11.53476 
1 1 1   25   11   30 o   24.693   6.3289   12.485   8.3716   16.471   12.302   9.0475   11.425   26.917   9.2106   22.469   8.6824 4.447573 12.65774 
1 1 1   25   11   31 o   43.875   5.5616   45.188   9.5581   28.169   13.234   63.745   13.819   33.924   9.2182   53.826   6.2248 -19.90202 11.12311 
1 1 1   25   11   32 o   33.961   7.3140   30.278   10.996   32.528   13.124   24.975   20.146   36.469   8.8215   31.452   11.669 5.016397 14.62805 
1 1 1   25   11   33 o   29.772   8.8074   17.396   12.518   17.643   13.024   14.406   45.330   27.224   9.4689   32.319   14.853 -5.094711 17.61476 
1 1 1   25   11   34 o   25.642   7.4975   12.311   12.290   11.978   14.852   13.032   21.888   24.475   9.7650   26.809   11.379 -2.334278 14.99490 
1 1 1   25   11   35 o   24.369   7.3431   9.5718   12.756   13.984   14.875  -2.6883   24.795   25.165   9.8559   23.572   10.888 1.592869 14.68623 
1 1 1   25   11   36 o   21.384   7.1834 -16.7257   18.153 -45.4774   28.761   2.3124   23.403   18.983   9.4371   23.784   10.833 -4.800591 14.36689 
1 1 1   25   11   37 f   28.567   8.5528   20.622   18.687   0.8730   29.327   34.121   24.246   24.686   11.550   32.449   12.618 -7.763397 17.10561 
1 1 1   25   12    0 o  113.829   2.5235  268.487   16.717  268.487   16.717  268.487   16.717  113.829   3.5688  113.829   3.5688 0.000000 0.000000 
1 1 1   25   12    1 o  201.292   2.5782  838.859   21.405  838.343   30.270  839.375   30.272  201.230   3.6471  201.354   3.6451 -0.1242218 5.156366 
1 1 1   25   12    2 o  155.897   2.4658  502.184   15.842  524.126   22.980  482.314   21.868  159.134   3.5013  152.659   3.4731 6.474976 4.931690 
1 1 1   25   12    3 o  146.135   2.3280  441.295   13.915  445.874   21.127  437.786   18.494  146.775   3.4900  145.495   3.0818 1.279312 4.655934 
1 1 1   25   12    4 o   35.491   4.6551   26.479   6.6484   31.055   9.9403   22.776   8.9432   38.579   6.2471   32.402   6.9032 6.176971 9.310240 
1 1 1   25   12    5 o  167.171   2.5224  577.544   17.373  556.619   23.905  600.970   25.293  163.973   3.5347  170.369   3.5995 -6.395325 5.044812 
1 1 1   25   12    6 o  261.065   2.8491  1412.31   30.666  1394.26   42.687  1431.56   44.083  259.354   3.9906  262.775   4.0674 -3.420746 5.698146 
1 1 1   25   12    7 o   77.500   2.8716  124.711   9.1674  128.582   12.783  120.610   13.154   78.753   3.9355   76.247   4.1830 2.506531 5.743254 
1 1 1   25   12    8 o  122.462   2.3907  313.052   11.960  288.480   17.748  333.490   16.187  117.983   3.6473  126.941   3.0916 -8.958511 4.781325 
1 1 1   25   12    9 f   87.223   2.4642  157.682   8.8634  155.022   12.572  160.310   12.498   86.487   3.5244   87.960   3.4450 -1.472450 4.928407 
1 1 1   25   12   10 o  188.053   2.4273  735.021   18.689  714.344   27.959  751.720   25.126  185.594   3.6526  190.512   3.1977 -4.918350 4.854534 
1 1 1   25   12   11 o  129.770   2.4888  349.498   13.308  338.590   19.031  359.935   18.616  127.768   3.6115  131.771   3.4253 -4.003754 4.977517 
1 1 1   25   12   12 o   97.980   2.6321  199.625   10.612  192.802   15.373  205.836   14.668   96.352   3.8684   99.608   3.5704 -3.255104 5.264268 
1 1 1   25   12   13 f  104.050   2.8336  222.107   11.413  233.699   20.174  216.651   13.841  105.882   4.6196  102.218   3.2829 3.664101 5.667295 
1 1 1   25   12   14 o   84.537   3.0807  152.041   10.062  139.614   17.224  158.479   12.397   81.695   5.1117   87.379   3.4400 -5.684059 6.161407 
1 1 1   25   12   15 o   95.446   2.8822  191.110   10.534  185.823   18.632  193.594   12.771   94.293   4.7910   96.599   3.2053 -2.306671 5.764347 
1 1 1   25   12   16 o   83.086   2.7489  143.789   9.1375  143.016   14.823  144.263   11.605   82.815   4.3396   83.358   3.3754 -0.5425720 5.497773 
1 1 1   25   12   17 o  127.826   2.6202  340.058   13.788  334.607   20.034  344.964   19.004  126.815   3.8304  128.836   3.5764 -2.020699 5.240422 
1 1 1   25   12   18 o   58.317   3.8138   71.665   9.1496   70.375   13.354   72.807   12.562   57.775   5.6040   58.860   5.1744 -1.084904 7.627506 
1 1 1   25   12   19 o   86.194   2.7746  155.263   9.5696  154.431   15.513  155.775   12.159   85.878   4.3796   86.510   3.4077 -0.6317902 5.549184 
1 1 1   25   12   20 o   80.151   3.1519  135.042   10.384  128.376   15.076  141.058   14.322   78.199   4.6744   82.102   4.2294 -3.903282 6.303764 
1 1 1   25   12   21 o   80.042   4.4620  134.365   14.730  134.365   14.730   0.0000   0.0000   80.042   4.4620  ?   ?       ?      ? 
1 1 1   25   12   22 o   93.077   5.1063  201.655   14.818  211.447   16.562  162.365   33.176  100.579   3.9924   85.575   9.3998 15.00482 10.21256 
1 1 1   25   12   23 o   37.495   5.4302   31.527   8.1152   33.336   11.545   29.761   11.410   38.637   7.5151   36.352   7.8403 2.285244 10.86035 
1 1 1   25   12   24 o   82.957   3.7293  148.721   12.180  156.237   15.364  136.004   19.985   86.213   4.3207   79.701   6.0796 6.512230 7.458506 
1 1 1   25   12   25 o   48.508   5.9282   52.689   11.566   52.117   15.691   53.369   17.116   48.729   7.8072   48.287   8.9232 0.4426765 11.85647 
1 1 1   25   12   26 o   33.205   5.9631   25.422   8.2516   30.423   11.874   20.751   11.476   36.412   8.1138   29.997   8.7408 6.415396 11.92625 
1 1 1   25   12   27 o   22.597   6.2551   7.3229   9.1900 -10.8176   17.336   14.413   10.838   19.502   9.0416   25.693   8.6461 -6.191238 12.51020 
1 1 1   25   12   28 o   70.326   3.4895  105.965   10.068   96.880   14.528  114.359   13.964   67.266   5.2365   73.386   4.6136 -6.119568 6.979027 
1 1 1   25   12   29 o   20.691   5.9267   5.7951   7.8608   3.8378   12.025   7.2558   10.388   20.348   8.5241   21.033   8.2365 -0.6853428 11.85333 
1 1 1   25   12   30 o   37.548   5.9468   32.522   8.9301   41.007   13.881   26.532   11.664   41.731   8.3565   33.364   8.4633 8.367352 11.89362 
1 1 1   25   12   31 o   54.526   6.1675   70.721   12.137   71.101   14.481   69.823   22.249   56.714   6.1909   52.338   10.669 4.375698 12.33500 
1 1 1   25   12   32 f   57.812   5.5037   71.837   12.091   64.335   14.264   90.987   22.790   53.763   6.4326   61.861   8.9321 -8.098545 11.00731 
1 1 1   25   12   33 o   35.045   8.7749   33.982   13.372   35.605   13.895   13.637   49.189   37.832   9.0302   32.258   15.048 5.573566 17.54972 
1 1 1   25   12   34 o   22.660   7.0679   3.9050   11.580   2.4355   13.522   7.9474   22.426   20.021   8.7236   25.299   11.123 -5.277588 14.13581 
1 1 1   25   12   35 o   30.284   7.8522   25.144   12.580   27.380   14.551   18.529   25.034   32.032   9.9592   28.536   12.143 3.495554 15.70446 
1 1 1   25   12   36 o   28.469   8.3129   15.898   18.572 -18.5094   28.836   40.288   24.278   21.841   10.554   35.097   12.846 -13.25612 16.62577 
1 1 1   25   12   37 o   31.826   9.1500   33.440   18.673   35.130   29.203   32.271   24.286   32.034   13.340   31.618   12.527 0.4158115 18.30003 
1 1 1   25   13    0 o   11.366   5.2682  -1.2634   8.7183  -1.2634   8.7183  -1.2634   8.7183   11.366   7.4504   11.366   7.4504 0.000000 0.000000 
1 1 1   25   13    1 o   66.801   3.0237   92.671   8.3061  101.711   11.824   83.865   11.670   70.037   4.0933   63.566   4.4514 6.471878 6.047366 
1 1 1   25   13    2 o  104.500   2.4278  226.928   10.378  218.940   15.557  233.331   13.929  102.808   3.6690  106.192   3.1804 -3.383621 4.855510 
1 1 1   25   13    3 o  130.725   2.3328  354.153   12.484  350.085   18.782  357.373   16.710  130.021   3.5023  131.429   3.0826 -1.407990 4.665621 
1 1 1   25   13    4 o  130.951   2.3324  354.004   12.505  363.004   18.970  347.089   16.629  132.391   3.4741  129.511   3.1131 2.880219 4.664833 
1 1 1   25   13    5 o  120.997   2.5450  302.586   12.684  286.882   17.419  320.314   18.507  117.666   3.5892  124.329   3.6090 -6.663826 5.089937 
1 1 1   25   13    6 o  178.613   2.5389  660.404   18.688  642.446   25.788  680.265   27.120  176.069   3.5511  181.157   3.6297 -5.088364 5.077881 
1 1 1   25   13    7 o   60.372   3.0744   75.534   7.6001   77.468   11.520   74.044   10.113   61.029   4.5768   59.715   4.1061 1.314461 6.148745 
1 1 1   25   13    8 o  122.673   2.2259  311.648   11.261  310.872   15.998  312.411   15.855  122.518   3.1659  122.827   3.1298 -0.3086624 4.451761 
1 1 1   25   13    9 o   18.822   4.6683   2.1591   5.6731  -9.7750   8.0715   13.811   7.9753   12.359   5.8662   25.284   7.2636 -12.92511 9.336602 
1 1 1   25   13   10 o   96.927   2.3622  194.690   9.4346  183.317   13.215  206.514   13.474   94.031   3.4074   99.823   3.2726 -5.792732 4.724492 
1 1 1   25   13   11 o   19.257   5.1800   3.2359   6.1038   11.300   9.2770  -2.9199   8.1052   23.730   7.9991   14.783   6.5836 8.946910 10.35999 
1 1 1   25   13   12 o  176.348   2.2177  644.556   16.128  630.145   22.663  659.343   22.956  174.347   3.1517  178.349   3.1208 -4.002518 4.435367 
1 1 1   25   13   13 o   69.731   3.2349  107.010   8.7469   81.213   13.917  123.854   11.246   62.237   5.4215   77.225   3.5307 -14.98731 6.469876 
1 1 1   25   13   14 o  108.521   2.7856  249.297   11.614  233.215   20.205  257.232   14.193  105.672   4.6359  111.370   3.0898 -5.697960 5.571227 
1 1 1   25   13   15 o   40.453   6.0212   35.334   7.7827   36.426   18.507   35.099   8.5780   39.961   10.919   40.945   5.0796 -0.9838867 12.04233 
1 1 1   25   13   16 o   30.291   5.8196   21.602   7.1232   14.295   14.116   24.097   8.2506   27.305   9.8247   33.278   6.2405 -5.972879 11.63911 
1 1 1   25   13   17 o   77.422   3.2669  125.438   10.424  132.570   14.933  118.662   14.557   79.585   4.5495   75.260   4.6896 4.324966 6.533764 
1 1 1   25   13   18 o   95.845   2.8464  191.887   11.244  192.458   16.222  191.359   15.599   95.960   4.0987   95.731   3.9507 0.2289963 5.692720 
1 1 1   25   13   19 o   99.895   2.6513  210.370   10.675  196.933   16.683  219.686   13.890   97.030   4.1686  102.759   3.2774 -5.729080 5.302690 
1 1 1   25   13   20 o   90.189   3.0708  170.285   11.418  164.456   15.880  176.523   16.428   88.591   4.3459   91.786   4.3396 -3.194855 6.141558 
1 1 1   25   13   21 o   32.549   6.6891   23.006   9.2365   19.591   11.520   29.153   15.454   29.561   8.7970   35.536   10.079 -5.975433 13.37819 
1 1 1   25   13   22 o   85.849   5.2613  163.350   13.993  165.581   15.459  153.230   32.926   88.897   4.2162   82.802   9.6411 6.095299 10.52269 
1 1 1   25   13   23 o   40.207   5.1750   36.018   8.3163   30.004   11.867   41.823   11.658   36.299   8.1284   44.115   6.4072 -7.816505 10.35008 
1 1 1   25   13   24 o   79.558   3.1663  133.566   10.336  117.533   14.543  149.930   14.693   74.630   4.7248   84.487   4.2164 -9.856247 6.332623 
1 1 1   25   13   25 o   40.949   5.8403   37.839   9.3355   40.813   14.999   35.959   11.928   41.955   8.9412   39.943   7.5160 2.012047 11.68053 
1 1 1   25   13   26 o   81.031   3.2260  139.186   10.727  123.245   15.146  155.233   15.196   76.249   4.8161   85.813   4.2935 -9.564766 6.452044 
1 1 1   25   13   27 o   71.448   4.1405  109.172   11.477  112.926   20.041  107.340   14.000   71.829   6.7648   71.067   4.7762 0.7615356 8.280962 
1 1 1   25   13   28 o   85.100   3.2397  154.123   11.361  149.832   16.252  158.223   15.888   83.874   4.6979   86.325   4.4623 -2.450829 6.479383 
1 1 1   25   13   29 o   81.530   3.3325  141.923   11.203  139.890   15.942  143.907   15.747   80.915   4.7769   82.145   4.6478 -1.229866 6.664936 
1 1 1   25   13   30 o   32.843   6.5072   26.142   9.5406   35.957   13.781   17.106   13.222   38.527   8.8576   27.159   9.5351 11.36731 13.01440 
1 1 1   25   13   31 o   28.044   6.5584   18.142   11.044   31.625   13.438  -9.9097   19.384   35.795   9.0863   20.294   9.4599 15.50183 13.11679 
1 1 1   25   13   32 o   71.545   4.7408  109.890   12.937  101.892   15.382  129.220   23.912   68.288   5.4613   74.801   7.7508 -6.512993 9.481588 
1 1 1   25   13   33 o   33.740   8.0503   31.055   12.851   30.739   15.519   31.744   22.921   34.075   10.226   33.405   12.436 0.6700783 16.10057 
1 1 1   25   13   34 o   37.775   6.5181   44.737   13.883   65.515   16.212 -12.4005   26.884   52.960   7.4219   22.590   10.717 30.37028 13.03629 
1 1 1   25   13   35 o   11.722   5.9068 -36.6876   13.199 -36.6876   13.199   0.0000   0.0000   11.722   5.9068  ?   ?       ?      ? 
1 1 1   25   13   36 o   28.953   8.8244   21.335   21.894 -43.3270   49.749   36.867   24.382   24.490   12.212   33.417   12.741 -8.927351 17.64875 
1 1 1   25   14    0 o  148.406   2.1748  455.630   18.808  455.630   18.808  455.630   18.808  148.406   3.0756  148.406   3.0756 0.000000 0.000000 
1 1 1   25   14    1 o   44.969   3.7407   42.027   6.9192   44.038   10.250   40.344   9.3783   45.943   5.4094   43.996   5.1683 1.946648 7.481469 
1 1 1   25   14    2 o  115.153   2.3554  274.286   11.093  277.717   16.860  271.667   14.729  115.755   3.5315  114.550   3.1176 1.204086 4.710712 
1 1 1   25   14    3 o  102.287   2.4455  217.707   10.219  209.936   15.400  223.821   13.660  100.611   3.7112  103.962   3.1857 -3.351204 4.890958 
1 1 1   25   14    4 f  105.672   2.4297  232.742   10.496  220.095   15.675  243.021   14.132  103.015   3.6892  108.329   3.1629 -5.314003 4.859444 
1 1 1   25   14    5 o   72.513   2.9589  109.614   8.8162  118.804   12.354  100.078   12.585   75.648   3.9596   69.377   4.3981 6.271255 5.917897 
1 1 1   25   14    6 o  191.887   2.5761  763.076   20.375  746.526   28.209  781.128   29.460  189.725   3.6049  194.049   3.6810 -4.323776 5.152180 
1 1 1   25   14    7 o  104.025   2.4302  222.602   10.351  238.282   15.807  210.831   13.696  107.184   3.5757  100.865   3.2922 6.318848 4.860497 
1 1 1   25   14    8 o   52.672   3.1136   57.724   6.7628   58.277   9.6771   57.196   9.4549   52.915   4.4340   52.429   4.3724 0.4866295 6.227249 
1 1 1   25   14    9 o  147.893   2.1714  453.009   13.242  440.183   18.551  466.333   18.908  145.756   3.0859  150.030   3.0557 -4.274002 4.342831 
1 1 1   25   14   10 o   30.046   5.0930   19.292   6.2050   24.495   9.6289   15.596   8.1146   33.405   7.2009   26.687   7.2043 6.717890 10.18598 
1 1 1   25   14   11 o   84.659   2.6542  151.125   9.1119  134.048   13.709  164.639   12.196   80.240   4.1424   89.077   3.3195 -8.837151 5.308359 
1 1 1   25   14   12 o   54.898   3.4908   61.887   7.6055   67.223   12.833   58.998   9.4425   56.596   5.4976   53.199   4.3034 3.396221 6.981588 
1 1 1   25   14   13 o   15.461   4.8904  -4.2382   6.1446   0.0122   10.308  -6.5814   7.6532   18.054   7.7396   12.867   5.9801 5.186954 9.780725 
1 1 1   25   14   14 f   62.088   3.4678   79.907   8.2809   82.653   14.749   78.643   10.007   62.706   5.7030   61.470   3.9470 1.235756 6.935620 
1 1 1   25   14   15 o  111.548   2.8040  263.496   11.919  247.668   21.075  270.939   14.451  108.820   4.6956  114.277   3.0661 -5.456940 5.608015 
1 1 1   25   14   16 o   22.049   5.7011   7.6358   6.4829   13.236   11.333   4.9123   7.9037   25.543   8.8357   18.556   7.2071 6.987883 11.40229 
1 1 1   25   14   17 o  100.284   2.7864  209.511   11.491  216.061   17.016  204.020   15.581  101.684   4.0573   98.884   3.8203 2.800369 5.572803 
1 1 1   25   14   18 o   50.797   4.0732   54.543   8.5147   59.883   12.340   49.690   11.764   53.196   5.6241   48.397   5.8936 4.798756 8.146499 
1 1 1   25   14   19 o   76.878   2.9044  122.380   8.9465  128.891   14.648  118.506   11.299   78.374   4.5316   75.382   3.6340 2.992043 5.808708 
1 1 1   25   14   20 o   70.999   3.4727  106.103   10.158  105.739   14.698  106.435   14.055   70.847   5.0299   71.150   4.7894 -0.3027802 6.945407 
1 1 1   25   14   21 o   24.520   6.4380   7.9101   9.9712   20.281   13.291  -8.0157   15.080   30.124   9.5407   18.917   8.6469 11.20643 12.87608 
1 1 1   25   14   22 o   54.195   5.1267   62.930   11.348   52.160   15.176   76.587   17.090   48.902   7.5245   59.488   6.9653 -10.58662 10.25345 
1 1 1   25   14   23 o   43.098   5.0994   41.278   8.6500   30.417   12.044   52.848   12.431   36.513   8.1985   49.683   6.0664 -13.16978 10.19880 
1 1 1   25   14   24 o   26.499   6.1384   10.266   8.5677   29.051   14.091  -0.7518   10.792   35.158   9.4945   17.841   7.7830 17.31624 12.27688 
1 1 1   25   14   25 o   56.662   4.0436   68.937   9.4200   62.981   13.343   74.856   13.301   54.119   5.9776   59.206   5.4471 -5.087738 8.087182 
1 1 1   25   14   26 o   66.325   3.5354   94.444   9.5820   84.526   13.991  103.205   13.150   62.845   5.3977   69.805   4.5674 -6.959743 7.070857 
1 1 1   25   14   27 o   42.999   6.3182   46.348   9.7706   36.234   18.852   50.062   11.425   37.879   11.249   48.120   5.7565 -10.24092 12.63638 
1 1 1   25   14   28 f  116.419   2.9038  288.035   13.868  271.618   20.308  302.383   18.985  113.113   4.3529  119.724   3.8446 -6.611153 5.807686 
1 1 1   25   14   29 o   45.119   5.1127   46.928   9.0934   39.648   13.400   53.143   12.380   41.013   8.2084   49.225   6.0978 -8.212666 10.22549 
1 1 1   25   14   30 o   71.831   3.8589  112.427   11.403  112.939   16.742  111.983   15.573   71.844   5.6501   71.817   5.2575 0.2693939E-01 7.717890 
1 1 1   25   14   31 o   36.112   7.5039   31.926   11.266   27.791   13.574   41.079   20.195   33.314   9.4452   38.911   11.663 -5.596405 15.00779 
1 1 1   25   14   32 o   24.027   8.3315 -14.7352   11.427 -18.3676   11.849   33.607   43.225   13.453   6.5613   34.601   15.317 -21.14767 16.66295 
1 1 1   25   14   33 o   27.315   6.9765   12.384   13.047   35.850   17.228 -19.1650   19.977   36.167   10.757   18.462   8.8871 17.70521 13.95294 
1 1 1   25   14   34 o   37.056   10.420   37.519   16.592   37.519   16.592   0.0000   0.0000   37.056   10.420  ?   ?       ?      ? 
1 1 1   25   14   35 o   20.427   6.5064  -0.3060   11.922   7.6677   14.208 -19.2776   21.916   21.852   9.2156   19.003   9.1871 2.849285 13.01275 
1 1 1   25   14   36 o   20.719   7.0279 -14.3181   17.449 -33.7025   29.702  -4.1037   21.561   20.117   9.9266   21.320   9.9514 -1.202740 14.05587 
1 1 1   25   15    0 o   18.903   6.3999   10.996   8.1179   10.996   8.1179   10.996   8.1179   18.903   9.0508   18.903   9.0508 0.000000 0.000000 
1 1 1   25   15    1 o   22.845   5.3236   10.464   5.8575   8.4041   8.1302   12.688   8.4462   21.195   7.4740   24.496   7.5829 -3.300774 10.64711 
1 1 1   25   15    2 o   63.576   2.7938   83.788   7.2959   94.741   10.559   73.783   10.092   67.562   3.7894   59.589   4.1063 7.972740 5.587623 
1 1 1   25   15    3 o   98.840   2.4457  202.707   9.9024  201.331   14.869  203.804   13.275   98.507   3.6597   99.174   3.2454 -0.6673813 4.891361 
1 1 1   25   15    4 o   59.990   3.2140   74.893   7.9493   73.632   11.062   76.239   11.431   59.472   4.5100   60.507   4.5804 -1.034813 6.428023 
1 1 1   25   15    5 o   34.962   4.9793   26.639   6.9284   25.462   9.6073   27.915   10.001   34.137   7.0567   35.786   7.0268 -1.648663 9.958553 
1 1 1   25   15    6 o  154.443   2.3613  492.945   14.881  483.561   19.577  505.785   22.900  152.765   3.1071  156.121   3.5564 -3.355896 4.722527 
1 1 1   25   15    7 o   31.320   4.7228   21.407   5.9304   25.988   8.5686   17.194   8.2163   34.658   6.2231   27.982   7.1059 6.675451 9.445646 
1 1 1   25   15    8 o   49.983   3.3062   52.831   6.6983   42.262   9.5668   62.994   9.3816   44.949   5.1604   55.016   4.1344 -10.06768 6.612365 
1 1 1   25   15    9 o   58.268   3.1794   72.156   7.4547   63.491   11.459   78.515   9.8160   55.092   5.0429   61.443   3.8734 -6.351135 6.358820 
1 1 1   25   15   10 o  152.915   2.3609  486.940   14.746  473.349   22.291  497.516   19.663  150.938   3.5806  154.893   3.0779 -3.956024 4.721702 
1 1 1   25   15   11 o   34.735   4.3572   26.110   6.0437   23.220   8.8561   28.628   8.2683   32.535   6.8180   36.936   5.4275 -4.401749 8.714478 
1 1 1   25   15   12 o   55.396   3.4404   64.714   7.5502   62.127   12.416   66.233   9.5106   54.398   5.5342   56.394   4.0889 -1.996567 6.880853 
1 1 1   25   15   13 o   90.968   2.6460  174.714   9.7005  158.311   15.006  186.490   12.714   87.149   4.1748   94.786   3.2522 -7.637268 5.292081 
1 1 1   25   15   14 o  108.353   2.7669  248.632   11.515  233.604   20.062  256.016   14.062  105.651   4.6039  111.055   3.0701 -5.403534 5.533711 
1 1 1   25   15   15 o  140.437   2.6719  412.176   14.327  408.842   25.603  413.696   17.287  139.725   4.4428  141.149   2.9695 -1.423355 5.343832 
1 1 1   25   15   16 o   23.515   5.8721   10.459   6.5782   11.857   12.424   9.9142   7.7544   25.103   9.1892   21.928   7.3134 3.175325 11.74427 
1 1 1   25   15   17 o   39.978   4.9013   34.671   7.8801   35.594   11.725   33.912   10.642   40.095   7.3615   39.861   6.4729 0.2332611 9.802556 
1 1 1   25   15   18 o   55.286   3.7851   63.966   8.5865   73.430   12.830   56.288   11.556   58.974   5.2746   51.598   5.4303 7.376621 7.570284 
1 1 1   25   15   19 o   83.264   2.8193  141.689   9.4575  159.651   15.440  130.904   11.965   87.307   4.2878   79.222   3.6617 8.084648 5.638585 
1 1 1   25   15   20 f   78.483   3.3009  129.675   10.667  121.266   15.096  138.061   15.075   75.887   4.8230   81.078   4.5081 -5.190773 6.601856 
1 1 1   25   15   21 f   25.296   6.5303   12.627   8.7809   14.463   10.963   9.3430   14.667   25.941   8.6958   24.650   9.7450 1.291227 13.06067 
1 1 1   25   15   22 o   16.857   5.3691  -7.4726   8.1258 -15.2989   10.952   2.1099   12.119   13.674   6.5817   20.040   8.4847 -6.366772 10.73814 
1 1 1   25   15   23 o   25.178   5.7213   10.381   7.8867   25.296   11.714  -1.9873   10.667   33.089   8.5291   17.267   7.6280 15.82176 11.44252 
1 1 1   25   15   24 o   21.865   6.0299   6.5290   8.4801  -4.6899   13.818   13.308   10.741   18.740   8.4504   24.990   8.6041 -6.250732 12.05983 
1 1 1   25   15   25 o   28.974   5.9665   18.906   8.0858   9.8235   11.414   28.055   11.456   23.118   8.7407   34.830   8.1238 -11.71174 11.93298 
1 1 1   25   15   26 o   64.684   3.6283   89.542   9.6650   89.892   14.069   89.229   13.300   64.739   5.2689   64.628   4.9897 0.1106033 7.256629 
1 1 1   25   15   27 o   31.339   7.1043   26.110   10.303  -2.4981   28.369   30.456   11.058   26.396   11.985   36.283   7.6314 -9.886740 14.20870 
1 1 1   25   15   28 o   26.930   6.2943   12.171   8.7153   30.513   14.594   2.0042   10.865   35.146   9.7342   18.715   7.9824 16.43099 12.58863 
1 1 1   25   15   29 o   23.265   6.4504   8.2312   9.3403   1.0113   12.517   17.302   14.030   19.267   8.3943   27.263   9.7962 -7.996050 12.90076 
1 1 1   25   15   30 o   30.042   7.0561   23.012   11.364   31.799   13.981   5.8963   19.512   35.711   9.3734   24.373   10.550 11.33847 14.11215 
1 1 1   25   15   31 o   39.190   7.4417   37.620   11.643   31.962   14.058   49.976   20.775   35.551   9.4322   42.828   11.513 -7.277058 14.88336 
1 1 1   25   15   32 o   36.886   6.8274   38.771   11.661   48.582   14.229   18.707   20.347   45.583   7.5685   28.190   11.365 17.39231 13.65483 
1 1 1   25   15   33 o   41.169   6.9577   51.759   13.549   69.459   16.629   16.796   23.371   54.493   7.3988   27.845   11.785 26.64755 13.91536 
1 1 1   25   15   34 o   21.269   9.2546   4.7102   15.174   4.7102   15.174   0.0000   0.0000   21.269   9.2546  ?   ?       ?      ? 
1 1 1   25   15   35 o   25.441   7.5044   14.731   12.898   15.725   16.141   12.976   21.455   25.431   10.169   25.451   11.039 -0.1941872E-01 15.00882 
1 1 1   25   16    0 o   23.996   6.2695   16.106   8.1340   16.106   8.1340   16.106   8.1340   23.996   8.8664   23.996   8.8664 0.000000 0.000000 
1 1 1   25   16    1 o   71.325   2.5789  105.625   7.5860  107.226   10.759  104.042   10.698   71.865   3.6298   70.785   3.6643 1.079597 5.157750 
1 1 1   25   16    2 o   75.714   2.5095  119.127   7.8268  113.114   11.127  125.016   11.012   73.805   3.6553   77.622   3.4395 -3.816406 5.019098 
1 1 1   25   16    3 o   72.814   2.5761  110.139   7.7214  101.363   10.834  119.200   11.008   69.849   3.7605   75.780   3.5220 -5.931458 5.152264 
1 1 1   25   16    4 o  100.227   2.4516  208.200   10.071  205.882   13.472  211.135   15.162   99.630   3.2785  100.824   3.6461 -1.194489 4.903296 
1 1 1   25   16    5 o  109.684   2.4161  249.235   10.842  246.121   14.408  253.302   16.464  108.937   3.2067  110.431   3.6148 -1.493469 4.832173 
1 1 1   25   16    6 o  171.683   2.1976  611.120   15.560  616.984   22.146  605.402   21.868  172.495   3.1128  170.871   3.1029 1.623657 4.395208 
1 1 1   25   16    7 o  178.037   2.2163  657.360   16.273  649.403   22.912  665.461   23.118  176.948   3.1394  179.125   3.1291 -2.177689 4.432550 
1 1 1   25   16    8 o  223.102   2.4995  1032.58   22.810  1022.55   30.308  1045.67   34.642  221.956   3.3107  224.248   3.7454 -2.292297 4.998928 
1 1 1   25   16    9 o  104.257   2.9955  237.032   11.696  200.127   20.654  254.452   14.190   97.751   5.1229  110.762   3.1062 -13.01141 5.991091 
1 1 1   25   16   10 o   49.643   3.2249   51.498   6.5912   50.486   9.5554   52.417   9.1038   49.157   4.7130   50.129   4.4032 -0.9726677 6.449871 
1 1 1   25   16   11 o  103.097   2.5039  220.711   10.344  221.635   16.753  220.141   13.151  103.178   3.9368  103.016   3.0952 0.1620789 5.007840 
1 1 1   25   16   12 o   72.009   2.9451  106.215   8.5047  116.541   14.008  100.185   10.703   74.649   4.5497   69.369   3.7410 5.279343 5.890184 
1 1 1   25   16   13 o   35.114   4.9294   27.193   6.6703   25.682   11.276   28.006   8.2728   33.796   8.1783   36.431   5.5057 -2.635715 9.858833 
1 1 1   25   16   14 f   40.141   4.5741   35.097   6.9667   34.020   11.838   35.667   8.6167   39.119   7.6112   41.163   5.0754 -2.043217 9.148226 
1 1 1   25   16   15 o   91.422   3.1130  172.719   11.490  186.556   18.510  164.044   14.656   94.238   4.7623   88.606   4.0103 5.632484 6.225932 
1 1 1   25   16   16 o   62.192   3.5384   83.243   8.3248   76.740   14.804   86.251   10.067   60.102   5.9719   64.281   3.7972 -4.178822 7.076887 
1 1 1   25   16   17 o   83.391   3.0111  145.602   10.309  145.972   15.333  145.296   13.927   83.427   4.4561   83.354   4.0511 0.7266998E-01 6.022274 
1 1 1   25   16   18 o   52.079   4.0765   58.086   8.6622   51.628   12.702   63.700   11.843   49.218   6.2572   54.940   5.2266 -5.722157 8.152951 
1 1 1   25   16   19 o   24.970   5.5865   10.241   6.6076   23.379   11.523   3.8060   8.0651   32.019   8.5606   17.921   7.1800 14.09756 11.17303 
1 1 1   25   16   20 o   99.642   2.8554  209.521   11.650  184.832   16.709  232.877   16.252   93.774   4.3203  105.510   3.7347 -11.73648 5.710742 
1 1 1   25   16   21 o   75.504   3.7054  119.976   11.179  117.141   14.089  124.793   18.367   74.557   4.5817   76.452   5.8248 -1.894386 7.410773 
1 1 1   25   16   22 o   84.195   3.3822  149.388   11.633  145.908   15.354  154.077   17.826   83.181   4.4755   85.210   5.0721 -2.029518 6.764310 
1 1 1   25   16   23 o   89.395   3.7379  170.321   13.780  172.466   19.448  168.158   19.529   89.985   5.2401   88.805   5.3320 1.180878 7.475839 
1 1 1   25   16   24 o   37.426   5.6412   32.142   8.4241   32.859   12.390   31.526   11.488   37.726   8.1971   37.127   7.7525 0.5991821 11.28241 
1 1 1   25   16   25 o   28.515   6.3095   18.736   8.2118   21.163   12.347   16.810   10.997   29.951   9.1510   27.080   8.6890 2.871132 12.61904 
1 1 1   25   16   26 o   34.927   6.2400   29.072   8.9736   28.220   12.237   30.064   13.198   34.456   8.6298   35.399   9.0155 -0.9429932 12.48006 
1 1 1   25   16   27 o   27.362   7.3190   14.185   9.7412   21.582   20.986   12.154   10.998   30.748   11.797   23.975   8.6656 6.773619 14.63798 
1 1 1   25   16   28 o   26.547   6.3232   16.362   8.1474   18.405   12.351   14.789   10.840   27.741   9.2288   25.353   8.6464 2.388988 12.64640 
1 1 1   25   16   29 o   16.104   5.2375  -5.8497   8.0070  -8.7376   12.024  -3.5487   10.733   15.837   7.4050   16.371   7.4090 -0.5348978 10.47509 
1 1 1   25   16   30 o   24.411   7.0253   2.8397   10.658  -6.4423   12.548   26.887   20.197   16.797   7.7540   32.025   11.717 -15.22770 14.05068 
1 1 1   25   16   31 o   31.517   7.7075   26.056   11.684   25.357   14.044   27.629   21.061   31.254   9.7950   31.779   11.903 -0.5252209 15.41500 
1 1 1   25   16   32 o   74.115   5.3973  130.693   15.931  137.117   20.530  120.969   25.257   77.792   6.3987   70.439   8.6937 7.352531 10.79458 
1 1 1   25   16   33 o   40.807   7.3843   50.767   14.249   65.463   17.783   24.416   23.813   51.777   8.3274   29.837   12.197 21.93970 14.76850 
1 1 1   25   16   34 o   21.326   9.3058   5.0532   15.437   5.0532   15.437   0.0000   0.0000   21.326   9.3058  ?   ?       ?      ? 
1 1 1   25   16   35 o   29.774   7.9341   26.316   13.275   28.585   15.929   21.157   24.018   31.494   10.481   28.054   11.915 3.440012 15.86820 
1 1 1   25   17    0 o  108.466   2.2369  243.944   14.125  243.944   14.125  243.944   14.125  108.466   3.1635  108.466   3.1635 0.000000 0.000000 
1 1 1   25   17    1 o  133.980   2.1712  372.220   11.998  373.532   17.008  370.921   16.926  134.214   3.0725  133.745   3.0684 0.4690399 4.342330 
1 1 1   25   17    2 o   26.217   4.8451   14.592   5.7642   23.626   8.2856   6.1202   8.0242   32.941   6.3285   19.493   7.3382 13.44765 9.690117 
1 1 1   25   17    3 o   75.824   2.5256  119.457   7.8802  108.993   11.023  130.396   11.270   72.408   3.6910   79.240   3.4483 -6.831360 5.051154 
1 1 1   25   17    4 o   31.527   4.8877   22.046   6.2926   26.216   8.4754   16.923   9.3935   35.301   5.8211   27.754   7.8532 7.547077 9.775426 
1 1 1   25   17    5 o   75.577   2.7069  117.518   8.3836  107.683   11.112  130.511   12.773   71.961   3.7441   79.193   3.9104 -7.231651 5.413843 
1 1 1   25   17    6 o   39.613   3.7504   32.866   6.1214   33.608   8.8906   32.198   8.4408   40.027   5.3853   39.198   5.2210 0.8289413 7.500706 
1 1 1   25   17    7 o   86.940   2.3939  156.949   8.5829  155.345   12.198  158.521   12.080   86.494   3.4192   87.385   3.3516 -0.8913269 4.787875 
1 1 1   25   17    8 o   37.320   4.4018   28.816   6.4123   42.684   10.031   19.233   8.3384   45.100   5.3927   29.540   6.9585 15.56044 8.803580 
1 1 1   25   17    9 o   56.750   3.1549   67.651   7.2478   65.110   11.272   69.442   9.4637   55.762   4.9009   57.737   3.9741 -1.975006 6.309717 
1 1 1   25   17   10 o   76.990   2.8699  126.515   8.7426  112.547   14.092  135.256   11.147   73.313   4.6604   80.666   3.3505 -7.352562 5.739814 
1 1 1   25   17   11 o   80.685   2.7649  134.385   8.9318  141.794   14.660  130.012   11.264   82.332   4.3173   79.038   3.4552 3.293640 5.529718 
1 1 1   25   17   12 o  126.060   2.4510  333.544   12.496  316.371   19.412  345.693   16.328  123.137   3.8223  128.984   3.0692 -5.846939 4.902078 
1 1 1   25   17   13 o   17.923   5.1423   2.6673   6.2235  -5.4989   10.583   6.9841   7.6946   16.094   7.3127   19.752   7.2316 -3.657312 10.28451 
1 1 1   25   17   14 o   74.523   2.9061  116.292   8.6251  115.586   14.141  116.710   10.884   74.205   4.6205   74.840   3.5261 -0.6352768 5.812223 
1 1 1   25   17   15 o   28.201   5.7217   14.979   6.6647   26.654   12.381   10.216   7.9083   34.213   8.7416   22.190   7.3849 12.02268 11.44346 
1 1 1   25   17   16 o   39.245   4.9115   30.359   7.1181   42.093   13.734   26.049   8.3232   43.440   7.9586   35.050   5.7576 8.390026 9.822924 
1 1 1   25   17   17 o   83.310   3.0223  146.367   10.314  133.145   15.006  158.205   14.199   79.627   4.5690   86.993   3.9573 -7.366020 6.044555 
1 1 1   25   17   18 o   52.211   4.0169   57.995   8.6479   59.680   12.272   56.332   12.188   52.983   5.6160   51.440   5.7447 1.543156 8.033755 
1 1 1   25   17   19 o   18.575   4.9341   3.9795   6.0676 -10.2762   10.500   11.126   7.4345   14.492   6.8215   22.659   7.1308 -8.167271 9.868179 
1 1 1   25   17   20 o   84.374   3.4950  148.330   11.993  137.905   15.506  163.849   18.919   80.861   4.6495   87.886   5.2194 -7.024933 6.989985 
1 1 1   25   17   21 o   76.853   3.2248  125.182   10.161  119.485   14.997  130.017   13.816   75.117   4.8405   78.589   4.2623 -3.471489 6.449597 
1 1 1   25   17   22 f   51.771   4.1468   57.458   8.8403   59.129   12.941   55.996   12.105   52.434   5.9840   51.109   5.7425 1.325066 8.293640 
1 1 1   25   17   23 o   28.497   6.9268   18.201   9.8616   16.543   14.575   19.600   13.392   27.759   9.9836   29.235   9.6045 -1.476252 13.85351 
1 1 1   25   17   24 f   64.326   3.8427   89.250   10.147   85.115   14.855   92.867   13.894   62.774   5.7375   65.878   5.1135 -3.103584 7.685450 
1 1 1   25   17   25 o   61.991   3.6521   82.232   9.3156   85.949   13.755   79.083   12.662   63.229   5.2743   60.752   5.0531 2.476269 7.304277 
1 1 1   25   17   26 o   60.907   3.8594   81.330   9.5390   69.445   14.008   91.606   13.026   56.391   6.0229   65.422   4.8274 -9.030125 7.718760 
1 1 1   25   17   27 o   63.186   4.4981   88.863   11.040   87.112   18.900   89.770   13.601   61.936   7.3986   64.436   5.1177 -2.500526 8.996109 
1 1 1   25   17   28 o   27.242   6.4882   17.510   8.7913   13.126   12.535   21.755   12.333   24.710   9.1970   29.775   9.1542 -5.065397 12.97632 
1 1 1   25   17   29 o   59.310   4.1130   77.796   9.9789   67.205   14.136   88.315   14.089   54.989   6.2329   63.632   5.3682 -8.643116 8.225948 
1 1 1   25   17   30 o   61.510   5.2630   83.830   12.689   75.665   15.424  100.930   22.321   57.926   6.4557   65.094   8.3138 -7.168213 10.52598 
1 1 1   25   17   31 o   53.169   6.1561   66.498   12.464   60.696   15.153   78.637   21.918   51.185   7.1776   55.153   10.004 -3.968231 12.31217 
1 1 1   25   17   32 o   59.569   6.8067   89.495   15.457   86.266   19.107   95.610   26.293   60.237   7.6907   58.902   11.233 1.335060 13.61341 
1 1 1   25   17   33 o   19.774   6.5402 -10.4309   12.610 -20.3111   15.716   7.4262   21.128   15.545   7.5760   24.004   10.663 -8.459364 13.08045 
1 1 1   25   17   34 o   38.933   8.2499   47.102   14.000   47.746   16.598   45.515   26.065   41.897   9.7827   35.968   13.287 5.929134 16.49979 
1 1 1   25   18    0 o  217.255   2.3046  977.088   29.190  977.088   29.190  977.088   29.190  217.255   3.2592  217.255   3.2592 0.000000 0.000000 
1 1 1   25   18    1 o   55.391   2.9654   63.930   6.7745   64.661   9.6320   63.215   9.5301   55.705   4.1923   55.078   4.1952 0.6268692 5.930877 
1 1 1   25   18    2 o  149.113   2.1707  460.880   13.346  447.433   18.651  474.993   19.107  146.883   3.0787  151.344   3.0610 -4.460953 4.341398 
1 1 1   25   18    3 o   33.168   4.7618   24.149   6.2664   24.747   8.4745   23.427   9.3082   33.723   6.3253   32.613   7.1198 1.109779 9.523654 
1 1 1   25   18    4 o  127.332   2.3468  337.418   12.220  343.032   16.329  330.272   18.422  128.599   3.0787  126.066   3.5430 2.532867 4.693686 
1 1 1   25   18    5 o   84.871   2.6006  148.580   9.0402  139.974   11.970  160.005   13.792   82.061   3.5367   87.681   3.8138 -5.619240 5.201272 
1 1 1   25   18    6 o   55.218   2.9537   63.615   6.7179   68.038   9.5799   59.335   9.4230   57.124   4.0661   53.313   4.2854 3.810394 5.907435 
1 1 1   25   18    7 o   91.045   2.5267  172.472   9.3791  172.738   14.396  172.276   12.363   91.043   3.8338   91.046   3.2923 -0.2944946E-02 5.053441 
1 1 1   25   18    8 o  147.751   2.3638  455.154   14.264  445.610   21.615  462.517   18.985  146.282   3.5826  149.219   3.0848 -2.936630 4.727674 
1 1 1   25   18    9 o  154.040   2.1909  491.271   13.894  458.766   18.998  528.648   20.372  148.582   3.1000  159.499   3.0967 -10.91685 4.381769 
1 1 1   25   18   10 o   81.076   2.8181  139.837   9.0681  127.183   14.614  147.760   11.563   77.881   4.5495   84.270   3.3270 -6.388176 5.636240 
1 1 1   25   18   11 f   34.552   5.1143   29.447   6.8803   16.189   11.620   36.604   8.5377   27.393   8.9439   41.710   4.9629 -14.31721 10.22860 
1 1 1   25   18   12 f   39.071   4.5476   30.054   6.8382   48.590   11.693   20.421   8.4299   47.840   5.9263   30.303   6.8995 17.53722 9.095277 
1 1 1   25   18   13 o   71.933   2.9620  107.811   8.4620  110.147   14.060  106.483   10.596   72.401   4.7086   71.464   3.5948 0.9366760 5.923961 
1 1 1   25   18   14 o   81.460   2.7729  138.486   9.0025  139.242   14.778  138.040   11.352   81.501   4.3963   81.419   3.3805 0.8182526E-01 5.545728 
1 1 1   25   18   15 o   44.292   4.2505   35.774   7.1177   58.781   13.914   27.619   8.2837   52.464   6.4300   36.119   5.5606 16.34544 8.500933 
1 1 1   25   18   16 o  135.690   2.6837  379.283   13.922  399.592   25.184  370.345   16.707  137.943   4.4266  133.436   3.0356 4.506973 5.367453 
1 1 1   25   18   17 o   23.084   5.9008   5.8138   7.7911   20.249   12.701  -2.8945   9.8652   29.884   9.3067   16.284   7.2568 13.59971 11.80151 
1 1 1   25   18   18 o   67.323   3.5835   96.311   9.8979   85.672   14.055  106.779   13.941   63.515   5.3651   71.131   4.7521 -7.615776 7.167046 
1 1 1   25   18   19 o   82.588   3.0460  144.317   10.239  137.772   15.592  149.280   13.577   80.786   4.6795   84.391   3.9006 -3.604454 6.092019 
1 1 1   25   18   20 o   20.342   6.0763   2.3271   8.8783   5.9116   11.881  -2.2061   13.361   21.463   8.6736   19.222   8.5119 2.241383 12.15253 
1 1 1   25   18   21 o   19.117   5.5707   2.9907   7.3285  -2.8073   11.276   7.2302   9.6424   17.416   7.7600   20.818   7.9945 -3.402645 11.14133 
1 1 1   25   18   22 o   61.551   4.1833   81.331   10.180   83.108   17.048   80.347   12.691   61.688   6.7004   61.414   5.0104 0.2742729 8.366601 
1 1 1   25   18   23 o   36.434   6.2917   31.329   9.3765   27.462   12.745   35.892   13.844   33.936   8.9696   38.933   8.8255 -4.996376 12.58344 
1 1 1   25   18   24 o   33.258   5.9114   26.760   8.2076   20.593   12.423   31.538   10.934   29.472   9.2084   37.043   7.4151 -7.570719 11.82281 
1 1 1   25   18   25 o   36.927   5.7414   32.093   8.4464   32.043   12.850   32.131   11.207   36.616   8.6472   37.239   7.5553 -0.6226082 11.48287 
1 1 1   25   18   26 o   39.299   5.5577   37.102   8.7255   28.038   12.962   44.613   11.800   33.745   9.1033   44.853   6.3783 -11.10857 11.11543 
1 1 1   25   18   27 o   54.844   4.8872   60.900   10.403   90.270   19.104   48.521   12.403   62.994   7.3530   46.695   6.4400 16.29905 9.774462 
1 1 1   25   18   28 o   27.610   6.5251   18.405   8.7217   18.932   12.643   17.927   12.047   27.925   9.3387   27.295   9.1158 0.6295795 13.05023 
1 1 1   25   18   29 o   63.363   5.3201   96.265   12.316  101.407   14.748   84.419   22.385   68.072   5.2530   58.654   9.2532 9.417927 10.64029 
1 1 1   25   18   30 o   26.625   6.9687   17.356   10.055   19.490   12.110   12.620   18.041   27.823   9.1328   25.427   10.528 2.396114 13.93748 
1 1 1   25   18   31 o   18.127   5.9863 -10.8929   11.651   0.6730   15.126 -27.7620   18.268   20.137   8.9790   16.116   7.9196 4.020651 11.97253 
1 1 1   25   18   32 o   33.690   8.2349   31.942   13.358   25.441   16.417   44.678   22.978   30.095   10.620   37.285   12.589 -7.190397 16.46988 
1 1 1   25   18   33 o   27.915   7.8783   20.639   13.180   17.976   16.311   25.650   22.375   26.359   10.321   29.471   11.906 -3.112095 15.75660 
1 1 1   25   19    0 o   15.813   6.0655   7.5338   7.8606   7.5338   7.8606   7.5338   7.8606   15.813   8.5779   15.813   8.5779 0.000000 0.000000 
1 1 1   25   19    1 f   40.328   3.7499   34.502   6.1514   27.950   8.6701   41.144   8.7289   36.365   5.7807   44.291   4.7783 -7.926556 7.499899 
1 1 1   25   19    2 o   67.520   2.6480   94.975   7.3719   96.335   10.582   93.693   10.276   67.983   3.7740   67.056   3.7154 0.9276276 5.295979 
1 1 1   25   19    3 o   51.341   3.3139   55.022   6.9742   53.111   9.2938   57.484   10.551   50.363   4.4742   52.318   4.8898 -1.955379 6.627847 
1 1 1   25   19    4 o   89.596   2.5452  167.686   9.3059  170.584   12.360  163.893   14.140   90.562   3.3091   88.630   3.8682 1.931892 5.090484 
1 1 1   25   19    5 o   76.203   2.5335  121.012   7.9562  127.242   11.295  114.877   11.209   78.167   3.5035   74.239   3.6607 3.928345 5.067072 
1 1 1   25   19    6 o   34.471   4.6652   26.486   6.3495   22.131   9.7493   29.694   8.3674   31.436   7.6026   37.506   5.4091 -6.069401 9.330483 
1 1 1   25   19    7 o  101.124   2.4744  212.689   10.213  215.038   15.644  210.943   13.483  101.541   3.7354  100.708   3.2460 0.8329163 4.948764 
1 1 1   25   19    8 f   43.149   3.5306   39.183   6.2812   40.434   8.9109   37.948   8.8554   43.844   4.9277   42.453   5.0575 1.391438 7.061171 
1 1 1   25   19    9 o  111.603   2.4350  257.730   10.912  266.641   17.702  252.269   13.857  113.031   3.7971  110.176   3.0495 2.855629 4.870030 
1 1 1   25   19   10 o  112.487   2.4569  262.670   11.099  267.763   17.934  259.508   14.130  113.242   3.8397  111.733   3.0663 1.508598 4.913804 
1 1 1   25   19   11 o  143.128   2.4231  430.342   14.068  404.612   21.586  449.337   18.547  139.232   3.7590  147.023   3.0587 -7.790833 4.846142 
1 1 1   25   19   12 o   32.334   5.0806   26.470   6.7505   10.921   11.546   34.546   8.3210   24.164   8.8566   40.503   4.9810 -16.33965 10.16118 
1 1 1   25   19   14 o   66.627   3.2052   97.857   8.2683   77.500   13.399  110.377   10.508   60.504   5.3692   72.749   3.5020 -12.24559 6.410348 
1 1 1   25   19   15 o   33.148   5.4549   25.593   7.4578   18.411   11.801   30.368   9.6231   28.644   8.9791   37.652   6.1968 -9.007463 10.90980 
1 1 1   25   19   16 o   14.487   4.7223  -5.4742   6.2872 -14.0009   11.762  -2.0633   7.4392   14.686   7.0019   14.288   6.3382 0.3978043 9.444510 
1 1 1   25   19   17 o   85.181   3.3884  154.322   11.762  145.129   17.736  161.540   15.716   82.723   5.1983   87.639   4.3477 -4.916321 6.776843 
1 1 1   25   19   18 o   69.773   3.4120  104.322   9.6603   94.023   14.564  112.412   12.909   66.469   5.3125   73.076   4.2829 -6.607277 6.823914 
1 1 1   25   19   19 o   19.943   5.5066   2.8992   6.2876   13.374   11.680  -1.3750   7.4609   25.314   8.9548   14.573   6.4113 10.74040 11.01327 
1 1 1   25   19   20 o   72.075   3.8255  110.666   11.077  109.535   14.132  112.470   17.839   71.879   4.7668   72.270   5.9847 -0.3909683 7.651068 
1 1 1   25   19   21 o   44.177   4.7390   43.757   8.2641   35.638   11.880   51.369   11.504   39.522   7.5636   48.832   5.7117 -9.309978 9.477931 
1 1 1   25   19   22 o   63.404   4.2003   89.562   10.248   79.863   17.407   94.707   12.679   60.079   7.0250   66.729   4.6067 -6.650795 8.400683 
1 1 1   25   19   23 o   31.340   6.6361   23.764   9.5252   29.617   13.048   17.085   13.937   35.122   8.9741   27.557   9.7784 7.565178 13.27217 
1 1 1   25   19   24 o   43.547   6.5970   45.623   11.250   47.360   18.139   44.537   14.341   43.563   10.264   43.530   8.2903 0.3279877E-01 13.19404 
1 1 1   25   19   25 o   85.540   3.1907  157.263   11.206  146.207   16.209  167.385   15.510   82.467   4.7657   88.612   4.2438 -6.145393 6.381329 
1 1 1   25   19   26 o   29.973   5.9023   20.513   8.1446   33.376   12.186   10.128   10.950   37.380   8.1351   22.566   8.5540 14.81389 11.80468 
1 1 1   25   19   27 o   30.355   6.7651   24.208   10.152   11.026   17.843   30.518   12.345   25.347   10.481   35.363   8.5569 -10.01645 13.53025 
1 1 1   25   19   28 o   20.074   5.9484   3.8006   8.4519   9.4729   12.334  -1.2207   11.605   22.492   8.9224   17.655   7.8691 4.837070 11.89674 
1 1 1   25   19   29 o   69.236   4.7194  107.756   12.700  104.520   15.514  114.330   22.113   68.777   5.4692   69.695   7.6928 -0.9174042 9.438814 
1 1 1   25   19   30 o   23.108   6.8938   6.7613   10.409   2.6092   12.433   16.494   19.035   19.366   8.4017   26.850   10.932 -7.484041 13.78759 
1 1 1   25   19   31 o   58.866   6.1096   88.066   13.948   97.229   18.467   75.897   21.282   64.441   6.9482   53.290   10.051 11.15104 12.21912 
1 1 1   25   19   32 o   46.956   8.0230   63.161   15.677   44.736   20.729   87.784   23.963   37.870   11.905   56.042   10.758 -18.17170 16.04603 
1 1 1   25   20    0 o   33.725   4.9020   26.579   8.5190   26.579   8.5190   26.579   8.5190   33.725   6.9325   33.725   6.9325 0.000000 0.000000 
1 1 1   25   20    1 o   96.302   2.3028  192.906   9.1459  189.719   12.892  196.136   12.977   95.497   3.2731   97.107   3.2401 -1.610130 4.605618 
1 1 1   25   20    2 o   47.475   3.3018   47.330   6.4525   51.118   9.1911   43.649   9.0608   49.376   4.5132   45.573   4.8205 3.802555 6.603510 
1 1 1   25   20    3 o   53.288   3.2139   59.241   7.0231   56.770   9.3660   62.415   10.615   52.060   4.3619   54.515   4.7212 -2.454723 6.427764 
1 1 1   25   20    4 o  111.746   2.4069  258.916   10.989  252.440   14.498  267.660   16.846  110.175   3.1906  113.317   3.6045 -3.141754 4.813752 
1 1 1   25   20    5 o  125.466   2.1948  327.139   11.353  314.116   15.910  340.649   16.205  122.911   3.1384  128.020   3.0691 -5.108818 4.389624 
1 1 1   25   20    6 o   48.111   3.5375   49.619   6.8604   43.614   10.474   54.131   9.0788   45.391   5.5950   50.832   4.3304 -5.441078 7.075035 
1 1 1   25   20    7 o   84.676   2.6201  148.949   9.0660  154.233   13.894  145.031   11.964   85.919   3.9207   83.432   3.4768 2.487137 5.240228 
1 1 1   25   20    8 o   74.017   2.8896  116.479   8.4944  107.059   13.710  122.349   10.822   71.392   4.6560   76.641   3.4235 -5.249557 5.779185 
1 1 1   25   20    9 o   52.986   3.5089   59.479   7.3073   57.861   12.265   60.369   9.0985   52.252   5.6910   53.720   4.1065 -1.467762 7.017879 
1 1 1   25   20   10 o   69.436   2.9579   97.333   8.2424  116.474   13.707   86.492   10.316   74.523   4.4596   64.348   3.8868 10.17468 5.915713 
1 1 1   25   20   11 f  160.425   2.6085  537.144   17.256  523.964   24.365  550.408   24.442  158.430   3.7288  162.421   3.6486 -3.990509 5.216924 
1 1 1   25   20   12 o   37.756   4.7120   30.839   6.8625   32.092   11.535   30.152   8.5377   37.812   7.6592   37.701   5.4906 0.1109428 9.423935 
1 1 1   25   20   13 o  112.970   2.7814  270.140   11.915  259.953   21.371  274.735   14.352  111.052   4.6659  114.888   3.0288 -3.835434 5.562749 
1 1 1   25   20   14 o   42.834   4.1084   38.614   6.9149   40.981   11.853   37.392   8.5140   43.608   6.5900   42.060   4.9079 1.547951 8.216733 
1 1 1   25   20   15 o  123.731   2.5402  325.007   12.650  293.690   19.617  347.297   16.550  118.341   4.0191  129.122   3.1077 -10.78022 5.080464 
1 1 1   25   20   16 o   32.354   5.6206   22.655   6.8069   26.849   13.190   21.133   7.9469   33.923   9.1963   30.785   6.4647 3.138836 11.24117 
1 1 1   25   20   17 o   80.019   3.5410  137.090   11.508  128.341   17.533  143.712   15.253   77.529   5.4831   82.509   4.4822 -4.980698 7.082008 
1 1 1   25   20   18 o   88.480   3.3125  165.778   11.764  165.467   18.916  165.974   15.022   88.145   5.2032   88.815   4.1008 -0.6697769 6.624948 
1 1 1   25   20   19 o   85.605   3.0786  156.847   10.689  140.800   16.123  169.430   14.277   81.426   4.8008   89.784   3.8554 -8.357559 6.157275 
1 1 1   25   20   20 o  106.712   2.8933  240.317   12.686  241.907   18.795  238.986   17.194  106.931   4.2616  106.493   3.9146 0.4374542 5.786629 
1 1 1   25   20   21 o   24.896   6.4847   12.962   8.6722   7.6949   15.569   15.332   10.442   23.822   9.8142   25.969   8.4784 -2.147421 12.96932 
1 1 1   25   20   22 o   28.324   6.2730   18.228   8.1488   23.787   12.565   14.192   10.705   31.444   9.1418   25.205   8.5923 6.238615 12.54593 
1 1 1   25   20   23 o   34.072   5.5182   26.195   8.6990   47.214   12.785   8.0761   11.870   46.095   6.7249   22.049   8.7510 24.04563 11.03649 
1 1 1   25   20   24 o   33.224   6.5218   27.032   9.3992   20.741   12.862   34.241   13.769   29.127   9.4026   37.322   9.0403 -8.195337 13.04363 
1 1 1   25   20   25 o   27.213   6.2494   16.883   8.1351   23.667   12.408   11.768   10.774   30.983   9.1064   23.444   8.5611 7.538862 12.49871 
1 1 1   25   20   26 o   27.504   5.7147   17.076   8.3503   0.7906   12.291   31.036   11.380   18.951   8.2857   36.057   7.8728 -17.10531 11.42948 
1 1 1   25   20   27 o   43.112   6.1195   43.527   10.173   55.105   17.199   37.296   12.617   46.960   9.2093   39.265   8.0610 7.694244 12.23892 
1 1 1   25   20   28 o   20.776   6.4791  -2.7351   10.536 -11.2149   12.965   13.752   18.078   15.704   7.4481   25.848   10.604 -10.14436 12.95810 
1 1 1   25   20   29 o   48.058   6.3637   55.844   11.628   51.787   14.126   64.369   20.477   47.062   7.2775   49.054   10.441 -1.991619 12.72738 
1 1 1   25   20   30 o   49.755   6.7622   64.245   13.255   59.857   17.433   70.257   20.406   48.223   9.0985   51.287   10.006 -3.063831 13.52430 
1 1 1   25   20   31 o   46.302   7.8651   61.547   14.434   60.228   18.015   63.911   24.123   47.647   9.5003   44.957   12.537 2.689602 15.73011 
1 1 1   25   21    0 o   67.198   2.6884   94.580   10.460   94.580   10.460   94.580   10.460   67.198   3.8019   67.198   3.8019 0.000000 0.000000 
1 1 1   25   21    1 o   70.437   2.6067  103.522   7.5703  100.322   10.693  106.738   10.719   69.334   3.7393   71.540   3.6328 -2.206390 5.213357 
1 1 1   25   21    2 o  145.400   2.3602  438.292   14.002  427.940   18.403  452.523   21.578  143.461   3.1103  147.340   3.5508 -3.879486 4.720375 
1 1 1   25   21    3 o  162.306   2.7923  541.457   18.383  503.899   23.612  599.256   29.292  155.417   3.6836  169.196   4.1975 -13.77914 5.584594 
1 1 1   25   21    4 o   86.757   2.5709  157.156   9.1151  158.385   12.129  155.561   13.816   87.215   3.3719   86.299   3.8817 0.9160156 5.141717 
1 1 1   25   21    5 o   66.241   2.9289   92.549   7.8736   87.211   12.066   96.507   10.391   64.469   4.5379   68.013   3.7041 -3.544395 5.857717 
1 1 1   25   21    6 o   94.987   2.5113  187.166   9.7260  193.910   15.042  182.320   12.750   96.382   3.7838   93.592   3.3030 2.790352 5.022677 
1 1 1   25   21    7 o  105.099   2.7532  230.506   11.882  202.343   16.474  261.039   17.153   98.356   4.0610  111.842   3.7186 -13.48547 5.506316 
1 1 1   25   21    8 o   96.298   3.1979  192.990   12.701   0.0000   0.0000  192.990   12.701  ?   ?    96.298   3.1979      ?      ? 
1 1 1   25   21    9 o  101.698   2.8307  218.344   10.931  211.786   19.602  221.304   13.169  100.274   4.7397  103.123   3.0963 -2.849007 5.661472 
1 1 1   25   21   10 o   70.889   2.9697  105.877   8.4079  103.779   13.636  107.164   10.680   70.161   4.7122   71.618   3.6156 -1.457565 5.939445 
1 1 1   25   21   11 o   32.513   5.2349   23.661   6.5994   24.256   11.284   23.352   8.1359   32.534   8.3634   32.492   6.2983 0.4197693E-01 10.46973 
1 1 1   25   21   12 o   22.516   5.6112   8.3457   6.2390   15.952   11.104   4.8364   7.5422   26.920   8.7407   18.111   7.0387 8.809576 11.22244 
1 1 1   25   21   13 o   98.291   2.7866  206.630   11.013  179.599   16.880  226.663   14.531   92.369   4.4307  104.212   3.3808 -11.84251 5.573240 
1 1 1   25   21   14 o   34.979   5.0027   25.744   6.5855   32.877   11.865   22.568   7.9168   38.056   7.8210   31.902   6.2403 6.153316 10.00543 
1 1 1   25   21   15 o   22.897   5.7230   10.387   6.4273   11.354   11.360   9.9320   7.7948   24.040   8.7891   21.755   7.3323 2.285461 11.44596 
1 1 1   25   21   16 o   39.886   5.1162   38.962   7.3362   26.854   12.956   44.676   8.9007   33.833   9.0905   45.939   4.6976 -12.10606 10.23249 
1 1 1   25   21   17 o   34.967   7.0060   25.291   9.0156   37.777   19.974   22.097   10.103   38.967   11.580   30.966   7.8886 8.001503 14.01204 
1 1 1   25   21   18 o   40.195   5.6970   41.347   8.9306   21.949   14.412   53.438   11.378   30.533   9.9602   49.857   5.5334 -19.32393 11.39405 
1 1 1   25   21   19 o   32.692   5.8017   25.019   7.6465   25.078   12.495   24.984   9.6683   32.409   9.0179   32.974   7.3017 -0.5648689 11.60334 
1 1 1   25   21   20 o   43.662   4.7209   41.787   8.4172   43.664   12.941   40.410   11.082   44.334   7.0772   42.991   6.2498 1.342979 9.441762 
1 1 1   25   21   21 f   34.710   5.6728   32.255   8.6272   11.084   14.687   43.408   10.660   24.736   9.7604   44.683   5.7843 -19.94679 11.34565 
1 1 1   25   21   22 o   49.436   4.9112   57.682   9.1586   39.224   13.501   73.417   12.465   40.600   8.3416   58.273   5.1864 -17.67320 9.822484 
1 1 1   25   21   23 o   48.032   4.4298   50.216   8.6912   60.567   13.305   42.512   11.479   52.324   6.1652   43.740   6.3627 8.583603 8.859641 
1 1 1   25   21   24 o   86.326   3.5136  159.960   12.408  153.226   16.396  168.986   18.982   84.413   4.7093   88.239   5.2158 -3.825912 7.027225 
1 1 1   25   21   25 o   30.479   6.1337   23.436   8.4803   15.008   12.841   29.956   11.293   25.629   9.3483   35.328   7.9436 -9.698866 12.26748 
1 1 1   25   21   26 o   21.285   6.0989   7.5057   8.2920   8.1216   12.415   7.0097   11.141   21.833   8.8513   20.738   8.3927 1.094574 12.19772 
1 1 1   25   21   27 o   35.088   6.6900   34.139   10.015   23.720   18.117   38.723   12.018   29.910   11.072   40.267   7.5125 -10.35682 13.37999 
1 1 1   25   21   28 o   23.374   7.1020   7.7827   12.348   9.4761   16.920   5.8529   18.062   23.765   10.041   22.982   10.046 0.7830524 14.20407 
1 1 1   25   21   29 o   51.692   5.8598   62.647   11.912   51.645   14.841   82.567   19.971   45.561   8.1994   57.823   8.3739 -12.26218 11.71969 
1 1 1   25   21   30 o   50.783   6.7302   67.041   13.746   57.794   18.306   78.995   20.813   46.166   9.9103   55.401   9.1088 -9.235546 13.46044 
1 1 1   25   22    0 o   15.203   5.9713   6.8133   7.8163   6.8133   7.8163   6.8133   7.8163   15.203   8.4447   15.203   8.4447 0.000000 0.000000 
1 1 1   25   22    1 o  115.450   2.2261  277.329   10.600  279.511   15.024  275.166   14.957  115.904   3.1428  114.996   3.1536 0.9077148 4.452245 
1 1 1   25   22    2 o   48.855   4.3107   53.359   7.8112   57.324   9.4369   44.731   13.921   52.268   4.3775   45.443   7.4273 6.824837 8.621308 
1 1 1   25   22    3 o   64.639   2.8993   87.319   7.7057   85.175   10.443   89.882   11.418   63.801   3.9684   65.476   4.2279 -1.675228 5.798539 
1 1 1   25   22    4 o   91.259   2.9706  171.773   10.995  190.055   17.525  159.908   14.119   95.098   4.4682   87.420   3.9158 7.677940 5.941275 
1 1 1   25   22    5 o   74.413   2.7494  116.480   8.3329  111.794   12.682  120.040   11.054   72.994   4.2125   75.831   3.5343 -2.836815 5.498734 
1 1 1   25   22    6 o   55.859   3.4379   65.833   7.5534   66.035   12.756   65.724   9.3733   55.727   5.5499   55.990   4.0590 -0.2627220 6.875835 
1 1 1   25   22    7 f  126.359   2.4212  338.448   12.260  308.972   19.310  358.354   15.869  121.477   3.8542  131.242   2.9317 -9.765648 4.842480 
1 1 1   25   22    8 o  109.581   2.5274  249.955   11.157  255.353   17.882  246.516   14.276  110.397   3.9273  108.765   3.1823 1.632851 5.054798 
1 1 1   25   22    9 o   51.784   3.5433   53.199   7.2568   69.801   12.655   45.066   8.8577   57.334   5.3518   46.234   4.6451 11.10046 7.086521 
1 1 1   25   22   10 o   78.950   2.8708  130.752   9.0078  130.812   14.862  130.717   11.325   78.783   4.5739   79.116   3.4706 -0.3333740 5.741531 
1 1 1   25   22   11 o   27.374   5.5031   14.727   6.3107   24.917   11.232   10.026   7.6286   32.934   8.2785   21.814   7.2528 11.11921 11.00619 
1 1 1   25   22   12 f   57.802   3.3956   67.433   7.7146   81.704   13.555   60.595   9.3824   61.949   5.3052   53.654   4.2398 8.294346 6.791255 
1 1 1   25   22   13 o   78.219   3.5821  137.413   10.732  105.855   17.547  156.275   13.566   70.129   6.0667   86.310   3.8108 -16.18159 7.164268 
1 1 1   25   22   14 o   24.472   5.5128   9.7801   6.3713   23.054   11.331   3.6426   7.7047   31.521   8.5148   17.423   7.0045 14.09871 11.02558 
1 1 1   25   22   15 o   69.453   3.3737   98.163   8.9646  113.724   16.507   91.653   10.676   72.881   5.4915   66.026   3.9205 6.854622 6.747319 
1 1 1   25   22   16 o   59.826   3.4307   75.883   8.1493   77.431   13.526   75.002   10.210   60.051   5.4612   59.600   4.1536 0.4500465 6.861322 
1 1 1   25   22   17 o   59.073   4.2628   79.313   9.7011   63.595   15.846   88.735   12.269   53.547   7.1750   64.600   4.6049 -11.05239 8.525564 
1 1 1   25   22   18 o   48.885   5.6524   55.415   10.770   39.340   15.094   72.090   15.373   40.465   9.2461   57.304   6.5045 -16.83921 11.30485 
1 1 1   25   22   19 o   48.049   4.5191   50.892   8.8109   49.451   13.593   51.937   11.571   47.175   6.9860   48.923   5.7345 -1.748295 9.038167 
1 1 1   25   22   20 o   26.743   6.4955   16.630   8.5064   13.273   15.071   18.199   10.305   25.743   9.9651   27.742   8.3344 -1.999266 12.99103 
1 1 1   25   22   21 f   69.127   3.5193  103.798   9.9043   98.316   15.004  108.032   13.185   67.218   5.4118   71.036   4.5004 -3.818146 7.038555 
1 1 1   25   22   22 o  123.394   2.9131  324.498   14.792  318.492   21.535  329.863   20.352  122.165   4.2740  124.624   3.9595 -2.459328 5.826206 
1 1 1   25   22   23 o   41.223   5.2518   39.664   8.5371   37.202   13.236   41.417   11.172   39.269   8.4243   43.176   6.2735 -3.907009 10.50360 
1 1 1   25   22   24 o   76.765   3.6786  129.355   11.532  136.206   15.562  121.012   17.174   79.380   4.7531   74.150   5.6156 5.229729 7.357135 
1 1 1   25   22   25 o   87.684   3.4686  165.111   12.426  151.080   16.271  184.747   19.248   83.443   4.7277   91.925   5.0768 -8.481842 6.937220 
1 1 1   25   22   26 o   40.244   5.5899   40.292   8.9972   25.507   12.909   54.257   12.547   31.422   9.3033   49.065   6.1999 -17.64334 11.17988 
1 1 1   25   22   27 f   53.942   5.1956   67.984   10.829   69.600   18.815   67.183   13.242   53.214   8.5727   54.669   5.8726 -1.455200 10.39127 
1 1 1   25   22   28 o   44.489   7.2676   54.334   13.068   55.757   18.161   52.807   18.817   45.492   9.9559   43.486   10.590 2.005341 14.53513 
1 1 1   25   22   29 o   29.189   7.6171   24.424   12.234   27.181   16.195   20.760   18.672   30.733   10.566   27.644   10.974 3.088642 15.23412 
1 1 1   25   23    0 o   37.600   4.2429   31.758   8.5950   31.758   8.5950   31.758   8.5950   37.600   6.0004   37.600   6.0004 0.000000 0.000000 
1 1 1   25   23    1 o   54.002   3.2566   62.472   7.1265   70.243   9.6673   53.222   10.547   57.873   4.0500   50.131   5.1010 7.742233 6.513297 
1 1 1   25   23    2 o  112.495   2.4064  264.816   11.082  270.412   14.887  257.862   16.596  113.921   3.1683  111.070   3.6228 2.850349 4.812778 
1 1 1   25   23    3 o   61.782   4.2854   86.679   9.6903   69.784   17.401   94.274   11.667   56.566   7.4587   66.997   4.2221 -10.43170 8.570732 
1 1 1   25   23    4 o  145.249   2.8441  435.286   15.473  459.510   29.014  425.657   18.292  147.542   4.7678  142.957   3.1023 4.585907 5.688253 
1 1 1   25   23    5 o   85.229   3.2038  146.298   9.9126  167.473   19.899  139.309   11.432   88.756   5.4357   81.701   3.3926 7.055664 6.407552 
1 1 1   25   23    6 o   68.454   3.0423   99.541   8.2319   94.811   13.568  102.297   10.356   66.954   4.9132   69.955   3.5893 -3.001122 6.084592 
1 1 1   25   23    7 f   69.774   3.1266  106.948   8.4696   87.293   13.794  118.843   10.731   64.120   5.2158   75.427   3.4493 -11.30743 6.253168 
1 1 1   25   23    8 o   56.076   3.7730   66.153   7.8723   68.750   14.837   65.136   9.2874   56.462   6.3712   55.690   4.0435 0.7716637 7.545967 
1 1 1   25   23    9 o   53.726   4.0749   63.320   8.7869   51.761   13.149   72.647   11.812   48.907   6.5184   58.545   4.8917 -9.637585 8.149806 
1 1 1   25   23   10 o  106.941   2.5722  241.630   11.048  229.844   17.513  249.420   14.238  104.552   4.0614  109.330   3.1574 -4.777946 5.144310 
1 1 1   25   23   11 o   86.689   2.7382  158.645   9.3829  154.602   15.565  160.954   11.760   85.589   4.4094   87.790   3.2478 -2.200821 5.476357 
1 1 1   25   23   12 o   80.904   2.8237  139.463   8.9914  131.236   14.907  144.167   11.273   78.752   4.5895   83.056   3.2907 -4.303665 5.647306 
1 1 1   25   23   13 o  106.061   2.5641  238.497   10.815  226.003   17.556  246.137   13.729  103.541   4.1111  108.580   3.0656 -5.039078 5.128266 
1 1 1   25   23   14 o   90.259   2.7361  175.171   9.7548  157.688   15.826  185.881   12.388   86.249   4.4490   94.268   3.1861 -8.018707 5.472160 
1 1 1   25   23   15 o   53.106   3.7812   61.795   7.7762   56.846   13.198   64.427   9.6241   51.043   6.2692   55.170   4.2295 -4.127525 7.562496 
1 1 1   25   23   16 o   63.441   3.2849   83.356   8.2460   94.191   14.104   77.729   10.164   66.248   5.1617   60.633   4.0645 5.615078 6.569840 
1 1 1   25   23   17 o   29.725   6.1835   20.957   7.9941   20.881   12.669   21.007   10.305   29.594   9.3077   29.856   8.1430 -0.2623310 12.36700 
1 1 1   25   23   18 o  100.442   3.5148  216.355   14.548  227.577   21.082  206.152   20.101  102.928   4.9659   97.956   4.9754 4.972427 7.029603 
1 1 1   25   23   19 o   27.336   6.8262   17.295   8.8851   14.726   18.468   18.069   10.135   27.135   10.867   27.537   8.2640 -0.4026318 13.65248 
1 1 1   25   23   20 o   44.980   4.6287   44.592   8.5295   52.198   12.838   38.582   11.412   48.434   6.4265   41.527   6.6632 6.907547 9.257383 
1 1 1   25   23   21 o   39.231   5.4355   38.548   8.4061   22.597   12.730   50.881   11.194   30.241   9.3008   48.221   5.6281 -17.98081 10.87107 
1 1 1   25   23   22 o   89.192   3.1576  171.096   11.561  152.080   16.291  190.387   16.409   83.999   4.7024   94.386   4.2152 -10.38732 6.315115 
1 1 1   25   23   23 o   40.403   5.3734   39.287   8.5666   33.326   13.036   43.817   11.365   36.589   8.7556   44.217   6.2316 -7.627975 10.74676 
1 1 1   25   23   24 o   22.680   6.0409   10.719   8.1019   3.3462   12.802   15.644   10.464   19.949   8.5902   25.410   8.4957 -5.460825 12.08177 
1 1 1   25   23   25 o   57.527   4.7353   76.033   10.954   77.190   14.142   74.299   17.319   58.765   5.8347   56.288   7.4598 2.476688 9.470622 
1 1 1   25   23   26 o   26.899   6.1348   18.155   8.5333   7.6100   12.738   26.741   11.494   21.398   8.8522   32.401   8.4961 -11.00363 12.26969 
1 1 1   25   23   27 o   61.918   5.0021   92.026   12.180   97.334   15.501   83.463   19.690   65.649   5.7249   58.187   8.2044 7.462513 10.00429 
1 1 1   25   23   28 o   41.457   6.3360   53.798   15.938 -19.8741   26.779   94.207   19.833   20.698   10.042   62.216   7.7289 -41.51819 12.67193 
1 1 1   25   24    0 o   80.179   2.5059  134.294   11.667  134.294   11.667  134.294   11.667   80.179   3.5438   80.179   3.5438 0.000000 0.000000 
1 1 1   25   24    1 o   46.817   3.3349   46.358   6.4390   46.047   9.1394   46.664   9.0734   46.653   4.7497   46.982   4.6825 -0.3282776 6.669735 
1 1 1   25   24    2 o   82.069   2.8717  141.349   9.7081  145.194   14.156  137.935   13.339   83.095   4.1304   81.043   3.9907 2.051735 5.743342 
1 1 1   25   24    3 o   73.138   3.1492  112.485   9.3882  115.275   14.496  110.469   12.322   73.799   4.7624   72.478   4.1219 1.320702 6.298404 
1 1 1   25   24    4 o   45.759   6.4494   50.673   9.5217   43.503   21.261   52.472   10.649   41.857   11.804   49.661   5.1993 -7.803635 12.89876 
1 1 1   25   24    5 o  110.555   2.4933  255.424   11.031  257.204   17.929  254.339   13.994  110.671   3.9279  110.439   3.0721 0.2324066 4.986615 
1 1 1   25   24    6 o   79.900   2.8315  136.198   8.9926  125.985   14.506  142.572   11.460   77.210   4.5553   82.591   3.3643 -5.381050 5.663004 
1 1 1   25   24    7 o   12.829   4.3149 -10.0022   5.6739  -5.2708   9.9273 -12.2977   6.9147   15.415   7.0342   10.243   4.9995 5.171355 8.629831 
1 1 1   25   24    8 o   49.937   3.8095   52.670   7.7418   56.782   12.139   49.850   10.052   51.453   5.7199   48.421   5.0331 3.032333 7.618983 
1 1 1   25   24    9 o   25.191   5.8439   13.989   6.9334   13.475   11.044   14.324   8.9076   25.122   8.7204   25.259   7.7820 -0.1367855 11.68778 
1 1 1   25   24   10 o   89.825   2.6606  170.257   9.5411  166.460   15.477  172.585   12.117   88.797   4.2260   90.853   3.2338 -2.055923 5.321268 
1 1 1   25   24   11 o   29.533   5.4887   19.758   6.5005   21.453   11.264   18.912   7.9597   30.235   8.6151   28.832   6.8033 1.402798 10.97746 
1 1 1   25   24   12 o   62.982   3.2313   85.147   7.9145   81.577   13.502   87.016   9.7687   61.639   5.3110   64.325   3.6821 -2.685593 6.462571 
1 1 1   25   24   13 o   16.085   5.0177  -2.1027   5.9150   2.9696   11.028  -4.1515   7.0086   19.341   8.1358   12.829   5.8753 6.512851 10.03550 
1 1 1   25   24   14 o   53.738   3.8183   64.329   7.8884   55.680   13.310   69.012   9.7941   50.387   6.4044   57.089   4.1595 -6.702621 7.636630 
1 1 1   25   24   15 o   19.495   5.4472   5.9932   6.3477   1.3651   11.589   7.9767   7.5869   18.985   8.1741   20.004   7.2021 -1.018614 10.89433 
1 1 1   25   24   16 f   32.194   5.2590   27.464   7.0052   12.276   12.549   34.340   8.4433   24.466   9.1833   39.921   5.1279 -15.45502 10.51797 
1 1 1   25   24   17 o   77.523   3.2458  128.235   10.296  133.055   15.682  124.582   13.650   78.639   4.8351   76.408   4.3316 2.231064 6.491564 
1 1 1   25   24   18 o   32.689   6.8736   26.883   9.9644   25.297   14.135   28.450   14.049   31.734   9.8072   33.644   9.6336 -1.910080 13.74726 
1 1 1   25   24   19 o   31.749   7.1524   23.283   9.2408   30.025   19.915   21.433   10.432   33.673   11.709   29.826   8.2174 3.846560 14.30483 
1 1 1   25   24   20 o  104.518   3.0116  234.236   12.679  229.565   20.078  237.334   16.352  103.234   4.7156  105.801   3.7473 -2.566795 6.023235 
1 1 1   25   24   21 f   24.708   5.5580   12.671   7.8524  -3.2381   11.837   25.175   10.494   17.175   7.7760   32.240   7.9434 -15.06481 11.11597 
1 1 1   25   24   22 o   59.948   3.8965   77.395   9.4974   97.972   14.701   62.657   12.442   66.739   5.3408   53.158   5.6751 13.58089 7.792994 
1 1 1   25   24   23 o   11.241   3.9909 -26.3567   7.4308 -23.9195   12.051 -27.8518   9.4387   12.594   6.2342   9.8886   4.9844 2.705515 7.981814 
1 1 1   25   24   24 o   60.341   3.9598   81.060   9.7562   81.330   14.854   80.856   12.938   60.105   5.9920   60.577   5.1784 -0.4717636 7.919576 
1 1 1   25   24   25 o   39.153   6.4751   39.092   10.228   32.247   13.419   48.582   15.799   34.993   9.1824   43.313   9.1318 -8.320118 12.95012 
1 1 1   25   24   26 o   46.434   5.1937   53.163   9.3337   41.871   13.895   62.447   12.599   40.404   8.6021   52.465   5.8225 -12.06055 10.38740 
1 1 1   25   24   27 o   47.956   6.1019   54.195   11.426   41.774   14.071   78.239   19.577   40.128   8.7484   55.785   8.5087 -15.65627 12.20382 
1 1 1   25   25    0 o   8.0743   4.0152  -7.9320   7.3497  -7.9320   7.3497  -7.9320   7.3497   8.0743   5.6783   8.0743   5.6783 0.000000 0.000000 
1 1 1   25   25    1 o   18.729   4.9477   1.2406   5.8193   13.942   9.3570  -6.7710   7.4314   25.054   8.0125   12.404   5.8068 12.64950 9.895443 
1 1 1   25   25    2 o   19.794   5.4715   5.9153   6.4904   7.3256   9.3165   4.5854   9.0470   20.663   7.8765   18.925   7.5966 1.738152 10.94293 
1 1 1   25   25    3 o   54.371   4.4199   65.356   8.9457   60.499   16.285   67.455   10.706   52.303   7.5492   56.439   4.5990 -4.136131 8.839712 
1 1 1   25   25    4 o   32.239   5.0966   25.839   6.6537   14.371   11.187   32.116   8.2768   25.680   8.7834   38.797   5.1725 -13.11627 10.19325 
1 1 1   25   25    5 o   57.353   3.3976   71.476   7.6366   64.383   12.591   75.602   9.6049   54.755   5.5754   59.950   3.8845 -5.194344 6.795196 
1 1 1   25   25    6 o   72.456   2.9934  115.521   8.4423   94.569   13.681  128.404   10.728   66.595   4.9811   78.318   3.3213 -11.72331 5.986844 
1 1 1   25   25    7 o   31.779   5.1586   23.451   6.4309   20.472   11.267   24.890   7.8320   29.557   8.6748   34.001   5.5849 -4.444023 10.31711 
1 1 1   25   25    8 o   20.415   5.0332   7.8019   6.1253  -6.4860   11.044   14.150   7.3614   15.894   7.3145   24.935   6.9159 -9.041299 10.06634 
1 1 1   25   25    9 o  112.121   2.5610  267.394   11.554  248.652   18.089  280.308   15.016  108.500   4.0423  115.741   3.1455 -7.240883 5.121917 
1 1 1   25   25   10 o   75.398   2.9048  120.937   8.6495  117.639   14.360  122.815   10.836   74.304   4.6857   76.492   3.4346 -2.188087 5.809652 
1 1 1   25   25   11 o   61.397   3.3421   81.020   7.9536   78.561   13.695   82.271   9.7701   60.323   5.5045   62.470   3.7919 -2.147705 6.684152 
1 1 1   25   25   12 o   95.032   2.7657  196.851   10.371  165.858   16.479  217.178   13.346   88.256   4.5271  101.809   3.1783 -13.55222 5.531389 
1 1 1   25   25   13 o   64.263   3.3846   90.761   8.5043   80.012   13.978   97.079   10.716   60.738   5.5798   67.789   3.8326 -7.051273 6.769279 
1 1 1   25   25   14 o   62.194   3.4276   82.704   8.4086   84.442   14.155   81.756   10.453   62.336   5.5058   62.053   4.0841 0.2832565 6.855146 
1 1 1   25   25   15 o   21.511   5.5448   9.6541   6.5638   2.4722   11.917   12.782   7.8641   19.453   8.3301   23.569   7.3204 -4.116344 11.08954 
1 1 1   25   25   16 o   39.306   5.9393   36.257   9.5719   26.225   12.908   48.515   14.268   32.526   9.2065   46.087   7.5060 -13.56123 11.87856 
1 1 1   25   25   17 o   54.057   4.5813   64.984   10.173   63.558   13.732   66.718   15.146   53.562   6.2159   54.553   6.7316 -0.9903717 9.162522 
1 1 1   25   25   18 o   36.729   7.0142   35.525   11.089   27.372   17.371   41.132   14.407   32.401   10.946   41.056   8.7741 -8.655094 14.02836 
1 1 1   25   25   19 o   38.629   5.9778   38.042   8.9813   29.884   15.559   42.119   10.999   33.781   10.262   43.477   6.1336 -9.695824 11.95553 
1 1 1   25   25   20 o   75.842   3.6240  130.122   10.846  105.126   16.846  147.823   14.176   68.647   5.9498   83.038   4.1391 -14.39083 7.247910 
1 1 1   25   25   21 o   43.680   5.2989   45.873   9.1018   38.488   13.552   51.941   12.285   39.336   8.5935   48.025   6.2020 -8.689651 10.59782 
1 1 1   25   25   22 o   24.892   6.2848   14.890   8.1978   12.380   12.728   16.669   10.717   23.794   9.1724   25.991   8.5942 -2.197231 12.56953 
1 1 1   25   25   23 o   25.293   6.1404   13.820   8.1979   25.304   12.650   5.5038   10.764   31.027   9.2147   19.560   8.1184 11.46691 12.28085 
1 1 1   25   25   24 o   65.814   3.8341   97.223   10.361   89.434   14.866  104.579   14.448   62.946   5.7262   68.683   5.1001 -5.737282 7.668128 
1 1 1   25   25   25 o   52.648   4.5255   64.277   9.8052   60.575   13.969   67.873   13.766   50.920   6.6514   54.376   6.1383 -3.455433 9.051020 
1 1 1   25   26    0 f   34.680   4.6573   27.963   8.4326   27.963   8.4326   27.963   8.4326   34.680   6.5865   34.680   6.5865 0.000000 0.000000 
1 1 1   25   26    1 o   22.457   5.5490   10.573   6.3125   11.300   9.3237   9.9572   8.5774   23.041   8.0117   21.873   7.6799 1.167961 11.09810 
1 1 1   25   26    2 o   23.061   6.1331   9.9302   7.1877   10.453   14.394   9.7565   8.2961   24.495   9.6633   21.627   7.5552 2.867720 12.26626 
1 1 1   25   26    3 o   51.681   3.7442   56.876   7.8469   60.177   12.409   54.676   10.129   52.754   5.7033   50.609   4.8526 2.144489 7.488337 
1 1 1   25   26    4 o   24.619   5.0414   14.553   6.1833   2.1705   10.521   21.086   7.6423   18.639   7.8991   30.600   6.2662 -11.96124 10.08274 
1 1 1   25   26    5 o   64.483   3.1280   88.339   8.0026   88.124   13.232   88.463   10.048   64.163   5.0002   64.803   3.7596 -0.6406174 6.255910 
1 1 1   25   26    6 o   56.294   3.3657   65.138   7.4154   75.607   13.056   60.153   9.0097   59.263   5.3414   53.324   4.0965 5.938984 6.731419 
1 1 1   25   26    7 o   45.646   5.0768   43.924   7.5515   52.528   16.893   41.775   8.4419   47.015   9.0402   44.276   4.6227 2.738949 10.15355 
1 1 1   25   26    8 o   90.240   3.4077  177.948   11.353  164.911   20.999  183.332   13.495   87.097   5.8458   93.383   3.5038 -6.286072 6.815405 
1 1 1   25   26    9 o   17.429   5.2031   2.2240   6.2995  -3.8055   11.532   4.7881   7.5206   17.053   7.7020   17.806   6.9975 -0.7529278 10.40610 
1 1 1   25   26   10 o   23.272   5.7121   10.023   6.2491   17.603   11.678   6.9815   7.3972   27.386   8.9674   19.158   7.0781 8.228067 11.42424 
1 1 1   25   26   11 o   55.775   3.5766   66.397   7.6183   68.961   13.710   65.251   9.1631   56.091   5.9264   55.459   4.0059 0.6312218 7.153274 
1 1 1   25   26   12 f   36.076   5.0667   29.813   6.7604   30.015   12.459   29.728   8.0482   35.138   8.6540   37.013   5.2720 -1.875343 10.13338 
1 1 1   25   26   13 o   33.721   5.3547   28.704   6.9622   20.333   12.696   32.303   8.3257   28.861   9.3442   38.580   5.2323 -9.719578 10.70940 
1 1 1   25   26   14 o   36.562   5.1140   31.011   6.8912   30.133   12.694   31.378   8.2056   35.098   8.7885   38.026   5.2319 -2.928425 10.22796 
1 1 1   25   26   15 o   45.949   4.1372   43.140   7.2537   55.573   13.649   38.246   8.5632   49.818   6.6426   42.080   4.9339 7.737427 8.274481 
1 1 1   25   26   16 o   25.428   6.0027   12.856   7.5791   24.304   12.438   6.0945   9.5588   31.238   9.0992   19.618   7.8317 11.61991 12.00544 
1 1 1   25   26   17 o   70.270   3.8708  108.252   11.208  102.597   15.495  114.457   16.231   68.330   5.4982   72.210   5.4498 -3.880440 7.741503 
1 1 1   25   26   18 f   23.129   5.8693   11.469   8.4442 -10.7810   16.458   19.419   9.8378   18.118   8.5320   28.141   8.0624 -10.02316 11.73868 
1 1 1   25   26   19 o   45.384   5.1024   49.222   8.9607   42.482   13.932   53.978   11.702   41.524   8.4226   49.244   5.7618 -7.719578 10.20486 
1 1 1   25   26   20 o   37.044   5.8267   36.293   9.0105   20.961   14.052   47.000   11.742   28.491   9.8395   45.597   6.2439 -17.10625 11.65343 
1 1 1   25   26   21 f   18.833   5.7298   0.8949   7.9127   9.6254   13.068  -4.1585   9.9424   22.441   9.0871   15.225   6.9820 7.216367 11.45963 
1 1 1   25   26   22 o   26.732   6.3778   18.433   8.3050   18.340   12.622   18.504   11.029   26.624   9.3179   26.840   8.7110 -0.2165184 12.75557 
1 1 1   25   26   23 o   28.420   6.4088   21.241   8.3883   22.885   12.966   20.058   11.001   29.098   9.4450   27.742   8.6649 1.356335 12.81751 
1 1 1   25   26   24 o   41.265   5.6297   42.562   9.2314   45.368   13.176   39.856   12.938   42.827   7.7444   39.704   8.1730 3.122623 11.25934 
1 1 1   25   27    0 o   13.933   5.9438   4.5949   8.8162   4.5949   8.8162   4.5949   8.8162   13.933   8.4058   13.933   8.4058 0.000000 0.000000 
1 1 1   25   27    1 o   74.157   4.1385  118.456   12.438  126.701   19.738  113.026   16.019   75.962   6.3001   72.351   5.3682 3.611366 8.277008 
1 1 1   25   27    2 o   47.174   5.7242   64.031   8.8362   28.417   16.599   78.115   10.438   33.663   10.662   60.685   4.1704 -27.02190 11.44848 
1 1 1   25   27    3 o  115.903   2.5276  283.258   11.822  281.137   18.709  284.667   15.252  115.286   3.9347  116.519   3.1737 -1.232887 5.055148 
1 1 1   25   27    4 o   14.959   4.7421  -1.9856   5.7703  -4.8599   10.239  -0.6480   6.9851   15.627   7.1359   14.291   6.2472 1.335603 9.484163 
1 1 1   25   27    5 o   49.505   3.8500   53.280   7.3080   52.604   12.878   53.601   8.8756   48.815   6.3961   50.194   4.2873 -1.378750 7.700065 
1 1 1   25   27    6 o   48.446   4.2885   56.341   7.3564   40.293   12.569   64.703   9.0728   41.649   7.5967   55.242   3.9820 -13.59318 8.577062 
1 1 1   25   27    7 o   31.839   5.4290   23.263   6.6047   25.660   12.112   22.249   7.8791   32.433   8.8213   31.246   6.3308 1.186874 10.85791 
1 1 1   25   27    8 o   21.465   5.6449   7.0631   6.1697   15.683   11.812   3.8293   7.2350   26.029   9.0196   16.902   6.7903 9.126413 11.28988 
1 1 1   25   27    9 o   24.887   5.1673   15.640   6.5485   0.3274   12.059   22.043   7.7985   18.704   8.1915   31.070   6.3011 -12.36660 10.33461 
1 1 1   25   27   10 o   59.686   3.4722   76.696   7.9752   77.219   14.042   76.447   9.6897   59.357   5.7358   60.014   3.9146 -0.6572380 6.944328 
1 1 1   25   27   11 o   39.975   4.8885   37.539   7.0445   33.563   12.811   39.262   8.4340   37.243   8.5243   42.706   4.7882 -5.463409 9.777092 
1 1 1   25   27   12 o   30.365   5.6483   22.388   6.9132   20.508   12.277   23.261   8.3656   28.947   9.1696   31.782   6.5978 -2.835592 11.29653 
1 1 1   25   27   13 o   54.955   3.8233   68.362   7.8551   59.473   13.910   72.525   9.5182   51.520   6.5459   58.389   3.9523 -6.869125 7.646585 
1 1 1   25   27   14 o   39.471   4.9424   34.457   7.1367   39.556   13.445   32.457   8.4208   40.399   8.3454   38.542   5.2973 1.856728 9.884712 
1 1 1   25   27   15 o   27.830   5.9690   20.201   7.0868   11.316   16.392   22.243   7.8592   24.653   10.103   31.006   6.3590 -6.353182 11.93796 
1 1 1   25   27   16 o   32.552   7.1709   28.885   11.045   20.779   17.531   34.221   14.223   28.650   10.832   36.454   9.3993 -7.804516 14.34180 
1 1 1   25   27   17 o   92.852   3.8501  196.122   14.201  157.756   21.612  225.276   18.839   83.610   6.2670  102.093   4.4741 -18.48325 7.700190 
1 1 1   25   27   18 o   50.773   4.4513   59.063   9.0446   54.880   14.253   61.883   11.703   48.624   7.1069   52.921   5.3617 -4.296436 8.902558 
1 1 1   25   27   19 o   55.758   4.2702   71.230   9.5377   65.301   14.926   75.321   12.399   53.096   6.8158   58.419   5.1461 -5.322605 8.540335 
1 1 1   25   27   20 f   89.253   3.5681  176.889   12.976  146.350   18.245  208.153   18.460   80.896   5.4682   97.611   4.5853 -16.71530 7.136244 
1 1 1   25   27   21 o   46.133   5.4096   54.209   9.4095   40.640   14.731   63.561   12.230   39.139   9.2684   53.127   5.5814 -13.98762 10.81920 
1 1 1   25   27   22 o   77.528   3.4065  133.830   10.773  118.602   15.734  147.268   14.780   72.879   5.2344   82.177   4.3608 -9.298416 6.812943 
1 1 1   25   28    0 o   20.585   7.9840   14.324   13.775   14.324   13.775   14.324   13.775   20.585   11.291   20.585   11.291 0.000000 0.000000 
1 1 1   25   28    1 o   59.375   4.7208   80.124   10.892   74.495   18.315   83.204   13.548   56.877   7.8075   61.872   5.3091 -4.995247 9.441568 
1 1 1   25   28    2 o   52.521   3.8080   61.858   7.9045   51.805   12.423   68.697   10.246   48.358   6.2285   56.684   4.3827 -8.326496 7.615923 
1 1 1   25   28    3 o   26.611   5.5814   16.374   6.2952   17.909   11.003   15.626   7.6756   27.344   8.6829   25.877   7.0155 1.467653 11.16289 
1 1 1   25   28    4 o   28.341   5.3568   20.091   6.3602   13.966   11.334   22.907   7.6843   24.893   8.8194   31.788   6.0826 -6.894753 10.71358 
1 1 1   25   28    5 o   52.023   3.6668   57.655   7.4689   61.987   12.920   55.481   9.1534   53.091   5.9003   50.955   4.3554 2.136234 7.333684 
1 1 1   25   28    6 o   53.492   3.5751   59.296   7.5197   70.662   13.156   53.781   9.1642   56.849   5.6110   50.135   4.4319 6.714634 7.150178 
1 1 1   25   28    7 o   64.279   3.2977   88.087   8.3227   91.078   14.192   86.520   10.275   64.716   5.3171   63.842   3.9021 0.8742943 6.595331 
1 1 1   25   28    8 o   44.803   4.1734   42.072   7.1911   50.384   13.160   38.534   8.5863   47.371   6.7359   42.235   4.9291 5.135571 8.346784 
1 1 1   25   28    9 o   86.341   2.8515  158.446   9.5673  159.635   16.566  157.851   11.719   86.124   4.6635   86.559   3.2827 -0.4350967 5.703040 
1 1 1   25   28   10 o   48.464   3.9907   50.490   7.3999   54.796   13.387   48.595   8.8799   49.385   6.5722   47.543   4.5285 1.841286 7.981318 
1 1 1   25   28   11 o   51.854   3.9442   59.698   7.7385   57.636   13.840   60.635   9.3339   50.514   6.6429   53.195   4.2543 -2.680599 7.888391 
1 1 1   25   28   12 o   50.729   4.0233   58.561   7.8213   51.838   13.310   62.106   9.6661   47.726   6.7619   53.733   4.3616 -6.006256 8.046567 
1 1 1   25   28   13 o   24.844   5.1983   15.843   6.6864   0.5978   12.040   22.642   8.0404   18.506   8.1428   31.182   6.4641 -12.67597 10.39662 
1 1 1   25   28   14 o   18.380   5.4451   3.4912   6.2457   6.3473   12.097   2.4531   7.2930   20.806   8.6184   15.955   6.6572 4.851050 10.89017 
1 1 1   25   28   15 o   62.232   3.6780   90.618   8.4252   70.635   14.730  100.335   10.271   55.805   6.3996   68.660   3.6271 -12.85479 7.356012 
1 1 1   25   28   16 o   31.034   7.2307   24.534   10.316   32.494   17.653   20.406   12.712   33.918   11.021   28.150   9.3628 5.767981 14.46134 
1 1 1   25   28   17 o   23.833   6.6202   10.566   8.6462   19.927   16.613   7.0879   10.126   27.656   10.524   20.010   8.0351 7.645641 13.24043 
1 1 1   25   28   19 o   29.170   6.5010   22.587   8.6306   23.612   13.659   21.906   11.135   29.386   9.7019   28.954   8.6559 0.4321918 13.00199 
1 1 1   25   28   20 o   27.836   6.2994   20.700   8.2562   17.637   12.908   22.821   10.741   26.016   9.3903   29.657   8.3996 -3.641619 12.59882 
1 1 1   25   29    0 o   8.9317   4.5842 -25.6333   13.181 -25.6333   13.181 -25.6333   13.181   8.9317   6.4831   8.9317   6.4831 0.000000 0.000000 
1 1 1   25   29    1 o   27.865   7.3996   13.812   9.6025   9.6769   10.715   30.674   21.639   22.128   8.4442   33.602   12.154 -11.47395 14.79928 
1 1 1   25   29    2 o   24.083   6.5387   12.227   9.3273   16.981   10.401  -7.2950   21.079   26.602   8.4414   21.564   9.9880 5.038280 13.07733 
1 1 1   25   29    3 o   54.982   3.6536   66.931   7.7852   61.946   13.194   69.594   9.6429   52.849   6.0529   57.115   4.0935 -4.265545 7.307167 
1 1 1   25   29    4 o   44.475   4.3862   45.580   7.1388   41.197   12.548   47.677   8.6804   41.838   7.5498   47.111   4.4674 -5.273396 8.772480 
1 1 1   25   29    5 o   87.106   2.7831  162.146   9.5711  159.681   15.941  163.535   11.968   86.172   4.4854   88.040   3.2960 -1.868050 5.566149 
1 1 1   25   29    6 o   64.881   3.2615   91.369   8.2680   88.941   14.011   92.666   10.241   63.736   5.3297   66.027   3.7608 -2.291332 6.522995 
1 1 1   25   29    7 o   67.406   3.4061  102.771   8.9719   80.670   14.107  117.781   11.626   60.420   5.6611   74.391   3.7892 -13.97018 6.812168 
1 1 1   25   29    8 o   23.304   5.2900   13.164   6.5612   0.5804   11.739   18.881   7.9125   18.344   8.0568   28.264   6.8574 -9.920147 10.58000 
1 1 1   25   29    9 o   22.064   5.6497   10.606   6.3032   10.091   11.543   10.825   7.5240   22.398   8.7069   21.731   7.2018 0.6670094 11.29943 
1 1 1   25   29   10 o   18.044   5.3722   1.2348   6.3036   9.5912   11.774  -2.1232   7.4634   22.195   8.7449   13.893   6.2426 8.302427 10.74449 
1 1 1   25   29   11 o   50.462   4.5322   62.844   7.9992   45.201   13.841   71.692   9.8019   43.127   8.0782   57.797   4.1119 -14.67043 9.064427 
1 1 1   25   29   12 f   27.734   5.4601   20.445   6.8006   10.380   12.311   24.865   8.1581   22.707   8.9437   32.761   6.2659 -10.05465 10.92020 
1 1 1   25   29   13 f   46.790   4.2626   50.402   7.5880   45.975   13.165   52.604   9.2855   44.374   7.1935   49.207   4.5752 -4.833179 8.525197 
1 1 1   25   29   14 o   49.963   3.9935   54.234   7.6660   60.630   13.835   51.400   9.2091   51.361   6.5310   48.565   4.5975 2.795429 7.986917 
1 1 1   25   29   15 o   39.434   5.1752   37.880   7.3979   35.680   13.611   38.802   8.8135   36.997   9.0046   41.870   5.1036 -4.873016 10.35030 
1 1 1   25   29   16 o   22.065   6.3775   8.9511   8.1665   11.431   16.828   8.1873   9.3401   23.981   10.067   20.149   7.8323 3.832010 12.75495 
1 1 1   25   29   17 o   21.721   6.0536   8.3956   7.9194   16.336   12.888   3.5784   10.038   25.339   9.3464   18.104   7.6959 7.235500 12.10715 
1 1 1   25   29   18 o   16.495   5.3218  -4.6733   7.6620   3.9252   12.968  -9.2847   9.4969   19.765   8.5777   13.225   6.3016 6.539385 10.64364 
1 1 1   25   30    0 o   24.900   8.6008   21.932   14.755   21.932   14.755   21.932   14.755   24.900   12.163   24.900   12.163 0.000000 0.000000 
1 1 1   25   30    1 o   26.675   7.2376   15.004   9.3163   13.536   10.310   21.534   21.749   24.042   8.4212   29.309   11.773 -5.266359 14.47518 
1 1 1   25   30    2 o   36.941   7.2534   34.138   9.8757   32.514   11.008   40.842   22.359   36.846   7.4984   37.035   12.419 -0.1897392 14.50689 
1 1 1   25   30    3 o   28.630   5.3395   18.994   7.6027   34.751   10.828   3.6729   10.677   38.386   7.1009   18.875   7.9761 19.51047 10.67897 
1 1 1   25   30    4 o   50.053   3.6881   51.752   7.3281   67.889   12.644   43.591   8.9923   55.383   5.5355   44.723   4.8751 10.66055 7.376184 
1 1 1   25   30    5 o   21.025   5.6242   8.9525   6.3592   8.7214   11.528   9.0535   7.6242   21.657   8.6148   20.393   7.2326 1.264423 11.24835 
1 1 1   25   30    6 o   23.108   5.6712   12.226   6.3157   12.008   11.441   12.321   7.5744   23.333   8.7665   22.882   7.1970 0.4517326 11.34232 
1 1 1   25   30    7 f   25.180   5.7069   11.959   6.6085   25.996   12.095   5.9847   7.8904   31.945   8.8664   18.414   7.1875 13.53025 11.41371 
1 1 1   25   30    8 o   29.283   4.9771   24.085   6.8748   3.8000   12.461   32.960   8.2426   19.856   8.5108   38.711   5.1626 -18.85529 9.954165 
1 1 1   25   30    9 o   25.619   4.5155   16.661   6.7209 -10.0843   12.019   28.829   8.1068   15.200   7.1981   36.039   5.4540 -20.83890 9.030978 
1 1 1   25   30   10 o   16.278   4.9947   0.4488   6.4448 -10.0547   11.763   4.9543   7.7040   14.976   7.1005   17.579   7.0264 -2.603136 9.989367 
1 1 1   25   30   11 o   19.647   5.4691   7.1037   6.7413  -0.7248   12.099   10.629   8.1183   17.834   7.9855   21.459   7.4751 -3.624893 10.93824 
1 1 1   25   30   12 f   16.540   5.1588  -1.0269   6.3727   5.5533   11.513  -3.9334   7.6518   19.842   8.3280   13.238   6.0910 6.603540 10.31769 
1 1 1   25   30   13 o   25.522   5.9354   16.507   7.0139   15.213   12.714   17.073   8.4094   24.800   9.2563   26.243   7.4321 -1.443100 11.87074 
1 1 1   25   30   14 o   31.745   5.1686   29.375   7.3009   8.8118   13.067   38.708   8.8032   21.768   8.9824   41.721   5.1159 -19.95260 10.33710 
1 1 1   25   30   15 o   66.796   4.7502  112.560   10.897   85.370   20.539  123.213   12.856   58.221   8.5532   75.372   4.1354 -17.15107 9.500493 
1 1 1   25   31    0 o   47.662   4.4701   51.491   11.817   51.491   11.817   51.491   11.817   47.662   6.3217   47.662   6.3217 0.000000 0.000000 
1 1 1   25   31    1 o   21.145   6.0711   6.6229   9.3347   14.548   10.368 -27.3046   21.451   24.477   8.4519   17.813   8.7176 6.664120 12.14215 
1 1 1   25   31    2 o   25.963   7.2940   13.253   9.4340   10.970   10.389   23.989   22.530   22.281   8.3570   29.646   11.957 -7.364325 14.58793 
1 1 1   25   31    3 o   47.734   4.9616   52.055   9.3997   49.085   11.689   57.487   15.812   46.534   6.0906   48.935   7.8343 -2.400787 9.923290 
1 1 1   25   31    4 o   30.641   5.6886   23.857   7.7982   13.413   11.144   33.879   10.916   23.810   8.7051   37.472   7.3256 -13.66218 11.37729 
1 1 1   25   31    5 o   58.602   3.5073   79.109   7.9352   62.548   12.800   89.446   10.113   52.613   5.8988   64.591   3.7960 -11.97797 7.014686 
1 1 1   25   31    6 o   46.564   4.2594   50.721   7.5217   44.528   12.941   53.880   9.2432   43.406   7.2288   49.723   4.5071 -6.316971 8.518806 
1 1 1   25   31    7 o   34.404   5.3893   28.492   7.1341   31.632   12.302   26.902   8.7570   35.088   8.5736   33.721   6.5324 1.367290 10.77866 
1 1 1   25   31    8 o   56.418   3.5128   68.680   7.8193   76.186   13.383   64.790   9.6350   58.215   5.5738   54.621   4.2769 3.593422 7.025537 
1 1 1   25   31    9 o   23.442   5.8700   12.121   6.6715   18.029   12.061   9.5169   8.0081   26.343   9.1150   20.541   7.3989 5.802004 11.73996 
1 1 1   25   31   10 o   45.395   4.2445   44.306   7.5820   56.876   13.356   38.328   9.2098   49.443   6.5496   41.347   5.4006 8.095943 8.489028 
1 1 1   25   31   11 o   30.183   5.6610   21.051   6.8396   31.264   12.194   16.363   8.2616   34.703   8.5702   25.664   7.3987 9.039116 11.32206 
1 1 1   25   31   12 o   79.451   3.1612  144.009   9.5937  119.107   16.086  157.757   11.952   72.905   5.3496   85.998   3.3697 -13.09291 6.322457 
1 1 1   25   32    0 o   7.5329   3.8803 -20.9133   9.9428 -20.9133   9.9428 -20.9133   9.9428   7.5329   5.4876   7.5329   5.4876 0.000000 0.000000 
1 1 1   25   32    1 o   26.990   7.1989   6.2654   9.4634  -2.4805   10.438   46.635   22.426   16.016   7.2716   37.963   12.427 -21.94691 14.39770 
1 1 1   25   32    2 o   45.763   7.0651   60.320   11.028   62.870   12.383   50.540   24.246   52.717   5.6953   38.809   12.932 13.90849 14.13012 
1 1 1   25   32    3 o   25.054   6.6109   15.388   8.8563   14.229   10.950   17.580   15.060   24.013   8.6514   26.096   9.9983 -2.083841 13.22172 
1 1 1   25   32    4 o   35.048   6.5065   33.439   9.4267   35.191   11.822   30.378   15.622   37.496   7.8938   32.601   10.345 4.894859 13.01291 
1 1 1   25   32    5 o   46.708   4.4517   50.149   8.5514   55.581   12.522   45.401   11.706   49.163   6.1755   44.254   6.4136 4.908714 8.903395 
1 1 1   25   32    6 o   47.752   4.3703   52.615   8.5685   48.467   12.284   56.546   11.958   45.627   6.5276   49.876   5.8130 -4.248959 8.740701 
1 1 1   26    0    0 o   53.473   6.5316   64.220   18.549   64.220   18.549   64.220   18.549   53.473   9.2371   53.473   9.2371 0.000000 0.000000 
1 1 1   26    0    1 o  115.531   3.0410  276.951   20.428  276.951   20.428  276.951   20.428  115.531   4.3006  115.531   4.3006 0.000000 0.000000 
1 1 1   26    0    2 o   17.824   6.7682   9.4395   9.6959   9.4395   9.6959   9.4395   9.6959   17.824   9.5716   17.824   9.5716 0.000000 0.000000 
1 1 1   26    0    3 o  167.959   2.2148  583.000   21.681  583.000   21.681  583.000   21.681  167.959   3.1322  167.959   3.1322 0.000000 0.000000 
1 1 1   26    0    4 o   52.785   3.3867   59.010   10.230   59.010   10.230   59.010   10.230   52.785   4.7895   52.785   4.7895 0.000000 0.000000 
1 1 1   26    0    5 o   16.295   6.3156   7.7083   8.6127   7.7083   8.6127   7.7083   8.6127   16.295   8.9316   16.295   8.9316 0.000000 0.000000 
1 1 1   26    0    6 o  495.602   3.6833  5083.34  106.449  5083.34  106.449  5083.34  106.449  495.602   5.2089  495.602   5.2089 0.000000 0.000000 
1 1 1   26    0    7 o  173.693   2.2163  623.517   22.437  623.517   22.437  623.517   22.437  173.693   3.1343  173.693   3.1343 0.000000 0.000000 
1 1 1   26    0    8 o  151.815   2.2004  476.486   19.466  476.486   19.466  476.486   19.466  151.815   3.1119  151.815   3.1119 0.000000 0.000000 
1 1 1   26    0    9 o   17.211   6.4144   8.9347   8.5707   8.9347   8.5707   8.9347   8.5707   17.211   9.0713   17.211   9.0713 0.000000 0.000000 
1 1 1   26    0   10 o  184.312   2.2452  702.180   24.122  702.180   24.122  702.180   24.122  184.312   3.1752  184.312   3.1752 0.000000 0.000000 
1 1 1   26    0   11 o   47.384   3.6611   48.108   9.8116   48.108   9.8116   48.108   9.8116   47.384   5.1775   47.384   5.1775 0.000000 0.000000 
1 1 1   26    0   12 o   16.582   6.3427   8.1355   8.5737   8.1355   8.5737   8.1355   8.5737   16.582   8.9700   16.582   8.9700 0.000000 0.000000 
1 1 1   26    0   13 o   88.938   2.9991  164.707   15.478  164.707   15.478  164.707   15.478   88.938   4.2414   88.938   4.2414 0.000000 0.000000 
1 1 1   26    0   14 o   54.259   5.3171   64.698   15.905   64.698   15.905   64.698   15.905   54.259   7.5195   54.259   7.5195 0.000000 0.000000 
1 1 1   26    0   15 o   66.320   3.2766   92.426   12.533   92.426   12.533   92.426   12.533   66.320   4.6338   66.320   4.6338 0.000000 0.000000 
1 1 1   26    0   16 o  117.948   2.7814  288.837   19.087  288.837   19.087  288.837   19.087  117.948   3.9335  117.948   3.9335 0.000000 0.000000 
1 1 1   26    0   17 o   15.987   6.1238   7.6186   8.0024   7.6186   8.0024   7.6186   8.0024   15.987   8.6604   15.987   8.6604 0.000000 0.000000 
1 1 1   26    0   18 o   27.291   6.1952   19.699   8.7006   19.699   8.7006   19.699   8.7006   27.291   8.7613   27.291   8.7613 0.000000 0.000000 
1 1 1   26    0   19 o   34.055   6.7785   29.426   11.657   29.426   11.657   29.426   11.657   34.055   9.5863   34.055   9.5863 0.000000 0.000000 
1 1 1   26    0   20 o   79.678   3.1056  132.847   14.333  132.847   14.333  132.847   14.333   79.678   4.3919   79.678   4.3919 0.000000 0.000000 
1 1 1   26    0   21 o   88.384   2.9767  163.131   15.267  163.131   15.267  163.131   15.267   88.384   4.2097   88.384   4.2097 0.000000 0.000000 
1 1 1   26    0   22 o   29.037   7.0948   23.215   10.828   23.215   10.828   23.215   10.828   29.037   10.034   29.037   10.034 0.000000 0.000000 
1 1 1   26    0   23 o  195.713   3.5085  799.411   39.994  799.411   39.994  799.411   39.994  195.713   4.9618  195.713   4.9618 0.000000 0.000000 
1 1 1   26    0   24 o   18.023   7.1712   9.5543   11.452   9.5543   11.452   9.5543   11.452   18.023   10.142   18.023   10.142 0.000000 0.000000 
1 1 1   26    0   25 o   48.515   4.5065   51.759   12.142   51.759   12.142   51.759   12.142   48.515   6.3731   48.515   6.3731 0.000000 0.000000 
1 1 1   26    0   26 o  111.910   2.7367  261.078   17.815  261.078   17.815  261.078   17.815  111.910   3.8703  111.910   3.8703 0.000000 0.000000 
1 1 1   26    0   27 o   9.2948   4.6342 -11.2712   9.9898 -11.2712   9.9898 -11.2712   9.9898   9.2948   6.5537   9.2948   6.5537 0.000000 0.000000 
1 1 1   26    0   28 f   14.578   6.6916   0.2543   13.581   0.2543   13.581   0.2543   13.581   14.578   9.4633   14.578   9.4633 0.000000 0.000000 
1 1 1   26    0   29 o   12.697   6.0069  -3.4756   12.318  -3.4756   12.318  -3.4756   12.318   12.697   8.4951   12.697   8.4951 0.000000 0.000000 
1 1 1   26    0   30 o   20.630   7.8599   13.848   13.118   13.848   13.118   13.848   13.118   20.630   11.116   20.630   11.116 0.000000 0.000000 
1 1 1   26    0   31 o   12.553   5.8683  -1.6019   11.179  -1.6019   11.179  -1.6019   11.179   12.553   8.2991   12.553   8.2991 0.000000 0.000000 
1 1 1   26    0   32 o   48.607   4.8797   53.248   13.029   53.248   13.029   53.248   13.029   48.607   6.9010   48.607   6.9010 0.000000 0.000000 
1 1 1   26    0   33 o   12.980   6.3590 -10.9889   16.606 -10.9889   16.606 -10.9889   16.606   12.980   8.9929   12.980   8.9929 0.000000 0.000000 
1 1 1   26    0   34 o   28.194   10.319   29.458   21.878   29.458   21.878   29.458   21.878   28.194   14.593   28.194   14.593 0.000000 0.000000 
1 1 1   26    0   35 o   24.787   10.122   22.778   23.662   22.778   23.662   22.778   23.662   24.787   14.314   24.787   14.314 0.000000 0.000000 
1 1 1   26    0   36 o   31.831   11.067   39.377   24.499   39.377   24.499   39.377   24.499   31.831   15.651   31.831   15.651 0.000000 0.000000 
1 1 1   26    1    0 o   32.974   7.3554   28.413   12.434   28.413   12.434   28.413   12.434   32.974   10.402   32.974   10.402 0.000000 0.000000 
1 1 1   26    1    1 o  191.052   3.0975  755.628   24.402  767.680   34.995  744.223   34.043  192.530   4.4070  189.575   4.3540 2.954636 6.195065 
1 1 1   26    1    2 o  113.199   2.6046  265.055   12.159  259.236   17.163  270.918   17.228  111.948   3.7171  114.449   3.6496 -2.500793 5.209261 
1 1 1   26    1    3 o   75.254   2.7960  116.264   8.6353  126.560   13.029  108.197   11.532   78.196   4.0396   72.312   3.8667 5.884186 5.591938 
1 1 1   26    1    4 o  135.550   2.2185  379.726   12.401  387.496   17.621  372.102   17.456  136.925   3.1203  134.174   3.1544 2.750641 4.436937 
1 1 1   26    1    5 o  128.027   2.2327  338.531   11.785  325.846   16.418  352.012   16.925  125.553   3.1705  130.500   3.1446 -4.946159 4.465486 
1 1 1   26    1    6 o  164.813   2.2036  561.328   14.977  551.732   20.978  571.305   21.391  163.378   3.1132  166.249   3.1196 -2.871918 4.407237 
1 1 1   26    1    7 o   57.941   3.0907   69.760   7.3436   78.851   10.437   60.846   10.335   61.707   4.1008   54.175   4.6253 7.531330 6.181396 
1 1 1   26    1    8 o   67.007   2.8057   92.885   7.7383   84.955   10.772  101.340   11.123   64.047   4.0780   69.967   3.8545 -5.919914 5.611376 
1 1 1   26    1    9 o   38.616   4.1194   31.035   6.5594   31.020   9.1744   31.050   9.3817   38.610   5.7611   38.621   5.8897 -0.1069260E-01 8.238868 
1 1 1   26    1   10 o  193.171   2.2550  771.053   17.958  794.782   25.891  749.057   24.928  196.030   3.2023  190.312   3.1759 5.717865 4.510087 
1 1 1   26    1   11 o  123.582   2.2256  315.780   11.343  309.428   15.891  322.377   16.195  122.315   3.1500  124.849   3.1450 -2.533722 4.451266 
1 1 1   26    1   12 o   67.294   2.8314   93.939   7.8495   96.660   10.949   91.062   11.259   68.307   3.8864   66.281   4.1186 2.026093 5.662735 
1 1 1   26    1   13 o  100.198   3.2547  208.708   13.047  207.563   21.167  209.411   16.569   99.890   5.1377  100.505   3.9970 -0.6152191 6.509328 
1 1 1   26    1   14 o   67.824   4.3086   96.417   11.995   85.217   16.884  107.831   17.045   63.787   6.4177   71.862   5.7508 -8.075016 8.617287 
1 1 1   26    1   15 o   84.844   2.7260  150.934   9.3990  160.343   12.521  138.786   14.227   87.957   3.4513   81.730   4.2204 6.227028 5.451948 
1 1 1   26    1   16 o   97.968   2.3919  198.968   9.6614  198.069   13.833  199.825   13.500   97.745   3.4312   98.192   3.3334 -0.4466934 4.783807 
1 1 1   26    1   17 o   25.950   5.0711   14.183   5.9219   21.306   8.5754   7.6889   8.1878   31.199   6.8517   20.700   7.4778 10.49911 10.14211 
1 1 1   26    1   18 o   84.683   2.4395  148.823   8.5176  143.418   11.956  154.394   12.138   83.116   3.4876   86.250   3.4120 -3.134041 4.879083 
1 1 1   26    1   19 o  135.140   2.5439  379.494   14.178  374.864   19.993  384.178   20.110  134.307   3.6093  135.972   3.5858 -1.664993 5.087713 
1 1 1   26    1   20 o   79.056   3.0271  130.271   9.8692  132.890   14.020  127.699   13.895   79.848   4.2572   78.263   4.3046 1.584419 6.054225 
1 1 1   26    1   21 o  161.633   2.5880  542.298   17.185  529.448   23.183  557.972   25.604  159.566   3.5227  163.700   3.7923 -4.134476 5.175951 
1 1 1   26    1   22 o   38.042   5.2426   31.503   8.0140   22.137   10.877   42.622   11.852   31.351   8.2867   44.732   6.4241 -13.38106 10.48513 
1 1 1   26    1   23 o   69.327   4.4662  102.371   12.769  100.334   17.997  104.436   18.120   68.617   6.3591   70.036   6.2729 -1.419113 8.932396 
1 1 1   26    1   24 o   70.421   3.8362  104.763   11.135  107.031   16.091  102.679   15.426   71.133   5.4845   69.710   5.3654 1.423439 7.672492 
1 1 1   26    1   25 o   58.491   4.1788   71.413   9.9558   65.180   12.907   80.569   15.644   55.469   5.6415   61.512   6.1664 -6.042576 8.357648 
1 1 1   26    1   26 o  115.884   2.7652  281.108   13.216  281.842   18.672  280.370   18.710  116.040   3.9014  115.728   3.9198 0.3116226 5.530433 
1 1 1   26    1   27 o   17.081   5.3956  -3.4118   7.7265  -1.9970   11.511  -4.5719   10.423   17.993   7.9376   16.168   7.3107 1.824530 10.79125 
1 1 1   26    1   28 o   36.154   6.3334   31.640   9.5756   22.006   14.849   38.499   12.529   30.979   10.110   41.329   7.6310 -10.35073 12.66680 
1 1 1   26    1   29 o   47.045   4.8876   48.521   9.3159   49.828   12.213   46.703   14.406   48.070   6.1603   46.020   7.5898 2.049549 9.775150 
1 1 1   26    1   30 o   55.465   4.1010   66.471   9.3022   77.247   13.318   56.206   12.999   60.033   5.3787   50.896   6.1922 9.137287 8.202067 
1 1 1   26    1   31 o   67.309   3.7316   98.051   10.228   80.886   14.474  115.171   14.455   61.132   5.7406   73.485   4.7692 -12.35366 7.463243 
1 1 1   26    1   32 o   26.188   6.2332   14.830   8.5603   6.0445   12.335   22.993   11.890   21.414   8.7687   30.963   8.8612 -9.548548 12.46639 
1 1 1   26    1   33 o   27.137   8.0134   12.874   14.880  -1.8897   28.466   18.425   17.455   25.885   11.850   28.388   10.791 -2.503235 16.02683 
1 1 1   26    1   34 o   40.279   8.0695   42.059   15.539   68.272   22.827   19.420   21.213   51.181   11.131   29.378   11.686 21.80227 16.13894 
1 1 1   26    1   35 o   34.577   8.2223   24.667   17.023   63.089   25.281  -7.2026   23.024   46.796   12.751   22.357   10.385 24.43893 16.44455 
1 1 1   26    1   36 o   55.919   8.6747   88.362   19.545  108.795   28.832   70.988   26.586   63.146   11.494   48.692   12.996 14.45359 17.34944 
1 1 1   26    2    0 o   93.006   2.7688  179.633   14.960  179.633   14.960  179.633   14.960   93.006   3.9156   93.006   3.9156 0.000000 0.000000 
1 1 1   26    2    1 o   29.929   5.7859   19.347   7.3629   17.673   10.450   20.998   10.376   28.751   8.3305   31.107   8.0318 -2.356064 11.57183 
1 1 1   26    2    2 o   44.732   4.1962   41.650   7.7297   43.741   10.844   39.490   11.021   45.886   5.7297   43.577   6.1321 2.309780 8.392378 
1 1 1   26    2    3 o   97.269   2.5693  196.764   10.220  186.389   15.249  205.225   13.770   94.906   3.8956   99.631   3.3510 -4.724495 5.138538 
1 1 1   26    2    4 o  274.770   2.7240  1559.07   30.497  1582.84   47.085  1541.90   40.028  276.500   4.1288  273.040   3.5544 3.459839 5.448007 
1 1 1   26    2    5 o  160.989   2.2018  535.707   14.619  533.497   20.711  537.902   20.638  160.656   3.1256  161.321   3.1018 -0.6646118 4.403524 
1 1 1   26    2    6 o  220.796   2.3242  1007.97   21.165  1004.58   29.870  1011.40   29.994  220.423   3.2856  221.170   3.2881 -0.7467194 4.648320 
1 1 1   26    2    7 o  128.167   2.2329  339.594   11.803  341.911   16.742  337.305   16.642  128.602   3.1565  127.732   3.1590 0.8693695 4.465724 
1 1 1   26    2    8 o   88.209   2.4876  160.984   9.0496  162.926   12.799  159.043   12.797   88.743   3.4969   87.675   3.5389 1.067268 4.975114 
1 1 1   26    2    9 o  137.354   2.2122  389.781   12.527  377.209   17.425  403.229   18.022  135.064   3.1281  139.644   3.1290 -4.580551 4.424414 
1 1 1   26    2   10 o   79.116   2.5899  129.563   8.4474  124.297   11.868  134.970   12.026   77.483   3.7138   80.749   3.6109 -3.266747 5.179874 
1 1 1   26    2   11 o   80.337   2.5586  133.621   8.4747  129.110   11.950  138.184   12.020   78.969   3.6691   81.705   3.5669 -2.736694 5.117153 
1 1 1   26    2   12 o   30.428   5.4042   20.137   6.7950   22.810   9.7400   17.602   9.4842   32.355   7.4524   28.501   7.8282 3.854015 10.80832 
1 1 1   26    2   13 o   58.888   4.2586   72.799   10.058   70.562   16.097   74.232   12.882   58.054   6.7227   59.722   5.2297 -1.667797 8.517257 
1 1 1   26    2   14 o  176.663   2.6045  646.737   18.970  638.071   26.396  655.995   27.281  175.448   3.6478  177.877   3.7186 -2.429260 5.209036 
1 1 1   26    2   15 o   67.923   2.9929   96.412   8.2830   99.773   11.010   92.030   12.573   69.339   3.8497   66.507   4.5837 2.831680 5.985900 
1 1 1   26    2   16 o  153.523   2.2092  488.118   13.987  498.402   19.926  478.130   19.638  155.119   3.1146  151.927   3.1339 3.191696 4.418364 
1 1 1   26    2   17 o   44.131   3.6528   40.874   6.6158   36.752   9.4448   44.845   9.2700   41.902   5.4650   46.360   4.8481 -4.457436 7.305521 
1 1 1   26    2   18 o   96.881   2.6479  197.141   10.361  183.950   16.081  206.503   13.547   93.995   4.1481   99.766   3.2924 -5.771530 5.295873 
1 1 1   26    2   19 o  133.462   2.6272  369.560   14.419  380.029   21.346  360.775   19.554  135.163   3.8290  131.761   3.5982 3.401978 5.254380 
1 1 1   26    2   20 o   45.794   4.3927   44.196   8.2188   52.606   11.920   36.574   11.347   50.013   5.7786   41.575   6.6175 8.437466 8.785451 
1 1 1   26    2   21 o  118.690   2.8992  292.782   13.983  287.587   18.206  300.256   21.837  117.520   3.7560  119.860   4.4173 -2.339485 5.798309 
1 1 1   26    2   22 o   37.517   5.9387   32.883   9.0056   38.570   11.505   23.883   14.472   42.519   6.5602   32.515   9.9014 10.00463 11.87742 
1 1 1   26    2   23 o   79.857   4.3109  139.180   13.406  148.152   16.784  123.367   22.281   83.947   4.8475   75.767   7.1301 8.179558 8.621864 
1 1 1   26    2   24 o   81.701   3.8768  146.845   12.254  122.641   20.248  160.833   15.393   75.768   6.4794   87.634   4.2587 -11.86688 7.753639 
1 1 1   26    2   25 o   22.882   6.1862   8.1522   8.1278   11.822   12.388   5.3784   10.770   25.019   9.1732   20.746   8.3023 4.273396 12.37239 
1 1 1   26    2   26 o   54.287   4.0960   63.324   9.0856   55.427   13.119   70.603   12.596   50.861   6.2536   57.712   5.2916 -6.850597 8.191955 
1 1 1   26    2   27 o   64.268   3.7795   87.794   10.004   85.391   14.402   90.034   13.907   63.359   5.5113   65.177   5.1734 -1.818035 7.558969 
1 1 1   26    2   28 o   30.351   6.5869   21.231   8.9951   20.654   13.733   21.664   11.904   30.076   9.7162   30.627   8.8964 -0.5513420 13.17381 
1 1 1   26    2   29 o   51.253   4.6483   56.499   9.7825   50.971   13.141   63.371   14.651   48.466   6.5739   54.041   6.5734 -5.574852 9.296510 
1 1 1   26    2   30 o   66.407   3.5781   94.126   9.7989   92.801   13.727   95.502   13.992   65.937   5.0477   66.878   5.0726 -0.9414215 7.156150 
1 1 1   26    2   31 o   61.625   3.7986   81.740   9.6492   81.437   13.869   82.024   13.433   61.467   5.4708   61.784   5.2715 -0.3167953 7.597297 
1 1 1   26    2   32 o   27.483   6.7580   17.613   9.2988   12.108   16.826   20.033   11.157   25.927   10.377   29.039   8.6608 -3.112492 13.51605 
1 1 1   26    2   33 o   32.131   7.9496   24.546   13.346   14.305   17.652   38.214   20.393   26.694   10.647   37.569   11.808 -10.87531 15.89917 
1 1 1   26    2   34 o   27.073   7.9348   12.073   14.681   20.986   21.668   4.5090   19.960   30.016   11.852   24.130   10.554 5.885803 15.86966 
1 1 1   26    2   35 o   47.485   8.6906   63.873   17.219   58.602   25.000   68.630   23.752   44.822   12.856   50.149   11.698 -5.327007 17.38118 
1 1 1   26    2   36 f   26.459   8.9130  -4.2020   21.464   11.051   47.568  -8.1016   24.052   30.645   14.454   22.274   10.434 8.370258 17.82603 
1 1 1   26    3    0 f   70.816   3.1104  104.834   12.734  104.834   12.734  104.834   12.734   70.816   4.3988   70.816   4.3988 0.000000 0.000000 
1 1 1   26    3    1 o  137.330   2.5142  389.793   14.236  401.580   20.434  378.676   19.844  139.346   3.5555  135.314   3.5557 4.032242 5.028366 
1 1 1   26    3    2 o  259.614   2.8359  1394.30   30.353  1370.72   42.194  1419.59   43.698  257.349   3.9753  261.879   4.0457 -4.530609 5.671881 
1 1 1   26    3    3 o   91.336   2.5924  172.460   9.7093  173.591   14.557  171.553   13.032   91.590   3.8534   91.081   3.4690 0.5096664 5.184858 
1 1 1   26    3    4 o  101.570   2.5058  213.389   10.428  213.271   15.672  213.483   13.968  101.527   3.7427  101.612   3.3329 -0.8502197E-01 5.011561 
1 1 1   26    3    5 o   26.239   5.5749   13.824   6.6940   20.073   10.027   8.7987   8.9913   30.412   7.9166   22.066   7.8513 8.346140 11.14970 
1 1 1   26    3    6 o  171.007   2.2185  604.504   15.647  599.682   22.050  609.396   22.207  170.320   3.1389  171.694   3.1359 -1.374283 4.436954 
1 1 1   26    3    7 o  156.549   2.2087  506.551   14.259  495.312   20.008  518.149   20.326  154.784   3.1342  158.315   3.1129 -3.530807 4.417383 
1 1 1   26    3    8 o  255.558   2.4533  1351.15   25.858  1345.39   36.434  1356.98   36.705  255.012   3.4640  256.105   3.4749 -1.093597 4.906589 
1 1 1   26    3    9 o  106.142   2.3180  232.890   10.140  245.979   14.521  220.434   14.166  109.056   3.2284  103.228   3.3272 5.827164 4.636055 
1 1 1   26    3   10 o  109.465   2.3091  247.793   10.423  252.923   14.894  242.870   14.592  110.574   3.2658  108.355   3.2652 2.219681 4.618146 
1 1 1   26    3   11 o   59.088   3.0185   72.317   7.3489   76.993   10.561   67.928   10.232   60.943   4.2017   57.233   4.3347 3.709534 6.036908 
1 1 1   26    3   12 o  116.465   2.8963  274.600   12.727  297.502   23.743  265.366   15.076  119.677   4.8101  113.253   3.2275 6.424217 5.792569 
1 1 1   26    3   13 o   47.796   5.2218   50.144   9.5154   43.610   15.498   54.098   12.055   44.670   8.7247   50.922   5.7399 -6.252373 10.44350 
1 1 1   26    3   14 o   72.959   2.9869  107.426   8.8448   93.461   11.342  129.097   14.129   67.095   4.0986   78.823   4.3461 -11.72785 5.973823 
1 1 1   26    3   15 o  123.647   2.4252  317.324   12.239  320.027   16.221  313.751   18.649  124.305   3.1639  122.988   3.6763 1.317307 4.850305 
1 1 1   26    3   16 o   65.807   3.0241   89.843   8.1598   88.062   10.916   92.098   12.285   65.096   4.0656   66.517   4.4778 -1.420738 6.048129 
1 1 1   26    3   17 o  225.648   2.5574  1057.18   23.540  1057.65   31.087  1056.53   36.042  225.820   3.3377  225.476   3.8756 0.3434753 5.114745 
1 1 1   26    3   18 o   95.630   2.8106  188.943   11.023  202.573   16.690  178.400   14.680   98.640   4.1025   92.621   3.8429 6.018356 5.621225 
1 1 1   26    3   19 o   77.666   3.3715  123.369   10.659  143.252   16.815  110.012   13.782   82.750   4.9268   72.582   4.6038 10.16766 6.743080 
1 1 1   26    3   20 o   40.884   4.8853   36.011   7.9959   30.626   11.134   41.745   11.490   37.297   7.4981   44.470   6.2644 -7.172867 9.770557 
1 1 1   26    3   21 o   57.013   3.8378   68.649   8.9947   73.817   12.597   63.275   12.847   59.267   5.1535   54.760   5.6882 4.506756 7.675561 
1 1 1   26    3   22 o   22.692   5.8259   7.2872   7.8428   16.943   11.001  -2.6928   11.184   27.780   8.6631   17.604   7.7919 10.17630 11.65172 
1 1 1   26    3   23 o   42.480   6.5308   45.046   10.324   50.946   12.156   29.770   19.559   48.969   6.0186   35.990   11.592 12.97958 13.06161 
1 1 1   26    3   24 o   29.925   6.6163   20.444   8.9727   14.799   16.008   23.030   10.835   27.931   10.394   31.919   8.1895 -3.988037 13.23264 
1 1 1   26    3   25 f   27.120   6.1684   16.021   7.8269   15.853   11.407   16.170   10.760   27.082   8.8622   27.159   8.5822 -0.7678223E-01 12.33670 
1 1 1   26    3   26 o   57.088   3.8619   69.361   9.0607   62.622   12.783   76.166   12.845   54.216   5.7164   59.960   5.1942 -5.744106 7.723820 
1 1 1   26    3   27 o   62.410   4.2248   82.706   10.727   86.967   16.759   79.749   13.962   63.601   6.3888   61.219   5.5297 2.382473 8.449552 
1 1 1   26    3   28 o   52.671   5.3980   55.857   10.361   72.915   21.133   50.459   11.888   56.856   9.0121   48.486   5.9445 8.369793 10.79605 
1 1 1   26    3   29 o   53.224   6.0088   68.273   11.989   46.145   18.383   84.649   15.814   43.793   10.343   62.654   6.1198 -18.86100 12.01762 
1 1 1   26    3   30 o   24.202   6.1987   11.681   8.0197   15.344   11.796   8.5324   10.936   26.313   9.0191   22.090   8.5060 4.223429 12.39745 
1 1 1   26    3   31 o   15.271   4.9763  -6.8282   7.3527 -10.8591   10.585  -3.0692   10.221   14.241   6.7473   16.300   7.3164 -2.059287 9.952631 
1 1 1   26    3   32 o   22.012   6.5184   3.8981   9.3299   0.2777   11.253   11.861   16.688   18.283   7.9625   25.741   10.323 -7.457590 13.03690 
1 1 1   26    3   33 o   67.872   5.1646  110.752   12.466  119.386   14.810   89.764   23.089   74.456   4.8225   61.288   9.1343 13.16867 10.32918 
1 1 1   26    3   34 o   64.484   5.9502   96.549   15.719   82.982   21.198  113.120   23.428   59.258   8.6731   69.710   8.1483 -10.45175 11.90036 
1 1 1   26    3   35 o   26.832   8.2498   10.281   17.034   5.2902   23.279   16.033   24.990   25.174   11.187   28.489   12.128 -3.315735 16.49952 
1 1 1   26    3   36 o   52.907   10.962   99.660   25.122  100.323   50.490   99.442   28.962   46.555   18.179   59.258   12.254 -12.70269 21.92342 
1 1 1   26    3   37 o   19.538   9.5080 -25.0037   24.496   0.0000   0.0000 -25.0037   24.496  ?   ?    19.538   9.5080      ?      ? 
1 1 1   26    4    0 o   30.229   6.6490   23.732   10.273   23.732   10.273   23.732   10.273   30.229   9.4032   30.229   9.4032 0.000000 0.000000 
1 1 1   26    4    1 f  143.975   2.5049  428.324   14.867  411.625   20.684  446.174   21.385  141.073   3.5549  146.877   3.5301 -5.804031 5.009895 
1 1 1   26    4    2 o   43.834   4.4520   40.734   7.6236   29.262   10.479   53.636   11.112   36.838   7.1546   50.831   5.3003 -13.99373 8.904036 
1 1 1   26    4    3 o   38.074   4.5713   30.471   6.9942   34.963   10.297   26.623   9.5297   40.995   6.0902   35.153   6.8188 5.841606 9.142535 
1 1 1   26    4    4 o   86.710   2.6221  154.673   9.3257  163.715   14.090  147.625   12.440   88.942   3.8410   84.478   3.5704 4.463486 5.244205 
1 1 1   26    4    5 o  153.150   2.3513  480.062   14.661  514.851   22.949  456.076   19.056  157.763   3.5269  148.536   3.1105 9.227310 4.702579 
1 1 1   26    4    6 o   71.560   2.7290  106.042   8.0514  103.452   11.440  108.584   11.333   70.689   3.9238   72.430   3.7938 -1.741135 5.457972 
1 1 1   26    4    7 o  176.946   2.2277  647.306   16.257  652.879   23.161  641.894   22.824  177.695   3.1602  176.197   3.1407 1.498383 4.455419 
1 1 1   26    4    8 o  112.283   2.2904  260.675   10.606  265.216   15.154  256.314   14.848  113.240   3.2445  111.325   3.2337 1.915558 4.580846 
1 1 1   26    4    9 o  235.799   2.3833  1150.28   23.177  1157.77   32.978  1142.97   32.581  236.555   3.3801  235.043   3.3608 1.512253 4.766565 
1 1 1   26    4   10 f  150.962   2.1955  471.299   13.670  474.310   19.353  468.300   19.311  151.444   3.0984  150.480   3.1114 0.9642944 4.391023 
1 1 1   26    4   11 o   47.630   3.5269   47.029   6.8607   56.509   10.002   38.604   9.4287   52.177   4.6476   43.083   5.3061 9.093788 7.053739 
1 1 1   26    4   12 o   89.095   3.2006  160.980   10.635  173.754   20.216  156.091   12.506   91.362   5.3648   86.828   3.4922 4.534729 6.401253 
1 1 1   26    4   13 o   27.477   6.7269   12.860   9.9026   23.189   14.339   3.4420   13.692   32.731   9.8312   22.223   9.1844 10.50776 13.45382 
1 1 1   26    4   14 o  115.015   2.5358  273.358   11.803  269.690   15.237  278.862   18.665  114.110   3.2375  115.920   3.9039 -1.810341 5.071648 
1 1 1   26    4   15 o   27.324   5.6427   16.191   6.9032   20.041   9.4534   11.793   10.104   30.213   7.5947   24.434   8.3476 5.778906 11.28546 
1 1 1   26    4   16 o  175.669   2.4206  642.301   17.411  661.396   23.466  618.912   25.970  178.650   3.1847  172.687   3.6463 5.963409 4.841218 
1 1 1   26    4   17 o   97.622   2.3794  197.530   9.5746  192.523   13.265  202.976   13.833   96.336   3.3386   98.908   3.3911 -2.571548 4.758727 
1 1 1   26    4   18 o  125.757   2.4927  330.018   12.736  319.200   19.612  337.906   16.747  123.883   3.8384  127.631   3.1814 -3.748024 4.985420 
1 1 1   26    4   19 o   85.330   2.8437  152.748   9.6901  146.813   15.647  156.441   12.342   83.867   4.5234   86.792   3.4477 -2.924812 5.687486 
1 1 1   26    4   20 o   34.850   5.6798   27.129   8.0335   22.692   11.418   31.480   11.305   31.898   8.5180   37.803   7.5157 -5.904831 11.35965 
1 1 1   26    4   21 o   44.023   4.8914   42.833   8.3175   57.711   11.901   28.626   11.630   52.307   5.5162   35.739   8.0794 16.56816 9.782866 
1 1 1   26    4   22 o   43.152   6.3340   43.822   10.186   47.277   12.197   35.862   18.515   47.133   6.2745   39.171   11.005 7.962566 12.66792 
1 1 1   26    4   23 o   26.669   6.3207   14.671   8.3458   10.174   11.588   19.516   12.030   23.773   8.8440   29.566   9.0327 -5.793182 12.64143 
1 1 1   26    4   24 o   53.827   4.7797   58.640   10.102   73.615   17.867   51.602   12.248   58.390   7.4191   49.264   6.0281 9.126076 9.559347 
1 1 1   26    4   25 o  163.259   3.8659  557.006   26.031   0.0000   0.0000  557.006   26.031  ?   ?   163.259   3.8659      ?      ? 
1 1 1   26    4   26 o   54.911   4.0904   64.943   9.1480   54.435   13.095   74.961   12.785   50.357   6.3048   59.464   5.2131 -9.107479 8.180840 
1 1 1   26    4   27 o  106.354   3.1802  234.864   13.693  255.534   21.898  221.594   17.546  109.973   4.8279  102.736   4.1409 7.237381 6.360416 
1 1 1   26    4   28 o   36.784   5.5330   31.155   8.2757   23.691   12.157   37.602   11.298   31.910   8.9006   41.658   6.5755 -9.747999 11.06606 
1 1 1   26    4   29 o   23.257   6.0764   8.1136   8.5248   18.157   11.947  -2.3044   12.168   28.248   9.0559   18.267   8.1044 9.981005 12.15283 
1 1 1   26    4   30 o   15.455   5.0264  -6.2777   7.3771  -7.9090   10.532  -4.7064   10.336   15.038   6.9977   15.871   7.2173 -0.8329153 10.05272 
1 1 1   26    4   31 o   54.624   4.2237   65.547   9.3534   78.440   13.197   52.531   13.259   60.380   5.2990   48.867   6.5786 11.51358 8.447381 
1 1 1   26    4   32 f   22.868   6.7190   3.7198   9.6480  -1.3248   11.402   16.437   18.104   17.769   7.8662   27.968   10.895 -10.19889 13.43808 
1 1 1   26    4   33 o   24.760   7.0524   11.433   10.551   13.750   12.243   4.7460   20.801   24.968   9.1248   24.553   10.755 0.4150810 14.10471 
1 1 1   26    4   34 o   24.811   7.5071   6.9330   14.009   14.063   18.795  -1.9812   21.016   26.793   10.881   22.828   10.346 3.964361 15.01420 
1 1 1   26    4   35 o   24.503   7.7231   1.6195   16.029  -9.3186   21.683   14.800   23.802   21.220   9.9292   27.785   11.832 -6.564934 15.44621 
1 1 1   26    4   36 o   36.016   9.1335   43.657   22.246 -38.7608   53.311   61.034   24.479   26.708   13.201   45.324   12.626 -18.61553 18.26693 
1 1 1   26    4   37 o   34.646   13.319   39.377   26.782   0.0000   0.0000   39.377   26.782  ?   ?    34.646   13.319      ?      ? 
1 1 1   26    5    0 o  159.782   2.5278  528.086   23.532  528.086   23.532  528.086   23.532  159.782   3.5749  159.782   3.5749 0.000000 0.000000 
1 1 1   26    5    1 o  128.910   2.5341  343.762   13.473  348.913   19.074  338.634   19.032  129.876   3.5609  127.944   3.6066 1.932350 5.068284 
1 1 1   26    5    2 f   25.493   5.6587   13.015   6.9276   7.1727   9.8398   18.757   9.7550   21.554   8.1237   29.432   7.8796 -7.877975 11.31730 
1 1 1   26    5    3 o  158.582   2.3728  519.213   15.396  526.547   23.364  513.584   20.469  159.544   3.5506  157.619   3.1486 1.924271 4.745588 
1 1 1   26    5    4 o  111.488   2.4382  255.713   11.140  268.816   16.892  245.627   14.820  113.988   3.5929  108.988   3.2970 4.999634 4.876379 
1 1 1   26    5    5 o  146.168   2.3544  442.409   14.085  437.235   21.212  446.490   18.837  145.376   3.5377  146.960   3.1077 -1.584381 4.708806 
1 1 1   26    5    6 o   28.694   5.3313   18.172   6.7441   9.7637   9.9984   25.191   9.1350   23.218   8.2775   34.170   6.7213 -10.95182 10.66266 
1 1 1   26    5    7 o  117.504   2.2581  285.512   10.943  280.468   15.407  290.647   15.545  116.455   3.2077  118.553   3.1791 -2.097382 4.516183 
1 1 1   26    5    8 o  134.675   2.2240  375.035   12.352  384.175   17.572  366.109   17.365  136.299   3.1259  133.051   3.1644 3.247818 4.447989 
1 1 1   26    5    9 o  160.178   2.3895  530.957   15.620  531.474   20.652  530.266   23.877  160.308   3.1235  160.048   3.6171 0.2599792 4.779078 
1 1 1   26    5   10 o  250.327   2.6179  1299.24   26.851  1282.29   40.209  1312.88   36.072  248.791   3.9186  251.863   3.4725 -3.072723 5.235781 
1 1 1   26    5   11 o  216.831   2.8188  973.557   23.872  977.083   40.995  971.748   29.364  216.954   4.5814  216.707   3.2853 0.2473755 5.637551 
1 1 1   26    5   12 o  256.405   3.0473  1375.81   30.500  1329.45   51.918  1400.25   37.689  252.800   4.9794  260.010   3.5144 -7.209732 6.094675 
1 1 1   26    5   13 o  164.130   2.6300  558.570   17.802  549.423   25.106  567.821   25.248  162.774   3.7396  165.487   3.6991 -2.712799 5.260006 
1 1 1   26    5   14 o   75.637   2.8734  118.575   8.8259  117.480   11.493  120.148   13.779   75.257   3.7026   76.017   4.3950 -0.7596512 5.746793 
1 1 1   26    5   15 o   49.776   3.4125   51.887   6.9670   57.196   9.7536   46.357   9.9553   52.421   4.5112   47.131   5.1213 5.290218 6.824905 
1 1 1   26    5   16 o   99.396   2.7402  202.248   10.857  194.005   13.575  216.881   18.086   96.712   3.4032  102.080   4.2958 -5.368187 5.480458 
1 1 1   26    5   17 o  101.047   2.6239  214.441   10.639  201.759   16.865  222.822   13.711   98.442   4.1538  103.652   3.2071 -5.209259 5.247836 
1 1 1   26    5   18 o   97.728   2.5794  200.597   10.108  189.087   16.062  208.143   13.006   95.285   4.0869  100.171   3.1480 -4.885780 5.158791 
1 1 1   26    5   19 o   34.072   5.2058   27.778   7.0764   15.886   11.659   34.716   8.9043   27.451   8.9585   40.692   5.3054 -13.24132 10.41161 
1 1 1   26    5   20 o  100.974   3.1155  209.997   12.575  224.717   20.786  201.499   15.794  103.587   4.8652   98.361   3.8931 5.226425 6.231060 
1 1 1   26    5   21 o   72.914   3.7867  112.412   10.935  110.965   18.116  113.241   13.716   72.314   6.0739   73.514   4.5238 -1.200233 7.573452 
1 1 1   26    5   22 o   81.722   3.9567  140.921   12.165  140.439   14.500  142.069   22.358   81.907   4.2921   81.538   6.6483 0.3698196 7.913372 
1 1 1   26    5   23 f   45.992   4.5823   45.642   8.5917   39.340   12.443   51.384   11.877   42.780   7.0522   49.204   5.8527 -6.423878 9.164505 
1 1 1   26    5   24 o   50.295   4.9934   53.118   9.9082   58.748   16.979   50.210   12.201   52.006   7.9159   48.583   6.0889 3.422550 9.986840 
1 1 1   26    5   25 o   79.576   3.1198  132.906   10.235  135.320   14.732  130.654   14.230   80.261   4.4505   78.890   4.3733 1.370918 6.239561 
1 1 1   26    5   26 o   19.796   5.7786   1.4698   8.4835 -15.9904   14.925   9.8042   10.311   16.791   7.9716   22.802   8.3679 -6.011076 11.55716 
1 1 1   26    5   27 o   44.767   4.8009   43.323   8.8363   44.219   13.075   42.569   11.989   45.118   7.0263   44.417   6.5441 0.7002335 9.601754 
1 1 1   26    5   28 o   35.530   5.6929   28.651   8.1225   32.924   12.237   25.285   10.860   37.903   8.0747   33.156   8.0273 4.746956 11.38583 
1 1 1   26    5   29 o   40.211   5.5254   37.883   8.8419   24.495   12.780   50.173   12.245   32.250   9.1724   48.171   6.1633 -15.92074 11.05074 
1 1 1   26    5   30 o   54.910   4.5700   62.966   10.099   48.733   12.872   85.758   16.289   47.125   6.6227   62.695   6.2993 -15.56939 9.140055 
1 1 1   26    5   31 f   59.606   3.9669   77.327   9.6682   66.802   13.766   87.570   13.582   55.363   6.0288   63.849   5.1574 -8.486584 7.933757 
1 1 1   26    5   32 o   31.151   7.2840   24.155   10.466   25.512   12.251   20.492   20.135   32.390   8.8976   29.912   11.535 2.477833 14.56800 
1 1 1   26    5   33 o   16.635   5.6219 -12.8853   10.100  -7.2314   11.695 -29.4698   20.030   15.992   7.4187   17.278   8.4490 -1.285318 11.24377 
1 1 1   26    5   34 o   32.358   7.7137   19.174   14.332  -4.0994   18.686   52.431   22.337   21.158   9.6531   43.558   12.034 -22.40043 15.42741 
1 1 1   26    5   35 o   28.864   9.0788   14.759   20.635  -7.8579   45.825   20.511   23.110   28.432   13.627   29.296   12.000 -0.8642311 18.15768 
1 1 1   26    5   36 o   26.348   9.0855 -16.1644   21.595   31.258   52.262 -25.9286   23.714   33.449   15.573   19.247   9.3637 14.20225 18.17091 
1 1 1   26    5   37 o   27.976   12.120   17.986   25.800   0.0000   0.0000   17.986   25.800  ?   ?    27.976   12.120      ?      ? 
1 1 1   26    6    0 o   78.149   2.9610  127.301   13.409  127.301   13.409  127.301   13.409   78.149   4.1875   78.149   4.1875 0.000000 0.000000 
1 1 1   26    6    1 f  151.328   2.5117  473.264   15.668  456.962   21.751  490.847   22.590  148.623   3.5484  154.034   3.5557 -5.410812 5.023335 
1 1 1   26    6    2 o  116.862   2.5875  282.543   12.462  297.471   17.767  268.087   17.485  119.907   3.5927  113.817   3.7246 6.089874 5.174945 
1 1 1   26    6    3 o  134.878   2.3829  373.998   13.135  392.405   20.177  360.459   17.304  137.720   3.5521  132.037   3.1774 5.682312 4.765886 
1 1 1   26    6    4 o  152.036   2.5369  478.439   15.898  482.756   22.147  473.850   22.834  152.754   3.5153  151.318   3.6588 1.435913 5.073823 
1 1 1   26    6    5 o  257.058   2.8396  1368.40   30.101  1357.24   42.102  1380.06   43.052  255.994   3.9875  258.121   4.0439 -2.127411 5.679244 
1 1 1   26    6    6 o  167.510   2.3735  579.472   16.244  587.606   24.805  573.365   21.494  168.503   3.5692  166.516   3.1296 1.986313 4.746933 
1 1 1   26    6    7 o  128.610   2.3741  341.661   12.494  346.483   18.951  337.953   16.618  129.387   3.5511  127.833   3.1518 1.553886 4.748101 
1 1 1   26    6    8 o  141.744   2.2172  415.202   12.955  397.574   18.068  433.856   18.586  138.646   3.1597  144.841   3.1112 -6.194702 4.434332 
1 1 1   26    6    9 o  105.952   2.3281  232.182   10.171  224.962   14.267  239.646   14.505  104.274   3.3172  107.629   3.2675 -3.354568 4.656246 
1 1 1   26    6   10 o   48.110   3.5483   48.243   7.0199   45.186   10.089   51.112   9.7735   46.610   5.2482   49.609   4.7767 -2.998482 7.096510 
1 1 1   26    6   11 o   86.387   2.7061  155.452   9.5224  149.297   14.500  160.120   12.627   84.839   4.1438   87.935   3.4815 -3.096336 5.412240 
1 1 1   26    6   12 o   60.084   4.0207   77.952   8.9365   69.332   16.359   81.619   10.669   57.461   6.9028   62.707   4.1252 -5.246132 8.041488 
1 1 1   26    6   13 o  129.608   2.6381  348.433   14.098  348.603   20.198  348.271   19.687  129.629   3.7778  129.586   3.6834 0.4263306E-01 5.276289 
1 1 1   26    6   14 o   89.917   2.7541  171.529   9.9454  188.660   13.100  148.225   15.280   95.413   3.3290   84.420   4.3884 10.99290 5.508150 
1 1 1   26    6   15 o  124.421   2.3906  320.746   12.191  323.275   18.325  318.738   16.329  124.824   3.5594  124.018   3.1924 0.8055115 4.781281 
1 1 1   26    6   16 o   65.006   3.2644   88.096   8.7467   89.010   12.626   87.252   12.128   65.319   4.6867   64.693   4.5453 0.6260681 6.528804 
1 1 1   26    6   17 o   23.768   6.2695   5.0174   9.7615 -12.5650   14.558   19.380   13.158   17.568   8.1924   29.967   9.4928 -12.39934 12.53906 
1 1 1   26    6   18 o  111.583   2.7871  258.974   12.821  248.886   17.905  269.590   18.368  109.346   3.9701  113.819   3.9128 -4.472221 5.574166 
1 1 1   26    6   19 o   91.547   2.6478  169.959   9.7157  192.363   16.110  157.152   12.180   96.102   4.0644   86.993   3.3947 9.109329 5.295582 
1 1 1   26    6   20 o   45.170   4.5607   43.346   8.4942   44.067   11.945   42.607   12.081   45.569   6.3556   44.770   6.5427 0.7990494 9.121400 
1 1 1   26    6   21 o   99.296   2.8124  205.802   11.514  200.968   16.044  210.937   16.535   98.098   3.9654  100.494   3.9893 -2.395958 5.624840 
1 1 1   26    6   22 o   42.443   6.3193   39.678   10.124   38.684   12.112   41.984   18.445   42.476   6.9135   42.410   10.580 0.6556702E-01 12.63853 
1 1 1   26    6   23 o  199.759   2.7472  832.845   22.623  812.054   31.393  855.308   32.630  197.184   3.8601  202.334   3.9101 -5.150085 5.494432 
1 1 1   26    6   24 o   54.919   4.6851   62.948   10.205   70.406   17.321   58.983   12.629   57.116   7.3529   52.721   5.8081 4.395523 9.370134 
1 1 1   26    6   25 o  117.708   2.6805  289.162   12.991  266.236   17.955  314.349   18.819  112.793   3.8595  122.624   3.7210 -9.831642 5.361072 
1 1 1   26    6   26 o  141.192   3.8762  417.505   22.573   0.0000   0.0000  417.505   22.573  ?   ?   141.192   3.8762      ?      ? 
1 1 1   26    6   27 o  100.730   2.8870  213.482   11.974  205.516   17.214  220.949   16.667   98.842   4.2227  102.618   3.9380 -3.775421 5.773963 
1 1 1   26    6   28 o   65.054   3.6458   90.542   9.6883   76.448   13.684  104.705   13.718   59.791   5.5491   70.317   4.7302 -10.52628 7.291587 
1 1 1   26    6   29 o   65.586   3.6628   91.774   9.8853   93.648   14.537   90.162   13.482   66.141   5.3290   65.030   5.0266 1.111122 7.325637 
1 1 1   26    6   30 o   45.885   5.1979   47.614   9.4808   48.948   12.600   45.873   14.395   47.269   6.4626   44.500   8.1430 2.769730 10.39587 
1 1 1   26    6   31 o   37.994   5.5196   33.260   8.5131   40.737   12.228   26.226   11.859   42.839   6.9206   33.148   8.6005 9.690369 11.03916 
1 1 1   26    6   32 o  108.458   4.1520  257.839   17.505  257.676   21.503  258.160   30.139  109.518   4.7605  107.399   6.8040 2.119019 8.304078 
1 1 1   26    6   33 o   25.279   7.1567   12.180   10.360   13.090   11.851   9.2321   21.335   24.505   8.9742   26.052   11.151 -1.546883 14.31338 
1 1 1   26    6   34 o   25.068   7.3587   7.1959   13.794   21.497   18.261 -11.8094   21.051   29.524   11.079   20.611   9.6885 8.913059 14.71743 
1 1 1   26    6   35 o   29.593   8.6935   19.328   18.618   1.0834   28.246   33.343   24.756   25.513   11.725   33.674   12.839 -8.160816 17.38696 
1 1 1   26    6   36 o   34.990   10.763   18.521   22.197  106.519   53.943   0.5843   24.354   46.007   18.521   23.972   10.969 22.03452 21.52523 
1 1 1   26    6   37 o   27.957   11.963   19.043   24.542   0.0000   0.0000   19.043   24.542  ?   ?    27.957   11.963      ?      ? 
1 1 1   26    7    0 o  172.282   3.1628  614.947   31.735  614.947   31.735  614.947   31.735  172.282   4.4729  172.282   4.4729 0.000000 0.000000 
1 1 1   26    7    1 o   48.243   4.4733   47.847   8.7635   52.180   13.880   44.975   11.301   50.001   6.7303   46.485   5.8943 3.515408 8.946548 
1 1 1   26    7    2 o  140.819   2.5399  410.104   14.747  399.987   20.542  420.862   21.183  139.029   3.5825  142.608   3.6015 -3.579086 5.079850 
1 1 1   26    7    3 o  116.607   2.4432  282.190   11.668  273.390   17.414  289.359   15.718  114.928   3.6738  118.287   3.2217 -3.359085 4.886327 
1 1 1   26    7    4 o  189.888   2.4254  746.582   18.822  741.806   28.565  750.246   25.022  189.309   3.6585  190.468   3.1852 -1.159424 4.850779 
1 1 1   26    7    5 o  165.259   2.3624  566.005   15.990  556.037   23.963  574.007   21.468  163.912   3.5445  166.606   3.1241 -2.693665 4.724810 
1 1 1   26    7    6 o  169.554   2.3724  595.214   16.451  591.488   24.891  598.104   21.922  169.046   3.5700  170.062   3.1254 -1.015701 4.744762 
1 1 1   26    7    7 o   29.885   5.3074   19.718   6.7503   12.494   9.8053   26.226   9.3070   24.907   8.2199   34.862   6.7163 -9.955137 10.61486 
1 1 1   26    7    8 o   50.565   3.3855   53.172   7.0471   49.717   10.009   56.567   9.9239   48.921   4.9605   52.209   4.6086 -3.287514 6.770954 
1 1 1   26    7    9 o  100.000   2.3478  206.935   9.6818  207.171   13.574  206.690   13.814  100.061   3.2891   99.939   3.3512 0.1224289 4.695621 
1 1 1   26    7   10 f  123.670   2.9029  321.572   13.627  305.822   24.358  328.746   16.440  121.293   4.8690  126.047   3.1623 -4.753471 5.805809 
1 1 1   26    7   11 o   93.136   2.6798  182.516   10.059  165.746   15.574  194.520   13.177   89.350   4.2261   96.923   3.2962 -7.572571 5.359503 
1 1 1   26    7   12 f  115.608   2.9259  282.616   12.877  264.157   22.784  291.279   15.609  112.620   4.9052  118.597   3.1911 -5.977669 5.851811 
1 1 1   26    7   13 o   98.020   2.6430  198.390   10.505  194.277   13.595  204.485   16.548   96.816   3.4047   99.224   4.0435 -2.408478 5.286029 
1 1 1   26    7   14 o   99.757   2.5643  203.656   10.390  191.316   13.401  222.247   16.449   96.061   3.3825  103.453   3.8550 -7.392113 5.128596 
1 1 1   26    7   15 o   68.942   2.7594   98.560   7.8374   93.196   10.800  104.528   11.391   66.964   3.9102   70.920   3.8944 -3.956451 5.518727 
1 1 1   26    7   16 o  129.878   2.6432  350.843   14.142  330.878   19.988  370.854   20.011  126.147   3.8417  133.609   3.6314 -7.461639 5.286317 
1 1 1   26    7   17 o   69.537   3.2071  100.462   9.1358  104.851   13.864   97.093   12.146   70.833   4.7455   68.240   4.3154 2.592926 6.414232 
1 1 1   26    7   18 o   53.551   3.9300   65.975   7.8329   43.019   12.692   80.097   9.9548   45.057   6.8299   62.045   3.8901 -16.98851 7.860070 
1 1 1   26    7   19 o   38.645   4.5777   29.780   6.8854   44.788   11.543   21.491   8.5788   46.054   6.0770   31.236   6.8478 14.81810 9.155437 
1 1 1   26    7   20 o   30.609   5.8345   21.020   7.6394   16.490   10.817   25.528   10.791   27.474   8.5939   33.744   7.8938 -6.270006 11.66907 
1 1 1   26    7   21 o  164.837   2.8559  559.542   18.709  538.107   23.311  598.343   31.363  160.727   3.5164  168.947   4.5009 -8.220047 5.711719 
1 1 1   26    7   22 o   41.576   5.9936   40.959   9.5458   46.419   11.832   30.780   16.155   46.704   6.1426   36.449   10.294 10.25508 11.98714 
1 1 1   26    7   23 o   80.677   3.0757  136.408   10.232  139.608   14.476  133.213   14.465   81.638   4.2994   79.717   4.3996 1.920937 6.151468 
1 1 1   26    7   24 o   50.312   4.8252   50.464   9.6355   71.297   16.555   39.792   11.849   57.552   6.9743   43.072   6.6700 14.47948 9.650387 
1 1 1   26    7   25 o   67.668   3.4709   96.805   9.6832   99.362   13.649   94.214   13.740   68.596   4.8243   66.741   4.9914 1.855476 6.941723 
1 1 1   26    7   26 o   39.302   5.9131   39.468   9.5676   16.798   15.355   53.855   12.232   28.413   10.244   50.191   5.9091 -21.77754 11.82614 
1 1 1   26    7   27 o   33.098   5.9509   25.360   8.1325   24.836   11.916   25.817   11.127   32.702   8.6872   33.495   8.1353 -0.7931786 11.90170 
1 1 1   26    7   28 o   42.619   5.0281   40.648   8.5113   33.344   12.089   47.827   11.985   38.168   7.9381   47.070   6.1736 -8.901505 10.05614 
1 1 1   26    7   29 o   70.539   3.5720  105.889   10.347  110.515   15.494  102.166   13.900   71.837   5.2293   69.242   4.8673 2.595001 7.143927 
1 1 1   26    7   30 o   44.611   5.4384   44.479   9.6275   33.884   12.820   58.182   14.579   37.931   8.4149   51.291   6.8917 -13.36008 10.87689 
1 1 1   26    7   31 o   89.398   4.3316  177.414   14.140  180.606   16.669  169.224   26.704   92.127   4.3869   86.670   7.4704 5.456612 8.663225 
1 1 1   26    7   32 o   29.895   7.3165   22.454   10.650   24.788   12.207   15.020   21.790   31.766   8.9399   28.025   11.585 3.741459 14.63299 
1 1 1   26    7   33 o   56.742   6.0062   80.718   11.788   87.772   14.100   64.345   21.482   63.486   5.3848   49.998   10.738 13.48887 12.01230 
1 1 1   26    7   34 o   68.295   5.9648  110.324   16.281  108.742   20.680  112.906   26.407   68.801   7.2876   67.788   9.4449 1.012314 11.92960 
1 1 1   26    7   35 o   43.436   9.5919   58.928   18.845   63.562   29.622   55.777   24.426   43.877   14.278   42.996   12.813 0.8806839 19.18371 
1 1 1   26    7   36 o   64.839   10.292  156.808   26.836  109.690   53.120  172.956   31.096   46.424   18.485   83.254   9.0561 -36.82980 20.58380 
1 1 1   26    7   37 o   30.422   12.632   27.867   26.072   0.0000   0.0000   27.867   26.072  ?   ?    30.422   12.632      ?      ? 
1 1 1   26    7   38 o   32.272   13.111   35.487   27.301   0.0000   0.0000   35.487   27.301  ?   ?    32.272   13.111      ?      ? 
1 1 1   26    8    0 o  162.904   2.5466  549.072   24.171  549.072   24.171  549.072   24.171  162.904   3.6014  162.904   3.6014 0.000000 0.000000 
1 1 1   26    8    1 o  105.903   2.6468  232.203   11.560  235.798   16.388  228.643   16.310  106.721   3.7231  105.085   3.7630 1.635979 5.293591 
1 1 1   26    8    2 o  119.363   2.5825  294.661   12.706  280.586   17.697  309.638   18.254  116.419   3.6855  122.307   3.6186 -5.887177 5.165019 
1 1 1   26    8    3 o   48.832   4.0747   49.830   8.0726   38.838   11.191   61.756   11.656   43.152   6.2878   54.513   5.1842 -11.36057 8.149398 
1 1 1   26    8    4 o   86.124   2.8603  153.739   10.157  157.584   14.317  149.843   14.411   87.215   3.9801   85.033   4.1089 2.181793 5.720549 
1 1 1   26    8    5 o  152.778   2.7205  488.414   16.164  468.206   27.668  498.885   19.917  150.240   4.4651  155.316   3.1091 -5.076889 5.440944 
1 1 1   26    8    6 o   73.166   2.9064  110.539   8.6909  113.922   13.301  108.018   11.481   74.117   4.3511   72.215   3.8545 1.902679 5.812870 
1 1 1   26    8    7 o  149.657   2.6480  466.196   15.625  455.732   26.125  472.023   19.496  148.247   4.2728  151.067   3.1290 -2.819611 5.296010 
1 1 1   26    8    8 o   62.813   3.1694   82.265   8.1364   78.774   12.213   85.051   10.910   61.579   4.8086   64.047   4.1302 -2.467819 6.338849 
1 1 1   26    8    9 o  107.056   2.6863  238.065   11.834  251.436   16.536  224.023   16.945  110.167   3.6392  103.945   3.9524 6.221458 5.372675 
1 1 1   26    8   10 o  129.197   2.4401  346.875   12.872  337.668   19.499  353.987   17.136  127.628   3.7042  130.765   3.1773 -3.137657 4.880206 
1 1 1   26    8   11 o   47.343   4.4557   41.330   7.8845   61.244   15.735   34.653   9.1108   53.941   7.0725   40.745   5.4214 13.19530 8.911377 
1 1 1   26    8   12 o   51.066   3.9014   57.040   7.7922   44.369   12.277   65.587   10.083   45.967   6.4757   56.164   4.3529 -10.19706 7.802754 
1 1 1   26    8   13 o  136.151   2.4098  380.706   13.295  365.893   17.116  403.236   21.109  132.902   3.1224  139.399   3.6715 -6.497330 4.819669 
1 1 1   26    8   14 o   37.196   4.7248   29.482   6.8857   27.084   8.8948   33.068   10.877   35.382   6.3274   39.010   7.0186 -3.627827 9.449662 
1 1 1   26    8   15 o  136.560   2.2166  386.634   12.484  385.520   17.538  387.777   17.774  136.365   3.1183  136.756   3.1512 -0.3908386 4.433255 
1 1 1   26    8   16 f   84.371   2.7780  147.124   9.4567  152.907   15.151  143.434   12.104   85.647   4.2892   83.095   3.5316 2.552406 5.556034 
1 1 1   26    8   17 o   23.223   5.5103   10.340   6.8637   0.9909   10.758   16.758   8.9136   18.849   7.9878   27.598   7.5928 -8.748909 11.02069 
1 1 1   26    8   18 f  189.137   2.4338  744.058   18.555  738.522   29.488  747.687   23.873  188.406   3.7948  189.868   3.0485 -1.461929 4.867637 
1 1 1   26    8   19 o   53.110   3.5411   58.533   7.5328   62.161   12.364   56.392   9.4994   54.300   5.5208   51.920   4.4360 2.379505 7.082195 
1 1 1   26    8   20 f   66.459   3.4806   92.888   9.4957  104.892   13.624   81.548   13.242   70.698   4.6723   62.219   5.1602 8.479744 6.961202 
1 1 1   26    8   21 o  155.973   3.7688  507.608   24.245  507.608   24.245   0.0000   0.0000  155.973   3.7688  ?   ?       ?      ? 
1 1 1   26    8   22 o   67.636   3.4334   95.956   9.5625  103.521   13.936   89.226   13.145   70.158   4.8162   65.113   4.8948 5.044914 6.866881 
1 1 1   26    8   23 f   94.180   2.9139  185.851   11.296  172.990   16.013  198.590   15.937   90.881   4.2721   97.478   3.9639 -6.597198 5.827816 
1 1 1   26    8   24 o   80.124   3.8541  145.074   11.825  105.154   18.884  170.827   15.167   69.961   6.5443   90.287   4.0730 -20.32571 7.708267 
1 1 1   26    8   25 o   94.180   3.4025  189.827   12.979  170.817   19.688  204.436   17.260   89.708   5.3212   98.652   4.2419 -8.944427 6.805081 
1 1 1   26    8   26 o   31.588   6.1262   23.342   8.4821   16.077   12.552   29.447   11.507   27.240   9.3039   35.936   7.9723 -8.695786 12.25231 
1 1 1   26    8   27 o   64.864   3.8706   92.807   9.9851   72.906   15.074  108.365   13.328   58.102   6.2903   71.625   4.5118 -13.52254 7.741104 
1 1 1   26    8   28 o   27.743   6.0438   17.206   8.2185   7.7186   11.998   25.594   11.281   22.300   8.8145   33.186   8.2712 -10.88603 12.08751 
1 1 1   26    8   29 o   20.628   5.5926   3.5651   7.9014 -11.0532   11.868   15.203   10.589   15.314   7.2219   25.943   8.5413 -10.62916 11.18518 
1 1 1   26    8   30 o   61.350   3.8093   81.172   9.6223   75.475   13.538   86.988   13.679   59.089   5.5549   63.610   5.2140 -4.521053 7.618584 
1 1 1   26    8   31 o   57.311   9.8619   80.239   13.543   77.843   14.032  112.817   51.742   59.769   5.6921   54.853   18.885 4.915977 19.72390 
1 1 1   26    8   32 o   37.653   7.5286   32.635   10.993   27.404   12.695   48.320   21.982   33.332   9.0163   41.974   12.059 -8.641697 15.05714 
1 1 1   26    8   33 o   32.064   6.6966   28.424   10.523   36.234   12.374   8.0153   20.002   39.021   7.9580   25.107   10.773 13.91467 13.39328 
1 1 1   26    8   34 o   45.878   9.5171   63.417   18.965   69.854   29.570   58.919   24.719   47.026   14.116   44.730   12.768 2.295830 19.03420 
1 1 1   26    8   35 o   37.200   9.3120   44.234   18.712   31.515   29.668   52.635   24.112   32.766   13.529   41.635   12.799 -8.868782 18.62400 
1 1 1   26    8   36 o   31.953   10.264   13.962   22.599   84.408   52.565  -2.0115   25.031   40.523   17.428   23.383   10.849 17.13941 20.52876 
1 1 1   26    8   37 o   64.004   10.758  158.413   27.588  142.431   55.898  163.559   31.721   49.350   19.167   78.659   9.7776 -29.30846 21.51675 
1 1 1   26    9    0 o   76.297   2.9995  121.470   13.254  121.470   13.254  121.470   13.254   76.297   4.2419   76.297   4.2419 0.000000 0.000000 
1 1 1   26    9    1 f   71.299   3.0997  105.536   9.1025   99.342   12.895  111.688   12.851   69.199   4.5181   73.399   4.2451 -4.199745 6.199480 
1 1 1   26    9    2 o  149.106   2.5418  460.233   15.632  459.165   22.115  461.298   22.098  148.932   3.6003  149.280   3.5891 -0.3474121 5.083648 
1 1 1   26    9    3 o   96.040   2.8048  189.345   10.731  197.795   17.806  184.526   13.447   97.653   4.4210   94.427   3.4529 3.226379 5.609622 
1 1 1   26    9    4 o  124.909   2.6058  323.154   13.416  325.922   18.691  320.212   19.269  125.471   3.6119  124.347   3.7570 1.123840 5.211624 
1 1 1   26    9    5 o   31.627   5.0532   22.067   7.4781   38.380   10.252   3.5205   10.932   42.921   5.7914   20.334   8.2824 22.58745 10.10636 
1 1 1   26    9    6 o   75.404   2.8423  118.306   8.7565  114.296   13.199  121.459   11.703   74.229   4.3111   76.578   3.7053 -2.349022 5.684611 
1 1 1   26    9    7 o  132.881   2.3712  365.440   12.884  365.972   19.547  365.031   17.133  132.934   3.5651  132.828   3.1273 0.1062775 4.742348 
1 1 1   26    9    8 o  187.676   2.5823  729.723   19.984  722.858   27.905  736.950   28.631  186.777   3.6224  188.574   3.6811 -1.797195 5.164564 
1 1 1   26    9    9 o  116.420   2.6334  281.018   12.638  268.493   17.764  293.854   17.983  113.783   3.7853  119.057   3.6621 -5.273865 5.266822 
1 1 1   26    9   10 o   88.971   3.0691  157.638   10.427  182.786   19.304  147.279   12.390   93.657   4.9975   84.285   3.5641 9.372299 6.138194 
1 1 1   26    9   11 o   76.719   2.9273  121.640   9.0494  125.307   14.525  119.314   11.569   77.602   4.5383   75.837   3.6987 1.764771 5.854571 
1 1 1   26    9   12 o   70.408   3.2938  103.336   9.5082   89.192   13.252  118.341   13.650   65.399   4.9131   75.416   4.3883 -10.01712 6.587542 
1 1 1   26    9   13 o   84.785   2.7121  147.457   9.2889  140.535   11.866  158.412   14.928   82.300   3.4957   87.270   4.1474 -4.969933 5.424119 
1 1 1   26    9   14 o  140.449   2.4130  408.686   13.749  405.628   17.870  413.123   21.525  139.884   3.0973  141.014   3.7010 -1.130234 4.826047 
1 1 1   26    9   15 o   85.486   2.4572  151.848   8.6589  156.453   12.183  147.149   12.309   86.809   3.4028   84.164   3.5458 2.644890 4.914484 
1 1 1   26    9   16 o   70.080   3.0528  102.455   8.5386  102.200   13.943  102.608   10.801   69.913   4.8354   70.248   3.7278 -0.3349609 6.105582 
1 1 1   26    9   17 o   64.323   3.3090   86.005   8.7427   91.173   13.097   81.850   11.742   66.034   4.8087   62.612   4.5470 3.421791 6.618021 
1 1 1   26    9   18 o   27.928   5.6910   17.459   6.9599   14.155   10.793   19.811   9.1059   25.999   8.6262   29.857   7.4255 -3.858219 11.38198 
1 1 1   26    9   19 o  147.677   2.4523  456.223   14.712  440.759   22.649  467.511   19.351  145.371   3.7775  149.982   3.1282 -4.611832 4.904553 
1 1 1   26    9   20 o   58.727   3.5516   75.691   8.2036   58.904   12.737   87.593   10.725   52.708   5.8588   64.746   4.0161 -12.03815 7.103173 
1 1 1   26    9   21 o  165.093   3.1223  566.218   20.443  552.893   25.484  590.272   34.240  162.744   3.7966  167.442   4.9579 -4.697357 6.244594 
1 1 1   26    9   22 o   35.934   5.4864   29.026   7.8966   26.462   11.281   31.490   11.057   34.235   8.1136   37.633   7.3873 -3.398033 10.97277 
1 1 1   26    9   23 o   99.052   2.8534  205.425   11.650  198.309   16.531  212.446   16.420   97.317   4.1187  100.788   3.9501 -3.470192 5.706744 
1 1 1   26    9   24 o   69.821   4.2120  106.100   11.459   97.902   19.246  110.602   14.263   67.254   6.9383   72.389   4.7773 -5.134193 8.423923 
1 1 1   26    9   25 o   69.909   5.8364  107.057   13.190  109.214   29.934  106.538   14.693   68.874   10.538   70.944   5.0216 -2.069893 11.67286 
1 1 1   26    9   26 o   84.378   3.1406  150.378   10.913  142.762   15.549  157.771   15.321   82.207   4.5860   86.548   4.2921 -4.341057 6.281207 
1 1 1   26    9   27 o   62.173   3.8657   82.774   9.8039   81.438   14.929   83.787   13.000   61.560   5.8798   62.786   5.0202 -1.225765 7.731404 
1 1 1   26    9   28 o   30.007   6.3927   20.867   8.5759   24.679   12.748   17.717   11.590   32.235   9.1584   27.778   8.9212 4.457388 12.78532 
1 1 1   26    9   29 o   31.074   5.7720   22.300   8.4755   7.4683   12.028   36.926   11.944   22.003   8.7849   40.145   7.4893 -18.14235 11.54404 
1 1 1   26    9   30 o   58.061   4.0093   73.566   9.5315   65.594   13.717   81.009   13.254   54.791   6.0699   61.330   5.2398 -6.539043 8.018645 
1 1 1   26    9   31 o   32.046   9.6054  -4.3441   10.756  -9.5898   11.050   90.486   46.981   14.846   6.9912   49.246   17.893 -34.40000 19.21073 
1 1 1   26    9   32 o   25.117   7.2659   9.7285   10.527   7.3836   12.099   17.033   21.354   21.662   8.7532   28.572   11.600 -6.910551 14.53176 
1 1 1   26    9   33 o   24.288   7.2059   8.8719   10.820   8.2310   12.408   10.906   22.107   22.062   8.8821   26.513   11.349 -4.450392 14.41175 
1 1 1   26    9   34 o   48.381   9.3682   72.442   19.499   63.349   30.257   78.902   25.501   43.686   14.440   53.076   11.938 -9.390457 18.73641 
1 1 1   26    9   35 o   31.427   8.9808   27.660   18.721   14.925   29.526   36.221   24.208   28.400   12.611   34.454   12.790 -6.053787 17.96164 
1 1 1   26    9   36 o   34.015   9.4910   41.227   23.577 -17.1781   51.868   56.438   26.470   27.139   13.338   40.891   13.506 -13.75142 18.98198 
1 1 1   26    9   37 o   32.134   9.2159   35.789   23.020 -30.1131   52.362   51.578   25.630   25.705   12.771   38.563   13.290 -12.85806 18.43189 
1 1 1   26   10    0 o   15.080   6.6732   2.7907   12.095   2.7907   12.095   2.7907   12.095   15.080   9.4373   15.080   9.4373 0.000000 0.000000 
1 1 1   26   10    1 o   81.816   3.1302  139.060   10.490  140.453   14.072  137.318   15.736   82.308   4.1452   81.324   4.6915 0.9844360 6.260400 
1 1 1   26   10    2 o  175.477   2.5519  637.587   18.469  639.308   26.183  635.882   26.057  175.712   3.6129  175.242   3.6051 0.4699554 5.103892 
1 1 1   26   10    3 o   93.030   2.5747  178.852   9.8108  182.401   14.834  176.092   13.080   93.828   3.8331   92.233   3.4385 1.595016 5.149388 
1 1 1   26   10    4 o   75.662   2.8176  119.472   8.6989  112.455   13.072  125.049   11.654   73.621   4.3049   77.702   3.6365 -4.080467 5.635265 
1 1 1   26   10    5 o   74.947   2.7883  115.054   8.5642  129.870   13.029  103.781   11.364   79.140   3.9915   70.754   3.8943 8.385170 5.576548 
1 1 1   26   10    6 o   46.583   3.7503   45.249   7.1577   44.864   10.732   45.558   9.6066   46.376   5.6105   46.790   4.9780 -0.4138222 7.500558 
1 1 1   26   10    7 o   56.707   3.3274   66.749   7.7575   68.539   11.500   65.254   10.508   57.387   4.8587   56.027   4.5475 1.360603 6.654876 
1 1 1   26   10    8 o  175.023   2.8126  637.326   19.884  628.319   31.356  643.384   25.715  173.868   4.3725  176.178   3.5390 -2.309555 5.625230 
1 1 1   26   10    9 o   54.952   3.4020   61.150   7.6031   75.586   11.960   51.361   9.8494   60.244   4.8135   49.661   4.8087 10.58311 6.803977 
1 1 1   26   10   10 f   58.256   3.2958   70.551   7.8171   71.382   12.091   69.954   10.247   58.507   5.0105   58.006   4.2831 0.5016518 6.591624 
1 1 1   26   10   11 o  167.950   2.4254  584.850   16.563  585.462   25.674  584.414   21.677  167.948   3.7064  167.953   3.1294 -0.5584717E-02 4.850774 
1 1 1   26   10   12 o  123.413   2.2461  315.680   11.432  322.413   16.232  309.054   16.103  124.723   3.1555  122.103   3.1974 2.619446 4.492299 
1 1 1   26   10   13 o  154.082   2.8120  499.956   16.597  510.949   20.174  476.937   29.193  156.990   3.1157  151.174   4.6821 5.816101 5.624051 
1 1 1   26   10   14 o  166.194   2.7979  561.541   17.540  542.928   20.780  607.669   32.713  161.801   3.1139  170.588   4.6495 -8.787186 5.595898 
1 1 1   26   10   15 f   73.213   2.9303  107.818   8.6049  128.133   14.327   96.355   10.762   78.368   4.4325   68.058   3.8341 10.31028 5.860693 
1 1 1   26   10   16 o  146.836   2.5709  448.323   15.552  444.000   22.472  452.298   21.546  146.126   3.7286  147.545   3.5406 -1.418839 5.141829 
1 1 1   26   10   17 o   60.722   3.5085   78.823   8.6000   66.972   12.896   88.316   11.541   56.407   5.5431   65.037   4.3025 -8.630310 7.016970 
1 1 1   26   10   18 o   94.451   2.8198  187.567   10.889  173.844   16.123  199.078   14.766   91.162   4.2881   97.741   3.6629 -6.579399 5.639549 
1 1 1   26   10   19 o   23.455   5.7023   11.240   6.5382   9.0302   11.255   12.365   8.0327   22.997   8.6832   23.912   7.3938 -0.9140625 11.40466 
1 1 1   26   10   20 o   57.974   3.6476   73.875   8.2701   59.259   13.170   83.391   10.627   52.798   6.0476   63.149   4.0801 -10.35083 7.295266 
1 1 1   26   10   21 o   75.999   3.7763  125.518   11.215  134.715   14.126  109.835   18.447   80.201   4.2704   71.798   6.2294 8.402924 7.552572 
1 1 1   26   10   22 o   53.832   3.9166   61.125   8.6791   66.176   12.714   56.716   11.877   55.914   5.5131   51.751   5.5645 4.163021 7.833108 
1 1 1   26   10   23 o   50.506   4.2035   54.496   8.7492   53.351   12.540   55.581   12.212   49.948   6.0874   51.065   5.7984 -1.117756 8.407052 
1 1 1   26   10   24 o   24.561   7.4556   2.9939   9.7322   13.212   26.092   1.3424   10.489   30.596   12.664   18.526   7.8711 12.07004 14.91113 
1 1 1   26   10   25 o   42.526   6.2307   45.732   10.001   29.232   17.664   53.516   12.133   35.060   10.985   49.991   5.8844 -14.93080 12.46150 
1 1 1   26   10   26 o   32.640   5.9929   24.543   8.0841   26.117   12.306   23.347   10.722   33.460   8.8000   31.821   8.1374 1.638889 11.98570 
1 1 1   26   10   27 f   42.649   5.6013   44.625   9.1274   27.579   14.256   56.467   11.882   34.002   9.6932   51.296   5.6163 -17.29365 11.20269 
1 1 1   26   10   28 o   63.223   3.7682   85.957   9.7964   84.203   14.323   87.498   13.429   62.507   5.5556   63.938   5.0923 -1.431854 7.536309 
1 1 1   26   10   29 o   46.075   4.8872   47.127   9.2473   45.784   13.580   48.288   12.627   45.292   7.2698   46.858   6.5336 -1.565559 9.774337 
1 1 1   26   10   30 o   24.515   6.2801   12.390   8.4141   17.696   11.942   7.1603   11.857   27.437   9.0723   21.594   8.6865 5.842941 12.56030 
1 1 1   26   10   31 o   51.450   8.4631   91.477   14.237   97.029   14.920   35.002   47.585   66.743   5.4201   36.157   16.035 30.58613 16.92616 
1 1 1   26   10   32 o   20.199   6.4400  -0.8575   10.437   2.1497   12.026 -10.0343   21.008   19.341   8.3270   21.056   9.8262 -1.714327 12.87999 
1 1 1   26   10   33 o   41.717   7.8718   43.765   13.368   34.023   16.442   62.763   22.961   35.770   10.474   47.663   11.754 -11.89266 15.74366 
1 1 1   26   10   34 o   29.070   7.9485   21.501   13.067   22.588   15.468   18.793   24.417   29.410   10.314   28.731   12.097 0.6788673 15.89705 
1 1 1   26   10   35 o   21.003   7.1266 -16.5230   17.648 -17.5026   27.060 -15.7980   23.280   21.627   10.394   20.380   9.7533 1.246984 14.25321 
1 1 1   26   10   36 o   34.353   9.4553   40.226   19.022   45.331   29.887   36.749   24.662   35.283   13.923   33.422   12.797 1.861069 18.91055 
1 1 1   26   10   37 o   27.783   9.1923   13.370   21.955   20.790   52.925   11.828   24.129   29.980   14.440   25.585   11.379 4.394621 18.38466 
1 1 1   26   11    0 o  152.536   2.5245  481.708   22.433  481.708   22.433  481.708   22.433  152.536   3.5702  152.536   3.5702 0.000000 0.000000 
1 1 1   26   11    1 o  134.829   2.5255  376.373   14.039  364.394   19.582  389.045   20.140  132.621   3.5799  137.037   3.5633 -4.415466 5.050984 
1 1 1   26   11    2 o  143.581   2.3658  425.960   13.886  433.723   21.172  420.100   18.396  144.690   3.5479  142.472   3.1305 2.217987 4.731545 
1 1 1   26   11    3 o   88.548   2.5992  163.078   9.4199  157.569   14.090  167.531   12.667   87.160   3.9195   89.936   3.4148 -2.775177 5.198414 
1 1 1   26   11    4 o  100.232   2.4976  209.527   10.220  197.522   15.335  219.118   13.707   97.594   3.8097  102.871   3.2307 -5.277664 4.995149 
1 1 1   26   11    5 o   63.663   3.4206   84.075   8.5780   85.364   14.504   83.382   10.638   63.950   5.4989   63.376   4.0697 0.5741043 6.841107 
1 1 1   26   11    6 f  162.574   2.4912  547.724   16.701  555.066   23.907  540.727   23.341  163.633   3.5423  161.515   3.5037 2.118332 4.982408 
1 1 1   26   11    7 o  180.695   2.5434  677.111   18.953  664.489   26.801  689.736   26.805  179.001   3.6302  182.389   3.5633 -3.387390 5.086828 
1 1 1   26   11    8 o  117.029   2.7177  280.022   12.417  297.411   21.625  271.467   15.167  119.584   4.3844  114.473   3.2125 5.111389 5.435310 
1 1 1   26   11    9 o   56.557   3.8765   70.403   8.3462   56.724   14.086   77.803   10.361   51.930   6.5766   61.185   4.1057 -9.255371 7.752962 
1 1 1   26   11   10 o  123.708   2.4735  319.706   12.420  304.029   19.089  331.215   16.355  120.988   3.8255  126.428   3.1365 -5.440918 4.946917 
1 1 1   26   11   11 o  133.603   2.4322  373.874   13.241  343.151   19.826  398.613   17.791  128.527   3.7401  138.680   3.1104 -10.15303 4.864469 
1 1 1   26   11   12 o  111.467   2.2832  257.757   10.495  252.454   14.855  263.041   14.829  110.315   3.2650  112.619   3.1925 -2.303886 4.566432 
1 1 1   26   11   13 o   50.400   3.7811   54.769   7.5952   61.040   9.9424   45.980   11.770   54.091   4.4566   46.710   6.1095 7.380642 7.562206 
1 1 1   26   11   14 o  146.640   2.4213  446.297   14.450  445.054   18.946  448.025   22.341  146.478   3.1361  146.802   3.6898 -0.3241119 4.842522 
1 1 1   26   11   15 o   42.966   4.5295   36.889   7.1937   68.351   11.807   18.312   9.0722   57.144   5.0094   28.789   7.5480 28.35511 9.059073 
1 1 1   26   11   16 o   27.078   4.7415   17.036   6.6909  -3.6773   11.204   28.520   8.3419   17.339   7.7297   36.817   5.4934 -19.47830 9.482963 
1 1 1   26   11   17 o   42.123   4.2666   37.182   7.2593   39.783   11.653   35.533   9.2803   43.212   6.5381   41.034   5.4834 2.177837 8.533158 
1 1 1   26   11   18 o   46.547   4.2397   45.949   8.0987   46.341   12.088   45.630   10.909   46.662   6.2809   46.431   5.6966 0.2309265 8.479399 
1 1 1   26   11   19 o   66.146   3.6065   91.944   9.8064   82.008   13.524  102.961   14.240   62.343   5.2596   69.949   4.9360 -7.606045 7.212979 
1 1 1   26   11   20 o   52.546   3.8838   57.844   8.3642   63.462   12.730   53.577   11.095   54.734   5.6391   50.359   5.3419 4.374374 7.767555 
1 1 1   26   11   21 o   51.419   4.2184   56.235   8.9285   55.264   12.969   57.111   12.310   50.943   6.1724   51.895   5.7515 -0.9521027 8.436718 
1 1 1   26   11   22 o   44.780   4.5213   42.992   8.3251   47.309   11.892   38.843   11.658   47.055   6.1276   42.506   6.6500 4.549244 9.042694 
1 1 1   26   11   23 o   70.234   3.4561  105.232   9.9101   92.673   14.431  116.443   13.633   66.083   5.2945   74.385   4.4438 -8.302719 6.912262 
1 1 1   26   11   24 f   60.673   4.6622   86.291   10.473   59.834   17.434  101.231   13.101   52.059   8.1197   69.288   4.5842 -17.22882 9.324404 
1 1 1   26   11   25 o   37.697   6.4000   35.853   9.6894   22.782   17.869   41.297   11.532   31.684   11.087   43.710   6.3966 -12.02599 12.80005 
1 1 1   26   11   26 o   18.450   5.5791   0.4901   7.7189  -4.4624   11.393   4.6917   10.494   16.932   7.6509   19.967   8.1221 -3.034666 11.15811 
1 1 1   26   11   27 o   34.267   6.1272   26.944   8.5468   32.498   13.575   23.297   11.001   36.999   8.9853   31.534   8.3328 5.464844 12.25441 
1 1 1   26   11   28 o   26.501   6.3533   15.862   8.4302   11.691   12.561   19.282   11.372   24.352   9.1784   28.650   8.7871 -4.298203 12.70659 
1 1 1   26   11   29 o   55.510   4.2925   67.554   9.7225   65.680   14.719   69.004   12.949   54.574   6.5395   56.446   5.5622 -1.872677 8.585042 
1 1 1   26   11   30 o   29.284   7.0230   21.636   10.917   28.330   13.091   6.3560   19.780   33.877   9.1528   24.690   10.654 9.187185 14.04599 
1 1 1   26   11   31 o   31.913   7.3373   29.859   12.586   37.230   13.098 -58.8900   45.449   39.413   8.3189   24.413   12.089 14.99984 14.67454 
1 1 1   26   11   32 o   32.770   6.3948   30.191   11.609   45.658   13.765  -7.9118   21.606   43.878   7.8967   21.661   10.061 22.21704 12.78960 
1 1 1   26   11   33 o   25.584   7.5530   10.479   12.384   5.8922   14.879   20.819   22.339   21.955   9.3523   29.213   11.863 -7.258404 15.10597 
1 1 1   26   11   34 o   26.216   7.6957   14.005   12.877   13.684   15.299   14.785   23.848   25.073   9.9399   27.358   11.751 -2.284271 15.39147 
1 1 1   26   11   35 o   24.589   7.8926   4.4087   17.680  -6.1203   27.306   12.009   23.199   23.259   10.964   25.918   11.356 -2.658283 15.78529 
1 1 1   26   11   36 o   34.568   9.4218   39.854   18.841   55.715   29.641   29.100   24.406   38.527   14.180   30.610   12.410 7.916771 18.84369 
1 1 1   26   12    0 o  172.298   2.5339  614.632   25.440  614.632   25.440  614.632   25.440  172.298   3.5834  172.298   3.5834 0.000000 0.000000 
1 1 1   26   12    1 o   76.552   2.9416  122.057   9.2465  135.389   13.089  108.776   13.064   80.766   3.9293   72.339   4.3787 8.427544 5.883221 
1 1 1   26   12    2 o   95.582   2.5258  189.540   9.8678  188.454   14.969  190.375   13.123   95.305   3.8081   95.859   3.3192 -0.5543060 5.051612 
1 1 1   26   12    3 o   41.142   4.1105   35.880   6.8578   32.212   10.360   38.740   9.1489   39.183   6.4109   43.101   5.1465 -3.918449 8.221092 
1 1 1   26   12    4 o   98.832   2.4821  202.930   10.045  198.710   15.052  206.319   13.488   97.870   3.7289   99.793   3.2769 -1.923752 4.964156 
1 1 1   26   12    5 o   37.651   4.5891   31.718   6.6817   21.623   9.8748   40.243   9.0746   31.368   7.6916   43.934   5.0079 -12.56608 9.178186 
1 1 1   26   12    6 o  153.465   2.3653  489.734   14.866  473.431   22.175  503.041   20.034  151.087   3.5586  155.843   3.1169 -4.755875 4.730592 
1 1 1   26   12    7 o  146.995   2.6456  451.115   15.247  439.992   25.783  457.095   18.906  145.441   4.2981  148.549   3.0858 -3.108322 5.291139 
1 1 1   26   12    8 o   81.313   3.0034  138.725   9.6259  133.452   16.029  141.700   12.038   79.984   4.8588   82.642   3.5319 -2.657127 6.006819 
1 1 1   26   12    9 o   24.798   5.5393   13.033   6.3775   10.784   9.6696   14.765   8.4845   23.530   8.1603   26.067   7.4929 -2.537319 11.07851 
1 1 1   26   12   10 o  119.091   2.8781  301.478   12.993  278.511   23.081  312.133   15.721  115.477   4.8461  122.706   3.1064 -7.228508 5.756226 
1 1 1   26   12   11 o   33.038   5.9789   20.650   7.7090   35.703   14.555   14.781   9.0885   39.946   9.0445   26.130   7.8220 13.81641 11.95776 
1 1 1   26   12   12 o  154.283   2.3210  494.208   14.689  495.870   19.785  492.168   21.925  154.625   3.1023  153.942   3.4532 0.6827850 4.642075 
1 1 1   26   12   13 o  111.547   2.5090  259.101   11.356  261.916   14.834  255.115   17.650  112.357   3.2011  110.737   3.8644 1.620781 5.018025 
1 1 1   26   12   14 f   69.305   3.2492  100.487   9.2584   97.994   13.542  102.675   12.687   68.458   4.7962   70.153   4.3846 -1.695496 6.498336 
1 1 1   26   12   15 o   72.002   2.9381  107.636   8.4434  110.337   13.878  106.048   10.639   72.612   4.6340   71.391   3.6132 1.221397 5.876116 
1 1 1   26   12   16 o   61.268   3.2119   77.555   7.8834   83.249   12.964   74.214   9.9304   62.926   4.9952   59.611   4.0390 3.315079 6.423831 
1 1 1   26   12   17 o   60.349   3.3410   74.658   8.0246   83.307   13.515   69.948   9.9728   62.868   5.2123   57.831   4.1811 5.037457 6.682032 
1 1 1   26   12   18 o  158.800   2.8451  523.138   18.480  498.225   24.381  556.782   28.332  154.491   3.8263  163.109   4.2115 -8.618073 5.690112 
1 1 1   26   12   19 o   49.506   4.2391   51.276   8.5817   58.786   13.227   45.817   11.278   52.560   6.1015   46.451   5.8864 6.108887 8.478108 
1 1 1   26   12   20 f   92.685   2.9032  177.200   11.014  201.242   16.884  159.387   14.533   98.059   4.1745   87.310   4.0356 10.74946 5.806310 
1 1 1   26   12   21 o  141.902   2.6386  421.069   15.421  411.665   22.249  429.764   21.394  140.320   3.8443  143.485   3.6151 -3.164810 5.277105 
1 1 1   26   12   22 o   53.867   3.9897   62.372   8.7744   55.742   12.857   68.152   12.005   51.015   6.1105   56.720   5.1315 -5.705269 7.979410 
1 1 1   26   12   23 o   98.513   3.2511  204.971   13.018  202.127   20.109  207.022   17.079   97.734   4.9886   99.292   4.1705 -1.557510 6.502220 
1 1 1   26   12   24 o   43.607   5.1992   42.114   8.9807   53.560   13.153   32.118   12.292   49.798   6.4038   37.415   8.1925 12.38248 10.39833 
1 1 1   26   12   25 o   30.900   7.4174   21.864   11.393   17.877   16.760   25.289   15.533   29.070   10.668   32.730   10.308 -3.660074 14.83483 
1 1 1   26   12   26 o   96.139   3.4673  190.990   13.344  174.297   16.675  220.725   22.254   90.731   4.4559  101.547   5.3135 -10.81581 6.934597 
1 1 1   26   12   27 o   33.484   6.1396   26.361   8.5782   31.167   12.652   22.272   11.670   36.309   8.5839   30.659   8.7804 5.650049 12.27919 
1 1 1   26   12   28 o   68.026   3.8016   97.161   10.493  114.800   16.786   85.849   13.443   72.841   5.5875   63.211   5.1563 9.630749 7.603102 
1 1 1   26   12   29 o   48.408   5.3951   55.916   9.9420   37.141   14.431   72.879   13.717   39.032   9.1271   57.784   5.7555 -18.75218 10.79022 
1 1 1   26   12   30 o   45.293   6.7173   50.118   11.361   49.907   13.532   50.624   20.916   47.055   6.9725   43.531   11.484 3.523937 13.43460 
1 1 1   26   12   31 f   86.801   4.3759  165.161   14.226  162.487   16.894  171.678   26.372   86.884   4.7145   86.718   7.3735 0.1666336 8.751900 
1 1 1   26   12   32 o   28.338   9.1168   5.2743   12.380   1.9181   12.856   48.099   45.923   19.573   8.5177   37.102   16.122 -17.52838 18.23356 
1 1 1   26   12   33 o   36.638   8.3585   36.629   13.540   32.513   16.202   46.161   24.655   34.649   10.460   38.626   13.040 -3.977600 16.71705 
1 1 1   26   12   34 o   61.880   6.8185   97.321   14.982   96.867   17.754   98.444   27.921   64.938   6.6288   58.821   11.917 6.117249 13.63692 
1 1 1   26   12   35 o   22.180   7.3990  -8.1137   18.005 -22.8232   27.981   2.2816   23.522   20.892   10.166   23.468   10.754 -2.575809 14.79808 
1 1 1   26   12   36 o   30.505   9.0574   28.179   19.043   39.194   29.625   20.423   24.858   33.088   13.574   27.921   11.996 5.167404 18.11483 
1 1 1   26   13    0 o   22.897   6.9842   15.677   9.5908   15.677   9.5908   15.677   9.5908   22.897   9.8772   22.897   9.8772 0.000000 0.000000 
1 1 1   26   13    1 o   29.933   5.3920   19.428   6.9198   12.078   9.5972   27.388   9.9867   24.418   8.1358   35.448   7.0785 -11.03002 10.78408 
1 1 1   26   13    2 o  113.145   2.3988  264.485   11.088  271.855   16.986  259.012   14.637  114.477   3.5976  111.813   3.1740 2.664032 4.797586 
1 1 1   26   13    3 o   76.066   2.7232  120.044   8.4799  120.963   12.819  119.330   11.308   76.294   4.0737   75.839   3.6151 0.4549561 5.446470 
1 1 1   26   13    4 o  132.055   2.3487  360.596   12.678  368.221   19.350  354.861   16.783  133.233   3.5214  130.878   3.1091 2.354904 4.697481 
1 1 1   26   13    5 o   87.002   2.5787  155.983   9.1851  166.061   14.023  148.411   12.155   89.421   3.8023   84.583   3.4843 4.838356 5.157309 
1 1 1   26   13    6 o   98.430   2.8379  206.401   10.896  185.146   18.176  218.323   13.613   94.234   4.6766  102.625   3.2162 -8.390762 5.675752 
1 1 1   26   13    7 o   89.911   2.8675  169.356   10.065  164.339   17.144  171.995   12.434   88.760   4.6830   91.063   3.3106 -2.303688 5.734977 
1 1 1   26   13    8 o   21.830   5.6574   8.0240   6.4963   10.408   10.628   6.6024   8.2081   23.705   8.5253   19.955   7.4394 3.750183 11.31482 
1 1 1   26   13    9 o   51.012   3.4932   55.694   7.1724   45.125   10.628   64.532   9.7193   46.369   5.5572   55.654   4.2342 -9.284996 6.986464 
1 1 1   26   13   10 o   26.494   5.5996   15.689   6.7128   10.054   11.160   18.885   8.4031   23.720   8.7052   29.269   7.0458 -5.548838 11.19923 
1 1 1   26   13   11 o   71.984   2.6204  107.645   7.7766  111.008   11.190  104.504   10.815   73.069   3.7131   70.899   3.6985 2.170418 5.240770 
1 1 1   26   13   12 o   82.668   2.4835  142.044   8.4558  151.327   12.002  132.895   11.915   85.369   3.4086   79.967   3.6126 5.401649 4.966901 
1 1 1   26   13   13 o   72.683   3.1916  110.541   9.5488  105.922   13.745  114.849   13.275   71.178   4.6821   74.188   4.3384 -3.010109 6.383118 
1 1 1   26   13   14 o   92.208   2.8725  177.645   10.902  173.359   15.811  181.531   15.053   91.107   4.2078   93.310   3.9114 -2.202682 5.744941 
1 1 1   26   13   15 o   27.699   6.2367   16.018   7.2953   17.481   14.605   15.531   8.4211   28.926   10.029   26.472   7.4165 2.454071 12.47341 
1 1 1   26   13   16 o   33.939   5.5607   29.541   7.3096   14.426   14.397   34.791   8.4846   27.227   9.9034   40.652   5.0604 -13.42446 11.12141 
1 1 1   26   13   17 o   35.571   5.1283   32.480   7.4385   10.877   11.964   46.095   9.4976   24.337   8.9995   46.805   4.9199 -22.46870 10.25650 
1 1 1   26   13   18 o   24.257   5.5813   11.248   7.3701  -0.5770   11.129   20.485   9.8359   18.336   7.9521   30.178   7.8338 -11.84128 11.16263 
1 1 1   26   13   19 o   36.979   5.1519   28.401   7.6184   42.759   12.196   19.212   9.7562   44.709   6.6138   29.249   7.9010 15.46015 10.30373 
1 1 1   26   13   20 o   77.272   3.1385  124.817   9.9127  129.521   15.180  121.320   13.089   78.455   4.6911   76.090   4.1708 2.365074 6.277071 
1 1 1   26   13   21 o  118.561   2.6466  293.984   12.938  297.247   18.555  290.896   18.049  119.186   3.7746  117.935   3.7107 1.251442 5.293109 
1 1 1   26   13   22 o   69.380   3.4128  101.646   9.7546  102.336   14.159  101.022   13.457   69.566   4.9349   69.193   4.7156 0.3733368 6.825688 
1 1 1   26   13   23 o   62.536   4.0696   82.921   10.149   86.707   16.764   80.731   12.752   63.378   6.4133   61.694   5.0115 1.684223 8.139156 
1 1 1   26   13   24 o   48.905   4.8024   53.978   9.0315   37.890   12.906   69.415   12.643   40.771   7.9608   57.039   5.3740 -16.26811 9.604885 
1 1 1   26   13   25 o   31.834   6.8323   23.078   9.1440   25.953   16.991   21.905   10.849   32.975   10.818   30.694   8.3486 2.281033 13.66451 
1 1 1   26   13   26 o   64.839   3.6975   90.731   9.8098   83.759   14.422   96.733   13.383   62.318   5.6110   67.360   4.8170 -5.042126 7.395040 
1 1 1   26   13   27 o   36.994   5.5613   33.880   8.5570   16.742   12.812   47.682   11.498   27.170   9.3946   46.819   5.9542 -19.64879 11.12256 
1 1 1   26   13   28 o   81.765   3.5444  145.957   11.717  128.366   17.684  159.721   15.643   76.910   5.5748   86.619   4.3786 -9.709167 7.088808 
1 1 1   26   13   29 o   38.272   6.1913   35.340   9.5538   40.513   14.175   31.033   12.933   40.940   8.6647   35.605   8.8460 5.334938 12.38263 
1 1 1   26   13   30 o   31.054   7.3511   15.580   10.762   4.9165   12.474   46.630   21.285   20.749   8.6862   41.358   11.862 -20.60904 14.70218 
1 1 1   26   13   31 o   26.815   6.3946   16.659   10.841   29.264   12.541 -20.5990   21.561   34.345   8.8104   19.285   9.2704 15.06020 12.78918 
1 1 1   26   13   32 o   28.724   9.3995   4.2616   13.725  -0.0193   14.266   57.510   50.314   19.613   8.7346   37.834   16.647 -18.22038 18.79908 
1 1 1   26   13   33 o   24.524   7.2297   11.158   12.166   15.742   14.347  -0.5742   22.953   25.799   9.7886   23.250   10.642 2.548960 14.45946 
1 1 1   26   13   34 o   33.146   10.417   30.804   15.872   30.804   15.872   0.0000   0.0000   33.146   10.417  ?   ?       ?      ? 
1 1 1   26   13   35 o   33.482   10.319   26.724   20.444   94.377   49.834   13.033   22.418   41.330   17.335   25.634   11.199 15.69624 20.63816 
1 1 1   26   14    0 o   75.883   2.9532  120.346   12.981  120.346   12.981  120.346   12.981   75.883   4.1765   75.883   4.1765 0.000000 0.000000 
1 1 1   26   14    1 o  130.934   2.3494  353.885   12.566  367.250   19.299  344.049   16.556  133.026   3.5175  128.843   3.1156 4.182800 4.698875 
1 1 1   26   14    2 o   27.942   5.2914   16.608   6.3049   22.479   9.5163   12.015   8.4173   31.956   7.3707   23.928   7.5940 8.028051 10.58278 
1 1 1   26   14    3 o  101.935   2.4426  215.309   10.166  217.884   15.556  213.388   13.432  102.423   3.6825  101.447   3.2101 0.9757309 4.885246 
1 1 1   26   14    4 o  129.902   2.3692  352.678   12.577  326.765   18.671  374.198   17.016  125.439   3.6089  134.364   3.0704 -8.925140 4.738333 
1 1 1   26   14    5 o  129.163   2.6744  348.190   13.528  342.133   22.971  351.406   16.739  128.137   4.3465  130.189   3.1174 -2.051895 5.348815 
1 1 1   26   14    6 o  102.285   2.7194  214.547   10.890  227.135   18.840  208.231   13.345  104.381   4.3762  100.189   3.2296 4.191940 5.438843 
1 1 1   26   14    7 o  106.665   2.7076  234.981   11.329  241.994   19.396  231.350   13.957  107.729   4.3654  105.602   3.2044 2.128029 5.415239 
1 1 1   26   14    8 o   36.596   4.3544   28.268   6.4017   32.453   9.7057   25.045   8.5170   39.253   5.9950   33.938   6.3170 5.314728 8.708879 
1 1 1   26   14    9 o   99.133   2.8612  209.095   10.970  191.223   18.719  218.445   13.539   95.656   4.7445  102.609   3.1992 -6.952469 5.722342 
1 1 1   26   14   10 o   35.022   5.4132   27.376   7.1858   24.537   13.099   28.598   8.5945   33.150   9.2363   36.893   5.6482 -3.742943 10.82640 
1 1 1   26   14   11 o  104.618   2.2785  227.148   9.8315  224.990   13.871  229.326   13.937  104.117   3.2300  105.118   3.2146 -1.001534 4.557083 
1 1 1   26   14   12 o   54.698   3.1499   62.835   7.0610   70.369   9.9370   55.151   10.035   58.074   4.1486   51.322   4.7410 6.752869 6.299838 
1 1 1   26   14   13 o   66.444   3.3553   92.566   9.1588   93.135   13.582   92.091   12.403   66.583   4.9458   66.306   4.5354 0.2771835 6.710513 
1 1 1   26   14   14 o   75.586   3.1046  119.518   9.6617  121.838   14.141  117.485   13.232   76.245   4.4967   74.927   4.2818 1.318260 6.209145 
1 1 1   26   14   15 o   33.009   4.9653   21.159   6.7192   38.942   11.301   11.436   8.3567   42.739   6.4111   23.279   7.5839 19.46025 9.930629 
1 1 1   26   14   16 o   65.795   3.1593   91.882   8.1800   86.916   13.592   94.703   10.243   64.209   5.1322   67.381   3.6856 -3.171165 6.318521 
1 1 1   26   14   17 o  118.847   2.5161  296.105   11.977  287.223   19.241  301.725   15.304  117.224   3.9796  120.471   3.0800 -3.246498 5.032214 
1 1 1   26   14   18 o   63.210   3.5178   83.476   9.1310   91.484   13.720   77.109   12.234   65.890   5.0484   60.530   4.9004 5.360226 7.035645 
1 1 1   26   14   19 o   72.956   3.5761  111.771   10.730  102.060   14.587  123.223   15.840   69.512   5.0879   76.401   5.0267 -6.889198 7.152240 
1 1 1   26   14   20 o   55.264   3.7104   66.303   7.9673   59.800   13.380   69.876   9.9173   52.833   6.1401   57.696   4.1676 -4.862885 7.420873 
1 1 1   26   14   21 o   37.565   5.8748   33.115   8.8597   25.759   14.249   37.750   11.312   33.271   9.7530   41.859   6.5521 -8.588146 11.74955 
1 1 1   26   14   22 o   22.756   6.2616   8.2582   8.5972   2.8730   13.645   11.804   11.071   21.277   9.0052   24.235   8.7028 -2.957876 12.52328 
1 1 1   26   14   23 o   45.619   5.2011   47.325   9.2042   33.083   13.061   61.378   12.973   37.777   8.5783   53.460   5.8837 -15.68382 10.40215 
1 1 1   26   14   24 o   37.746   5.5957   33.062   8.4773   27.378   12.972   37.299   11.200   34.079   9.0694   41.414   6.5568 -7.334553 11.19133 
1 1 1   26   14   25 o   33.630   6.4051   29.291   9.1949   16.740   17.129   34.372   10.898   28.280   10.704   38.981   7.0376 -10.70089 12.81018 
1 1 1   26   14   26 o   58.721   3.9956   74.901   9.5935   71.635   14.333   77.552   12.912   57.351   6.0595   60.090   5.2099 -2.739403 7.991269 
1 1 1   26   14   27 o   28.166   5.9567   18.813   8.0487   9.2312   12.088   26.445   10.788   22.791   8.8960   33.541   7.9242 -10.75026 11.91349 
1 1 1   26   14   28 f   28.586   6.6524   19.823   9.1063   18.151   13.513   21.214   12.325   27.687   9.6441   29.484   9.1656 -1.796743 13.30482 
1 1 1   26   14   29 o   33.375   7.4718   25.268   11.138   17.488   13.515   41.736   19.663   27.266   9.6340   39.484   11.423 -12.21883 14.94351 
1 1 1   26   14   30 o   21.578   6.5882  -3.3356   10.618 -13.4910   12.988   17.128   18.437   15.374   7.3377   27.782   10.944 -12.40800 13.17645 
1 1 1   26   14   31 o   37.998   10.098   29.222   13.005   24.681   13.495   88.430   48.727   30.952   9.5855   45.044   17.777 -14.09153 20.19630 
1 1 1   26   14   32 o   42.682   10.577   49.093   18.524   49.093   18.524   0.0000   0.0000   42.682   10.577  ?   ?       ?      ? 
1 1 1   26   14   33 o   51.884   7.4322   76.980   14.525   85.836   17.768   59.140   25.220   60.577   7.1116   43.191   13.053 17.38614 14.86435 
1 1 1   26   14   34 o   21.970   6.8714   4.3413   12.518   10.991   14.870 -11.8382   23.195   23.294   9.5934   20.645   9.8402 2.648680 13.74278 
1 1 1   26   14   35 o   28.854   8.7450   19.172   18.279   41.951   29.930   5.6218   23.084   33.831   13.734   23.877   10.830 9.954163 17.48993 
1 1 1   26   15    0 o   70.484   3.0171  104.105   12.300  104.105   12.300  104.105   12.300   70.484   4.2668   70.484   4.2668 0.000000 0.000000 
1 1 1   26   15    1 o   97.497   2.4793  196.090   9.9014  208.406   15.076  186.749   13.130  100.142   3.6502   94.852   3.3562 5.289948 4.958629 
1 1 1   26   15    2 o   80.323   2.6507  133.615   8.7297  138.821   13.179  129.545   11.653   81.683   3.9118   78.964   3.5780 2.719193 5.301362 
1 1 1   26   15    3 o   95.732   2.4791  190.845   9.7010  186.546   14.644  194.208   12.951   94.720   3.7484   96.744   3.2456 -2.024750 4.958242 
1 1 1   26   15    4 o   26.672   5.7575   14.271   6.6892   19.889   11.416   11.334   8.2546   30.029   8.7090   23.314   7.5331 6.715113 11.51499 
1 1 1   26   15    5 o  154.435   2.6593  493.206   15.958  504.304   27.807  487.756   19.487  155.511   4.3354  153.359   3.0808 2.152115 5.318596 
1 1 1   26   15    6 o   56.985   3.5970   70.813   7.8995   59.245   13.186   77.288   9.8658   53.029   6.0289   60.941   3.9252 -7.911797 7.194074 
1 1 1   26   15    7 o   81.070   2.6426  138.049   8.7208  126.180   13.088  147.527   11.695   77.841   4.0766   84.299   3.3638 -6.458145 5.285227 
1 1 1   26   15    8 o  112.407   2.3899  260.810   10.992  274.088   16.798  250.868   14.536  114.855   3.5460  109.958   3.2051 4.897720 4.779802 
1 1 1   26   15    9 o   70.301   3.2938  105.787   8.8352   96.484   15.444  110.313   10.772   67.756   5.5264   72.846   3.5854 -5.089806 6.587521 
1 1 1   26   15   10 o   81.924   3.0580  138.308   9.6330  145.381   17.233  135.093   11.617   83.247   5.0192   80.601   3.4947 2.646271 6.115957 
1 1 1   26   15   11 o   71.783   2.5942  107.407   7.6756  104.331   10.937  110.392   10.775   70.754   3.7478   72.812   3.5880 -2.058044 5.188396 
1 1 1   26   15   12 o   55.521   3.7665   63.701   8.5009   81.185   12.992   50.612   11.241   62.106   5.0721   48.935   5.5696 13.17081 7.533009 
1 1 1   26   15   13 o   82.828   2.9636  143.599   10.096  142.140   14.798  144.870   13.809   82.388   4.3550   83.268   4.0208 -0.8807373 5.927279 
1 1 1   26   15   14 o  129.035   2.5667  347.169   13.631  346.493   19.921  347.764   18.692  128.870   3.7479  129.199   3.5077 -0.3289948 5.133336 
1 1 1   26   15   15 o   46.187   3.9253   45.882   7.1509   42.431   11.731   47.922   9.0207   44.593   6.3781   47.781   4.5774 -3.187927 7.850659 
1 1 1   26   15   16 o   32.290   5.0808   26.217   6.7761   10.968   11.444   34.448   8.4083   24.145   8.8225   40.435   5.0419 -16.28965 10.16154 
1 1 1   26   15   17 o   86.123   2.8173  155.020   9.8177  155.249   15.456  154.865   12.712   86.063   4.3543   86.183   3.5761 -0.1200562 5.634609 
1 1 1   26   15   18 o  138.657   2.4285  399.064   13.489  408.976   21.966  393.063   17.091  139.854   3.8081  137.460   3.0146 2.394516 4.856924 
1 1 1   26   15   19 o   27.876   6.0510   16.894   8.1592   8.1992   11.670   25.210   11.412   22.585   8.7614   33.168   8.3485 -10.58291 12.10209 
1 1 1   26   15   20 o   32.644   5.3187   26.082   7.5264   10.859   11.930   36.147   9.7004   24.117   8.9733   41.171   5.7126 -17.05326 10.63738 
1 1 1   26   15   21 o   24.299   5.9544   11.144   7.6917   18.753   11.176   4.2957   10.602   28.686   8.6934   19.912   8.1390 8.773510 11.90875 
1 1 1   26   15   22 o   50.112   7.2172   73.350   11.783   35.436   26.584   82.619   13.144   37.895   13.498   62.329   5.1131 -24.43462 14.43441 
1 1 1   26   15   23 o   28.694   6.1727   19.003   7.9635   17.723   11.797   20.074   10.794   27.932   9.0034   29.457   8.4468 -1.524532 12.34545 
1 1 1   26   15   24 o   26.709   6.1911   15.794   7.8039   19.222   12.106   13.357   10.208   28.729   9.1060   24.689   8.3905 4.040161 12.38223 
1 1 1   26   15   25 o   22.800   6.4112   8.7289   8.6569   1.7911   16.975   11.167   10.064   22.431   9.7739   23.168   8.2998 -0.7375069 12.82246 
1 1 1   26   15   26 o   23.636   6.2120   11.281   8.1003   9.6553   12.070   12.613   10.926   23.021   8.9161   24.251   8.6521 -1.230061 12.42404 
1 1 1   26   15   27 o   88.152   5.7830  208.558   15.083  130.249   32.303  230.391   17.057   72.093   10.864  104.212   3.9684 -32.11884 11.56598 
1 1 1   26   15   28 o   21.273   6.5766   1.9021   10.859   2.5392   16.523   1.4177   14.408   22.017   9.6169   20.529   8.9732 1.488352 13.15312 
1 1 1   26   15   29 o   86.107   4.4155  165.818   15.012  169.100   18.882  160.178   24.752   88.229   5.1888   83.984   7.1458 4.245354 8.830993 
1 1 1   26   15   30 o   20.637   6.4983  -5.1046   10.840 -14.2562   13.329   12.770   18.628   15.379   7.3651   25.895   10.708 -10.51635 12.99654 
1 1 1   26   15   31 o   21.369   6.7242   1.6215   11.579   0.8698   14.607   2.8925   18.993   20.054   8.8892   22.684   10.092 -2.630209 13.44844 
1 1 1   26   15   32 o   27.566   10.211   19.378   15.416   19.378   15.416   0.0000   0.0000   27.566   10.211  ?   ?       ?      ? 
1 1 1   26   15   33 o   55.936   7.0698   84.155   14.777   87.174   18.240   78.388   25.206   60.581   7.3002   51.291   12.109 9.290627 14.13965 
1 1 1   26   15   34 o   27.857   7.6105   21.501   13.120   27.967   16.281   9.5228   22.158   31.103   10.596   24.610   10.927 6.493088 15.22091 
1 1 1   26   16    0 o   92.419   2.6877  177.777   14.433  177.777   14.433  177.777   14.433   92.419   3.8010   92.419   3.8010 0.000000 0.000000 
1 1 1   26   16    1 f   61.491   3.0216   79.068   7.6061   76.563   11.370   81.097   10.233   60.562   4.5520   62.419   3.9747 -1.856991 6.043131 
1 1 1   26   16    2 o  108.333   2.4110  245.120   10.666  232.191   16.008  255.444   14.304  105.690   3.6723  110.977   3.1252 -5.286812 4.822068 
1 1 1   26   16    3 o   46.809   4.1237   46.784   7.4469   44.055   12.857   48.162   9.1352   45.593   6.8373   48.025   4.6120 -2.431904 8.247347 
1 1 1   26   16    4 o  104.870   2.7638  229.929   11.248  225.678   19.446  232.066   13.789  103.975   4.5345  105.766   3.1610 -1.791550 5.527535 
1 1 1   26   16    5 o   81.320   2.9530  135.876   9.4467  144.272   16.185  131.538   11.634   83.079   4.7234   79.561   3.5454 3.518066 5.905928 
1 1 1   26   16    6 o  120.887   2.3738  305.377   11.706  289.448   17.648  317.890   15.642  117.983   3.6268  123.790   3.0636 -5.807137 4.747555 
1 1 1   26   16    7 o  101.969   2.4231  216.201   10.110  215.442   15.273  216.792   13.487  101.758   3.6390  102.179   3.2003 -0.4208221 4.846105 
1 1 1   26   16    8 o   54.667   3.2055   62.027   7.1799   66.995   10.935   58.262   9.5191   56.547   4.6887   52.787   4.3722 3.760025 6.410964 
1 1 1   26   16    9 o  130.590   2.7198  359.832   13.740  343.497   23.717  368.083   16.857  128.065   4.4902  133.115   3.0703 -5.049850 5.439575 
1 1 1   26   16   10 o   67.142   2.8362   93.202   7.8090  103.515   11.844   85.271   10.386   70.379   4.0803   63.905   3.9406 6.473690 5.672451 
1 1 1   26   16   11 o  156.511   2.3785  511.223   14.975  503.272   23.877  516.378   19.227  155.343   3.7267  157.680   2.9565 -2.336914 4.757008 
1 1 1   26   16   12 o  118.715   2.6729  293.953   13.082  283.045   18.313  305.321   18.695  116.455   3.8128  120.975   3.7469 -4.520378 5.345720 
1 1 1   26   16   13 o   57.982   3.5400   70.255   8.4294   79.670   12.523   62.457   11.398   61.523   4.9354   54.441   5.0761 7.082088 7.079902 
1 1 1   26   16   14 o   79.703   3.0180  133.800   9.8600  119.662   14.159  147.110   13.738   75.509   4.5465   83.896   3.9703 -8.386787 6.036074 
1 1 1   26   16   15 f   51.019   3.7501   56.128   7.4360   51.232   12.534   58.787   9.2372   49.048   6.1960   52.990   4.2265 -3.942493 7.500209 
1 1 1   26   16   16 o   44.040   4.0070   37.898   6.9816   54.963   12.079   29.338   8.5553   50.876   5.7566   37.204   5.5755 13.67270 8.013978 
1 1 1   26   16   17 o   19.389   4.9978   4.5655   6.3910 -12.3192   11.060   13.030   7.8308   14.485   6.8727   24.293   7.2581 -9.808384 9.995691 
1 1 1   26   16   18 o   28.629   5.5754   19.187   6.6507   14.906   11.863   21.149   8.0315   26.435   9.0450   30.822   6.5213 -4.386580 11.15078 
1 1 1   26   16   19 o   53.859   4.2675   62.401   9.4234   69.101   13.220   55.480   13.436   56.941   5.6293   50.777   6.4155 6.164452 8.535053 
1 1 1   26   16   20 o   60.509   3.5166   76.222   8.6889   88.401   13.495   67.597   11.356   64.529   5.0704   56.489   4.8742 8.039913 7.033286 
1 1 1   26   16   21 o   48.701   5.3238   56.532   9.5971   39.427   15.227   67.805   12.361   41.006   9.2265   56.395   5.3145 -15.38919 10.64762 
1 1 1   26   16   22 o   63.198   3.5859   84.943   9.3364   90.770   13.449   79.522   12.971   65.319   4.9922   61.078   5.1490 4.240604 7.171788 
1 1 1   26   16   23 o   86.710   3.1148  158.417   11.056  133.391   15.079  187.518   16.259   79.232   4.6142   94.188   4.1855 -14.95612 6.229677 
1 1 1   26   16   24 o   57.502   3.9668   72.699   9.2153   59.678   13.491   84.090   12.618   52.267   6.2581   62.737   4.8764 -10.46947 7.933672 
1 1 1   26   16   25 o   20.299   6.2213   1.5563   9.5320  -3.6153   15.859   4.4813   11.927   20.094   9.0577   20.505   8.5310 -0.4109497 12.44267 
1 1 1   26   16   26 o   22.067   6.0470   8.3256   8.2318   1.2720   12.612   13.561   10.865   19.488   8.4584   24.646   8.6442 -5.158543 12.09408 
1 1 1   26   16   27 o   17.517   5.5068  -2.3025   8.2069  -8.9768   12.480   2.7832   10.894   16.122   7.5404   18.912   8.0276 -2.789051 11.01362 
1 1 1   26   16   28 o   22.371   6.7514   5.5027   10.402   6.0987   12.485   4.1496   18.812   21.235   8.7727   23.508   10.265 -2.272392 13.50282 
1 1 1   26   16   29 o   54.664   6.1672   72.620   12.564   73.778   15.407   70.321   21.706   57.236   6.5267   52.092   10.466 5.144417 12.33450 
1 1 1   26   16   30 o   23.862   6.6826   10.777   10.716   18.660   12.749  -8.1965   19.778   27.324   9.3760   20.399   9.5247 6.925470 13.36518 
1 1 1   26   16   31 o   27.378   7.8160   14.222   12.837   6.9466   15.439   30.524   23.109   22.405   9.5347   32.351   12.387 -9.945713 15.63199 
1 1 1   26   16   32 o   16.858   5.8545 -23.0982   12.589 -24.2724   15.249 -20.5844   22.311   14.671   7.2146   19.044   9.2224 -4.373432 11.70908 
1 1 1   26   16   33 o   23.893   7.8335  -1.2031   18.061   15.713   28.346 -12.7646   23.434   27.262   12.214   20.523   9.8120 6.739134 15.66694 
1 1 1   26   17    0 o  157.035   2.1907  510.796   20.049  510.796   20.049  510.796   20.049  157.035   3.0982  157.035   3.0982 0.000000 0.000000 
1 1 1   26   17    1 o   15.470   4.6517  -1.8094   5.6598  -9.5240   8.3989   4.6081   7.6604   12.729   6.0248   18.211   7.0891 -5.481715 9.303441 
1 1 1   26   17    2 o   66.202   3.2833   91.366   8.4372   92.834   14.699   90.646   10.303   66.433   5.3648   65.971   3.7867 0.4620590 6.566617 
1 1 1   26   17    3 o   61.853   3.2805   74.500   8.0182  101.101   14.024   61.582   9.7731   69.427   4.8977   54.279   4.3655 15.14810 6.560905 
1 1 1   26   17    4 o   43.922   4.5865   44.541   7.3633   32.871   12.225   51.186   9.2243   38.394   7.9806   49.450   4.5228 -11.05605 9.173032 
1 1 1   26   17    5 o  125.014   2.6899  328.486   13.114  317.542   22.357  334.226   16.192  123.183   4.4005  126.845   3.0950 -3.661644 5.379897 
1 1 1   26   17    6 o   58.868   3.0804   73.228   7.3782   67.485   11.119   77.746   9.8623   56.703   4.7545   61.033   3.9179 -4.329895 6.160747 
1 1 1   26   17    7 o   90.685   2.5478  172.730   9.4380  158.974   13.997  184.198   12.780   87.271   3.8888   94.100   3.2929 -6.829063 5.095686 
1 1 1   26   17    8 o   36.925   5.1559   28.268   7.0784   34.065   13.293   25.973   8.3626   38.835   8.5325   35.016   5.7904 3.818619 10.31173 
1 1 1   26   17    9 o   39.395   5.0350   32.072   7.4016   38.830   13.704   29.289   8.7947   41.602   8.2780   37.187   5.7340 4.414352 10.06995 
1 1 1   26   17   10 o   64.449   2.8734   86.279   7.5988   92.220   11.467   81.627   10.146   66.388   4.1879   62.511   3.9354 3.876308 5.746800 
1 1 1   26   17   11 o  105.654   2.8169  236.728   11.406  223.762   19.980  242.996   13.892  103.203   4.6940  108.105   3.1156 -4.901993 5.633845 
1 1 1   26   17   12 o   29.699   4.6252   17.668   7.5225  -7.6685   10.926   40.500   10.372   15.697   7.2425   43.701   5.7547 -28.00373 9.250409 
1 1 1   26   17   13 o   64.111   3.3884   86.474   8.9339   85.638   13.104   87.201   12.212   63.772   4.9819   64.451   4.5941 -0.6790733 6.776807 
1 1 1   26   17   14 o   49.268   4.0860   51.603   8.2630   50.561   12.222   52.480   11.214   48.734   6.0807   49.801   5.4596 -1.067650 8.171988 
1 1 1   26   17   15 o   35.165   5.0734   30.334   6.8425   18.138   11.544   36.941   8.4960   28.490   8.8724   41.840   4.9233 -13.34999 10.14681 
1 1 1   26   17   16 o   26.382   5.5001   16.277   6.6620   8.5201   11.300   20.410   8.2480   22.563   8.6568   30.201   6.7869 -7.637550 11.00011 
1 1 1   26   17   17 o   64.925   3.1151   85.652   7.9997   99.311   13.764   78.685   9.8306   68.559   4.8676   61.292   3.8887 7.267082 6.230246 
1 1 1   26   17   18 o   77.410   3.1130  127.026   9.8247  119.655   14.801  132.832   13.136   75.251   4.7687   79.570   4.0028 -4.318268 6.225977 
1 1 1   26   17   19 o   28.932   5.8502   18.563   7.2113   22.728   11.568   15.916   9.2229   31.322   8.6628   26.542   7.8648 4.780272 11.70043 
1 1 1   26   17   20 o   30.996   6.5735   22.466   9.1725   25.884   12.572   18.575   13.412   33.257   8.9628   28.736   9.6184 4.520943 13.14708 
1 1 1   26   17   21 o   31.336   5.8458   17.824   8.4947   42.317   14.315   4.5122   10.554   42.795   8.4102   19.876   8.1217 22.91933 11.69162 
1 1 1   26   17   22 o   47.675   5.3079   49.656   10.058   40.427   13.045   63.182   15.792   41.940   7.8295   53.410   7.1690 -11.46996 10.61583 
1 1 1   26   17   23 o   47.056   4.7837   48.050   9.1517   53.563   14.463   44.370   11.818   49.095   7.1429   45.018   6.3650 4.076138 9.567356 
1 1 1   26   17   24 o   20.318   5.8299   4.7505   7.9551  -1.9002   12.022   9.9311   10.610   18.073   8.0353   22.563   8.4490 -4.489328 11.65985 
1 1 1   26   17   25 o   59.340   4.7632   78.851   10.814   77.402   19.024   79.542   13.144   58.061   7.9445   60.619   5.2572 -2.558090 9.526417 
1 1 1   26   17   26 o   18.501   5.4522  -1.0760   7.9792 -15.7025   11.908   10.844   10.750   14.106   6.8081   22.896   8.5179 -8.789684 10.90440 
1 1 1   26   17   27 o   16.841   5.3944  -3.9193   8.0234  -1.2256   12.046  -6.0670   10.757   18.117   8.0495   15.566   7.1834 2.550764 10.78871 
1 1 1   26   17   28 o   25.593   6.9670   9.2391   10.059   1.2790   12.020   27.840   18.374   18.884   8.2267   32.302   11.246 -13.41727 13.93394 
1 1 1   26   17   29 o   47.302   6.7691   57.715   12.505   60.884   15.846   52.483   20.362   51.032   7.5286   43.573   11.252 7.458740 13.53820 
1 1 1   26   17   30 o   34.354   9.4924   34.181   17.703   45.280   35.947   30.627   20.341   35.996   14.879   32.712   11.791 3.284630 18.98481 
1 1 1   26   17   31 o   21.382   6.8722  -0.3562   12.382  -3.3270   15.092   5.7613   21.657   18.827   8.6222   23.938   10.704 -5.111038 13.74449 
1 1 1   26   17   32 o   20.893   6.8263  -2.0733   12.864  -3.6642   15.587   1.3256   22.783   18.837   8.6766   22.950   10.541 -4.112593 13.65261 
1 1 1   26   18    0 o   24.035   6.3620   16.379   8.3206   16.379   8.3206   16.379   8.3206   24.035   8.9973   24.035   8.9973 0.000000 0.000000 
1 1 1   26   18    1 o   39.750   4.5787   31.638   7.0851   45.920   12.048   24.087   8.7599   46.453   6.2883   33.047   6.6570 13.40554 9.157483 
1 1 1   26   18    2 o   61.069   3.5398   80.343   8.2823   73.108   14.343   83.962   10.144   58.714   5.9230   63.423   3.8780 -4.709530 7.079589 
1 1 1   26   18    3 o   74.066   3.1873  120.460   9.0126   99.023   15.225  132.025   11.182   68.493   5.3895   79.640   3.4044 -11.14710 6.374666 
1 1 1   26   18    4 o   83.309   3.4087  144.481   11.712   0.0000   0.0000  144.481   11.712  ?   ?    83.309   3.4087      ?      ? 
1 1 1   26   18    5 o   81.265   2.6070  137.126   8.6891  143.008   13.106  132.512   11.607   82.776   3.8388   79.755   3.5284 3.021645 5.214077 
1 1 1   26   18    6 o   54.531   3.2191   63.023   7.1412   57.552   10.731   67.371   9.5672   52.295   4.9752   56.766   4.0863 -4.471272 6.438198 
1 1 1   26   18    7 o  159.925   2.4810  532.911   16.363  529.990   23.285  535.760   22.998  159.477   3.5401  160.372   3.4770 -0.8952026 4.962029 
1 1 1   26   18    8 o  122.114   2.7837  319.397   13.175  287.268   22.266  336.705   16.343  116.973   4.6153  127.256   3.1138 -10.28286 5.567469 
1 1 1   26   18    9 o   23.088   5.9525   9.1420   6.8126   13.066   12.697   7.5556   8.0732   25.830   9.3147   20.347   7.4137 5.482786 11.90492 
1 1 1   26   18   10 o   73.720   3.3606  119.266   9.2354  101.755   16.462  127.309   11.157   69.268   5.7620   78.172   3.4603 -8.903603 6.721211 
1 1 1   26   18   11 o   67.089   3.7965   98.981   9.9566   80.400   15.941  110.867   12.750   61.413   6.2933   72.765   4.2482 -11.35212 7.592976 
1 1 1   26   18   12 o  173.967   2.6412  631.402   18.945  611.373   26.453  652.492   27.145  171.129   3.7478  176.805   3.7224 -5.675766 5.282308 
1 1 1   26   18   13 o   53.019   4.0121   61.451   8.4886   46.255   12.410   74.812   11.637   46.440   6.4790   59.598   4.7341 -13.15722 8.024290 
1 1 1   26   18   14 o  125.489   2.6823  328.762   13.853  299.706   19.141  360.722   20.074  119.638   3.8790  131.339   3.7058 -11.70120 5.364676 
1 1 1   26   18   15 o   70.434   3.0887  104.174   8.6516  104.892   14.274  103.758   10.877   70.445   4.9130   70.423   3.7448 0.2152252E-01 6.177459 
1 1 1   26   18   16 o   23.066   5.5711   11.173   6.5870   5.0067   11.047   14.576   8.2053   20.602   8.3503   25.531   7.3772 -4.929831 11.14229 
1 1 1   26   18   17 o   77.058   2.9529  125.361   8.9839  123.116   14.971  126.624   11.231   76.294   4.7576   77.821   3.4990 -1.527237 5.905746 
1 1 1   26   18   18 o   79.109   3.5259  132.494   11.472  128.080   15.547  137.768   16.996   77.729   4.8496   80.490   5.1195 -2.760880 7.051828 
1 1 1   26   18   19 o   60.833   3.8940   81.248   8.8149   73.943   16.012   84.424   10.559   58.315   6.6574   63.351   4.0411 -5.036392 7.787940 
1 1 1   26   18   20 f   33.058   6.9754   25.639   10.163   30.620   15.671   22.023   13.351   35.522   10.175   30.594   9.5440 4.927191 13.95085 
1 1 1   26   18   21 o   31.287   6.1548   22.883   8.1984   26.128   12.397   20.360   10.929   33.127   8.8888   29.448   8.5158 3.678968 12.30970 
1 1 1   26   18   22 o   43.735   4.7339   42.281   8.4953   40.650   12.490   43.685   11.589   42.782   7.0783   44.688   6.2878 -1.906616 9.467752 
1 1 1   26   18   23 o   16.887   5.2937  -4.2920   7.5092   4.2809   11.455 -10.7529   9.9441   20.115   8.3640   13.659   6.4911 6.456859 10.58732 
1 1 1   26   18   24 o   45.276   4.8071   46.812   8.6135   41.380   12.792   51.317   11.650   42.145   7.6407   48.407   5.8354 -6.262066 9.614161 
1 1 1   26   18   25 o   53.735   5.6201   75.381   10.319   46.106   17.647   90.594   12.721   42.575   10.186   64.894   4.7528 -22.31867 11.24024 
1 1 1   26   18   26 o   27.698   6.0445   18.289   8.6136   5.1245   13.142   28.204   11.405   21.172   8.8924   34.223   8.1894 -13.05104 12.08893 
1 1 1   26   18   27 f   24.275   6.7813   11.322   9.5825   14.026   16.623   9.9757   11.727   25.960   10.339   22.590   8.7776 3.369846 13.56261 
1 1 1   26   18   28 o   30.022   6.9883   15.261   10.860   0.7850   13.180   45.871   19.166   19.262   8.4956   40.782   11.098 -21.52030 13.97659 
1 1 1   26   18   29 f   22.557   6.6184   7.4772   10.699   14.500   13.299  -5.4088   18.014   25.035   9.4422   20.079   9.2767 4.955849 13.23677 
1 1 1   26   18   30 o   26.380   7.5520   15.737   12.549   12.115   16.200   21.173   19.845   24.358   10.020   28.402   11.301 -4.043394 15.10393 
1 1 1   26   18   31 o   30.868   8.0372   24.608   12.853   16.339   15.566   42.329   22.787   25.675   10.075   36.061   12.526 -10.38554 16.07446 
1 1 1   26   18   32 o   34.631   8.2677   35.106   13.584   27.947   16.907   48.143   22.814   30.925   10.787   38.338   12.533 -7.413689 16.53547 
1 1 1   26   19    0 o   89.983   2.7631  168.986   14.440  168.986   14.440  168.986   14.440   89.983   3.9076   89.983   3.9076 0.000000 0.000000 
1 1 1   26   19    1 o   88.023   2.8674  158.891   9.8609  171.687   17.203  152.630   12.034   90.435   4.6122   85.612   3.4081 4.822929 5.734804 
1 1 1   26   19    2 o   64.479   3.3588   90.965   8.2864   76.858   14.061   98.472   10.257   60.237   5.6597   68.722   3.6186 -8.484512 6.717663 
1 1 1   26   19    3 o  130.275   2.6712  352.809   13.558  358.611   23.456  349.898   16.615  130.823   4.3471  129.727   3.1053 1.096008 5.342307 
1 1 1   26   19    4 o   84.260   2.5787  148.177   8.8852  147.282   13.448  148.870   11.837   83.971   3.8830   84.550   3.3944 -0.5783081 5.157431 
1 1 1   26   19    5 f   92.500   2.4927  177.872   9.4423  182.072   14.299  174.625   12.574   93.413   3.7113   91.587   3.3286 1.825928 4.985343 
1 1 1   26   19    6 o   53.804   3.1900   60.326   7.0542   66.148   10.515   55.561   9.5127   56.142   4.5409   51.466   4.4815 4.676601 6.379930 
1 1 1   26   19    7 o  100.290   2.4651  208.177   10.105  219.656   15.522  199.731   13.313  102.619   3.6674   97.961   3.2951 4.657936 4.930251 
1 1 1   26   19    8 o   41.857   5.0399   40.577   7.5350   32.897   13.642   43.949   9.0388   37.995   8.8671   45.719   4.7934 -7.723797 10.07983 
1 1 1   26   19    9 o  157.020   2.7289  516.634   16.631  510.098   28.777  519.912   20.379  155.928   4.4746  158.113   3.1250 -2.185181 5.457843 
1 1 1   26   19   10 o   76.336   3.2358  124.297   9.4260  117.425   16.625  127.553   11.443   74.473   5.4124   78.199   3.5479 -3.726608 6.471649 
1 1 1   26   19   11 o  128.997   2.8599  348.108   14.759  350.954   24.013  346.379   18.711  129.174   4.5073  128.820   3.5216 0.3538513 5.719865 
1 1 1   26   19   12 o   50.132   4.3346   52.580   8.7389   59.438   14.339   48.528   11.022   52.516   6.6202   47.747   5.5971 4.769627 8.669128 
1 1 1   26   19   13 o   27.070   5.8056   14.903   7.4485   25.056   11.359   7.2435   9.8658   33.072   8.3314   21.069   8.0876 12.00281 11.61127 
1 1 1   26   19   14 o   29.765   5.8441   20.002   7.3177   21.233   11.615   19.192   9.4229   30.444   8.7717   29.086   7.7246 1.357672 11.68811 
1 1 1   26   19   15 o   56.151   3.5187   66.856   7.9221   66.606   12.766   67.012   10.103   55.886   5.5384   56.416   4.3419 -0.5302505 7.037437 
1 1 1   26   19   16 o   78.730   3.1361  131.374   9.3784  129.187   16.850  132.355   11.288   77.898   5.2446   79.561   3.4401 -1.663040 6.272179 
1 1 1   26   19   17 o   23.817   5.7324   9.9151   6.6592   19.182   11.498   5.2382   8.1685   28.911   8.8306   18.723   7.3117 10.18778 11.46473 
1 1 1   26   19   18 o   99.736   2.8124  207.414   11.504  226.710   17.439  192.550   15.306  103.757   4.0751   95.715   3.8772 8.041855 5.624884 
1 1 1   26   19   19 o   77.976   3.0863  132.202   9.3767  117.136   15.574  140.768   11.744   74.025   5.1012   81.927   3.4754 -7.902641 6.172556 
1 1 1   26   19   20 o   59.206   4.9735   78.397   11.977   70.796   17.840   84.635   16.161   56.161   7.7020   62.251   6.2946 -6.089848 9.946935 
1 1 1   26   19   21 o   92.121   3.3122  180.768   12.398  179.679   16.191  182.311   19.275   92.047   4.2649   92.195   5.0689 -0.1486511 6.624453 
1 1 1   26   19   22 o   52.899   4.4368   63.372   9.2908   46.070   13.553   78.712   12.761   45.322   7.2502   60.476   5.1162 -15.15407 8.873597 
1 1 1   26   19   23 o   27.499   6.4013   17.846   8.2446   18.692   13.439   17.336   10.440   27.988   9.6250   27.010   8.4421 0.9780140 12.80268 
1 1 1   26   19   24 o   13.684   4.6017 -13.9226   7.5814 -30.0717   12.232  -3.8497   9.6607   11.982   5.9878   15.386   6.9892 -3.403660 9.203429 
1 1 1   26   19   25 o   17.663   5.5826  -3.3620   8.7697 -23.0567   16.502   4.3893   10.353   16.060   7.8130   19.266   7.9762 -3.205471 11.16520 
1 1 1   26   19   26 o   29.994   6.2744   21.755   8.6709   31.016   12.716   13.707   11.854   35.361   8.7634   24.628   8.9820 10.73365 12.54884 
1 1 1   26   19   27 o   25.754   7.0050   15.285   10.539   18.418   12.846   8.8324   18.435   27.209   9.4072   24.300   10.382 2.909229 14.00999 
1 1 1   26   19   28 o   24.759   6.8369   13.485   10.346   17.701   12.695   5.1432   17.856   26.695   9.3448   22.823   9.9823 3.871555 13.67376 
1 1 1   26   19   29 o   26.578   7.4589   15.743   12.363   8.1924   16.507   25.390   18.659   23.034   9.8321   30.122   11.219 -7.088518 14.91774 
1 1 1   26   19   30 o   79.222   5.7489  154.325   18.769  152.988   26.012  155.777   27.109   79.111   7.9722   79.334   8.2851 -0.2230835 11.49773 
1 1 1   26   19   31 o   25.630   7.3655   11.114   12.253   0.0583   15.285   30.994   20.497   19.635   8.8679   31.626   11.763 -11.99025 14.73104 
1 1 1   26   20    0 o   19.149   6.7641   11.552   9.2103   11.552   9.2103   11.552   9.2103   19.149   9.5658   19.149   9.5658 0.000000 0.000000 
1 1 1   26   20    1 o   89.163   3.0786  165.601   11.127  171.891   17.564  161.385   14.381   90.448   4.7083   87.877   3.9677 2.571648 6.157135 
1 1 1   26   20    2 o   99.495   3.2701  206.002   13.419   0.0000   0.0000  206.002   13.419  ?   ?    99.495   3.2701      ?      ? 
1 1 1   26   20    3 o  142.721   2.3488  421.686   13.663  438.888   21.177  409.420   17.883  145.110   3.5384  140.331   3.0898 4.779755 4.697567 
1 1 1   26   20    4 o   39.591   3.9765   33.088   6.4707   34.557   9.6342   31.880   8.7339   40.358   5.7879   38.824   5.4543 1.533718 7.952930 
1 1 1   26   20    5 o   34.304   4.5900   26.502   6.2189   19.481   9.2229   32.357   8.4215   29.459   7.5545   39.148   5.2156 -9.688971 9.180073 
1 1 1   26   20    6 o   90.106   2.5225  169.751   9.2971  166.064   13.992  172.665   12.440   89.158   3.8051   91.055   3.3126 -1.896759 5.044993 
1 1 1   26   20    7 f   76.458   3.3084  126.841   9.5554  113.041   16.868  133.361   11.595   72.965   5.6051   79.952   3.5163 -6.987625 6.616797 
1 1 1   26   20    8 o   43.269   4.4240   35.050   7.2908   54.895   14.021   27.695   8.5355   50.475   6.7348   36.064   5.7384 14.41048 8.847990 
1 1 1   26   20    9 o  135.745   2.7847  393.715   14.625  362.747   24.971  409.886   18.044  131.205   4.6144  140.285   3.1186 -9.080307 5.569436 
1 1 1   26   20   10 o   87.197   3.5384  160.805   12.720  154.518   17.819  167.340   18.165   85.436   5.0567   88.958   4.9509 -3.521858 7.076814 
1 1 1   26   20   11 o   64.430   3.7523   89.838   9.6650   79.841   15.151   96.699   12.550   61.087   6.0133   67.772   4.4900 -6.684643 7.504630 
1 1 1   26   20   12 o   89.892   3.2386  171.684   11.738  163.576   18.406  177.242   15.239   87.864   5.0791   91.920   4.0196 -4.056862 6.477277 
1 1 1   26   20   13 o   84.057   2.9648  148.084   10.245  154.628   15.231  142.675   13.846   85.702   4.3089   82.412   4.0734 3.289474 5.929533 
1 1 1   26   20   14 o   26.888   5.3241   17.490   6.6935   6.0976   11.320   23.615   8.3000   21.214   8.5039   32.562   6.4084 -11.34737 10.64817 
1 1 1   26   20   15 o   22.930   5.6120   8.6817   6.2523   17.789   11.256   4.6178   7.5189   27.981   8.7691   17.880   7.0059 10.10056 11.22409 
1 1 1   26   20   16 o   20.114   5.5655   5.6786   6.2543   8.8284   11.378   4.3148   7.4868   22.582   8.6812   17.646   6.9668 4.935690 11.13106 
1 1 1   26   20   17 o   83.615   3.0327  148.284   10.364  143.965   15.609  151.689   13.860   82.371   4.5943   84.859   3.9601 -2.487473 6.065465 
1 1 1   26   20   18 o   47.566   4.4734   54.508   7.5083   37.547   12.739   63.535   9.2941   40.299   7.9471   54.833   4.1096 -14.53402 8.946798 
1 1 1   26   20   19 o  103.538   3.2281  236.181   12.376  208.481   22.482  248.225   14.824   98.266   5.5471  108.810   3.3032 -10.54449 6.456137 
1 1 1   26   20   20 o   73.015   4.3295  119.293   12.660   93.367   18.590  141.719   17.290   64.838   6.9515   81.193   5.1630 -16.35499 8.659078 
1 1 1   26   20   21 o   46.899   5.4603   48.048   9.9191   31.337   12.722   73.963   15.842   36.084   8.6584   57.714   6.6552 -21.62943 10.92058 
1 1 1   26   20   22 o   78.468   3.2296  132.352   10.409  127.169   15.227  136.899   14.262   76.864   4.8033   80.072   4.3186 -3.208679 6.459251 
1 1 1   26   20   23 o   21.923   5.8754   8.6988   7.7739   1.0287   11.902   14.406   10.267   18.862   8.2017   24.984   8.4149 -6.121712 11.75071 
1 1 1   26   20   24 o   97.249   2.9434  202.475   11.760  187.016   16.887  217.032   16.387   93.457   4.3810  101.041   3.9321 -7.583862 5.886813 
1 1 1   26   20   25 f   31.775   6.1387   28.070   9.8416   3.9185   17.343   39.542   11.953   22.529   9.8462   41.020   7.3340 -18.49109 12.27741 
1 1 1   26   20   26 f   76.438   3.5510  127.835   11.130  111.600   15.583  144.742   15.903   71.227   5.3046   81.649   4.7224 -10.42103 7.102062 
1 1 1   26   20   27 f   19.670   6.2966  -2.0149   10.314  -4.4961   12.629   2.9523   17.869   17.177   7.8741   22.163   9.8278 -4.986729 12.59313 
1 1 1   26   20   28 o   53.551   5.5067   64.085   11.555   54.338   13.953   85.365   20.617   48.232   7.0140   58.870   8.4910 -10.63812 11.01332 
1 1 1   26   20   29 o   18.384   6.0344 -10.9539   11.342 -25.1227   15.334   6.1654   16.855   14.542   7.1672   22.225   9.7103 -7.683357 12.06889 
1 1 1   26   20   30 o   24.283   7.5165   9.8607   14.461   13.938   19.560   4.9449   21.477   25.294   10.747   23.273   10.511 2.020926 15.03301 
1 1 1   26   21    0 o   35.883   5.7252   30.921   10.454   30.921   10.454   30.921   10.454   35.883   8.0967   35.883   8.0967 0.000000 0.000000 
1 1 1   26   21    1 o  186.933   2.6416  730.581   20.366  727.588   28.862  733.548   28.742  186.541   3.7514  187.325   3.7201 -0.7837830 5.283220 
1 1 1   26   21    2 o   64.938   3.1534   88.179   8.3896   74.962   11.443  103.538   12.336   59.651   4.6513   70.225   4.2592 -10.57369 6.306762 
1 1 1   26   21    3 o   49.340   3.7044   51.829   7.5009   55.412   10.370   47.897   10.863   51.218   4.9090   47.462   5.5491 3.755512 7.408830 
1 1 1   26   21    4 o   87.871   2.5665  162.305   9.2274  152.513   13.687  170.464   12.494   85.341   3.8885   90.401   3.3508 -5.059837 5.133061 
1 1 1   26   21    5 o   96.022   2.5033  193.589   9.8394  183.117   14.598  202.307   13.320   93.543   3.7836   98.501   3.2786 -4.958275 5.006538 
1 1 1   26   21    6 o   55.107   3.5550   64.043   8.0426   62.044   10.797   66.534   12.054   54.199   4.8301   56.016   5.2175 -1.816463 7.110017 
1 1 1   26   21    7 o   84.771   3.0696  147.929   9.9676  159.661   18.055  142.786   11.954   86.856   5.0401   82.686   3.5053 4.169823 6.139212 
1 1 1   26   21    8 o   25.052   5.6308   14.410   6.8146   4.8596   12.698   18.272   8.0761   21.583   8.8743   28.520   6.9331 -6.937189 11.26150 
1 1 1   26   21    9 o   17.463   5.1595  -1.6706   7.2530 -19.7558   12.292   7.9897   8.9836   13.918   6.7642   21.009   7.7927 -7.091615 10.31893 
1 1 1   26   21   10 o   51.332   4.2436   56.740   8.6942   55.503   14.088   57.501   11.049   50.618   6.7481   52.046   5.1473 -1.427921 8.487130 
1 1 1   26   21   11 o   81.633   3.3359  141.966   10.813  137.038   17.694  144.903   13.660   80.201   5.3492   83.064   3.9872 -2.862892 6.671730 
1 1 1   26   21   12 o   49.011   5.1627   58.773   9.0331   36.950   14.702   72.007   11.449   39.712   9.1624   58.310   4.7606 -18.59797 10.32541 
1 1 1   26   21   13 o   28.556   6.0968   17.888   7.8888   24.822   12.037   12.667   10.444   32.627   8.7605   24.486   8.4815 8.140636 12.19353 
1 1 1   26   21   14 o   68.344   3.2743  101.695   8.7993   88.477   14.248  109.844   11.188   64.344   5.3690   72.345   3.7494 -8.001762 6.548590 
1 1 1   26   21   15 o   40.963   4.9854   40.759   7.2908   29.438   12.849   46.134   8.8540   35.298   8.8442   46.628   4.6039 -11.33054 9.970758 
1 1 1   26   21   16 o   68.129   3.9319  105.009   9.4080   89.737   18.292  110.503   10.970   63.763   6.9555   72.496   3.6689 -8.732979 7.863819 
1 1 1   26   21   17 o   53.658   4.7096   63.902   10.257   67.283   13.623   59.479   15.584   55.658   5.9346   51.658   7.3144 4.000027 9.419159 
1 1 1   26   21   18 o   28.567   5.7806   18.506   6.7275   20.679   12.379   17.596   8.0143   29.487   9.1886   27.647   7.0165 1.840420 11.56126 
1 1 1   26   21   19 o   43.553   5.4253   44.535   7.8109   41.434   16.326   45.455   8.8951   40.991   9.7912   46.116   4.6766 -5.125473 10.85070 
1 1 1   26   21   20 o   21.311   5.7832   4.9459   7.6170   16.780   11.989  -3.0636   9.8633   26.757   9.0932   15.865   7.1481 10.89190 11.56641 
1 1 1   26   21   21 o   54.153   4.8201   62.871   10.461   46.442   13.409   88.417   16.721   45.275   7.1810   63.032   6.4317 -17.75704 9.640204 
1 1 1   26   21   22 o   25.076   5.6695   13.761   7.8498  -0.5682   12.141   24.056   10.290   18.424   8.1386   31.728   7.8952 -13.30318 11.33892 
1 1 1   26   21   23 o   24.639   5.9742   11.949   7.9024   22.912   11.920   3.3515   10.556   30.416   8.9214   18.861   7.9482 11.55432 11.94844 
1 1 1   26   21   24 o   38.171   5.5377   33.527   8.6435   52.559   13.363   19.835   11.334   48.085   6.7378   28.257   8.7901 19.82832 11.07534 
1 1 1   26   21   25 o   69.708   4.3767  110.219   11.892  106.142   20.079  112.421   14.759   67.683   7.1929   71.733   4.9885 -4.050583 8.753463 
1 1 1   26   21   26 o   66.688   3.7617   98.268   10.333   95.762   14.864  100.611   14.374   65.727   5.4829   67.648   5.1517 -1.920273 7.523436 
1 1 1   26   21   27 o   47.929   6.4590   64.418   11.706   79.362   14.828   39.705   19.069   59.116   6.0815   36.742   11.397 22.37497 12.91808 
1 1 1   26   21   28 o   25.832   7.3290   16.317   12.010   19.226   15.893   12.444   18.336   26.986   10.287   24.678   10.442 2.307497 14.65791 
1 1 1   26   21   29 o   20.069   6.4264  -6.2924   11.857 -20.7144   15.639   13.208   18.185   15.357   7.5005   24.782   10.437 -9.424550 12.85271 
1 1 1   26   22    0 o   58.130   5.2212   74.801   16.925   74.801   16.925   74.801   16.925   58.130   7.3839   58.130   7.3839 0.000000 0.000000 
1 1 1   26   22    1 o   67.489   3.7209   99.467   9.1292  103.025   10.765   90.356   17.228   70.176   3.7193   64.802   6.4458 5.374168 7.441855 
1 1 1   26   22    2 o   41.646   4.2777   37.380   7.2825   39.562   9.8714   34.773   10.788   43.110   5.5518   40.181   6.5093 2.928284 8.555353 
1 1 1   26   22    3 o   76.930   2.9427  124.074   9.3268  120.200   12.827  128.420   13.586   75.675   4.1096   78.185   4.2131 -2.509811 5.885495 
1 1 1   26   22    4 o   26.797   5.4709   16.320   6.5069   19.591   8.7710   12.318   9.7039   29.447   7.2662   24.147   8.1808 5.300282 10.94187 
1 1 1   26   22    5 o   77.550   2.9197  126.096   9.3201  123.006   12.723  129.675   13.692   76.560   4.0292   78.540   4.2267 -1.979675 5.839414 
1 1 1   26   22    6 o   65.840   3.7924   94.010   9.8880   85.245   15.965   99.465   12.594   62.983   6.1458   68.698   4.4450 -5.714989 7.584760 
1 1 1   26   22    7 o   62.975   3.9590   87.939   9.7737   71.888   15.556   98.407   12.563   57.646   6.5429   68.305   4.4594 -10.65976 7.918020 
1 1 1   26   22    8 o   69.320   3.6062  103.032   9.8677   98.739   16.322  105.505   12.388   67.856   5.8320   70.784   4.2433 -2.927719 7.212334 
1 1 1   26   22    9 o   32.462   5.7354   25.657   8.0284   14.590   13.384   31.877   10.034   26.515   9.5632   38.408   6.3342 -11.89351 11.47073 
1 1 1   26   22   10 o   95.539   3.1194  192.047   11.775  194.770   19.748  190.544   14.667   95.751   5.0006   95.327   3.7305 0.4238586 6.238786 
1 1 1   26   22   11 o   18.068   5.5190   0.2902   7.5158  -5.3940   12.570   3.4528   9.3764   17.566   7.9767   18.570   7.6295 -1.004751 11.03802 
1 1 1   26   22   12 o   60.656   4.9576   86.117   10.496   69.402   20.119   92.368   12.304   55.262   8.8269   66.050   4.5164 -10.78762 9.915235 
1 1 1   26   22   13 o  109.451   3.1829  255.058   14.156  247.584   21.783  260.521   18.624  107.779   4.9003  111.124   4.0635 -3.344299 6.365885 
1 1 1   26   22   14 o   26.122   5.7539   15.653   6.6674   14.259   11.712   16.321   8.1098   25.576   8.9745   26.667   7.2034 -1.091919 11.50786 
1 1 1   26   22   15 o   51.531   3.8270   58.127   7.5690   54.390   13.126   59.988   9.2644   49.841   6.3853   53.221   4.2205 -3.380642 7.654041 
1 1 1   26   22   16 o  122.102   2.7360  315.035   13.755  306.784   19.867  322.633   19.064  120.470   3.9984  123.735   3.7356 -3.264832 5.471910 
1 1 1   26   22   17 o   21.900   5.8017   7.5350   6.6108   15.046   12.257   4.4537   7.8505   25.978   9.1752   17.822   7.1030 8.156116 11.60332 
1 1 1   26   22   18 o   23.803   5.9813  -1.1792   6.8059   32.588   16.589  -8.0127   7.4629   35.680   10.542   11.926   5.6547 23.75408 11.96261 
1 1 1   26   22   19 o   30.167   5.3552   24.207   7.0007   9.9750   13.200   29.777   8.2577   23.355   9.2411   36.979   5.4142 -13.62451 10.71032 
1 1 1   26   22   20 o   71.729   3.5249  112.042   10.326   97.611   14.888  125.418   14.334   66.966   5.3905   76.492   4.5433 -9.526146 7.049751 
1 1 1   26   22   21 o   42.923   5.6898   41.451   9.6886   28.440   12.489   61.119   15.355   33.983   8.8299   51.863   7.1783 -17.87992 11.37958 
1 1 1   26   22   22 o   17.490   5.5217  -3.1585   8.4149 -10.4940   12.145   3.6139   11.670   15.382   7.2698   19.597   8.3129 -4.214608 11.04334 
1 1 1   26   22   23 o   24.954   6.2376   13.892   8.0819   20.011   12.381   9.3485   10.669   28.200   9.2331   21.707   8.3894 6.493523 12.47525 
1 1 1   26   22   24 o   40.793   5.5861   42.891   9.1491   20.689   13.297   62.849   12.608   28.455   9.5769   53.132   5.7532 -24.67750 11.17211 
1 1 1   26   22   25 o   17.127   5.5381  -4.5141   8.9416 -20.7069   16.579   2.1281   10.618   16.174   7.8598   18.081   7.8043 -1.906406 11.07622 
1 1 1   26   22   26 o   18.078   5.7785  -8.3606   9.2331 -18.9915   11.588   10.120   15.279   12.941   6.3487   23.215   9.6569 -10.27382 11.55690 
1 1 1   26   22   27 o   28.349   5.8350   18.451   10.356   40.302   13.336 -14.7395   16.436   39.805   8.3877   16.893   8.1138 22.91169 11.66993 
1 1 1   26   22   28 o   30.688   7.3498   27.176   11.737   35.277   15.770   17.116   17.573   35.275   10.238   26.101   10.548 9.173918 14.69952 
1 1 1   26   23    0 o  142.751   2.1993  423.228   18.293  423.228   18.293  423.228   18.293  142.751   3.1103  142.751   3.1103 0.000000 0.000000 
1 1 1   26   23    1 o   75.043   2.7797  117.796   8.5079  115.265   11.176  121.284   13.120   74.180   3.6530   75.906   4.1908 -1.726273 5.559388 
1 1 1   26   23    2 o   91.877   2.7645  177.058   10.470  172.237   14.509  182.297   15.124   90.584   3.8834   93.169   3.9358 -2.585495 5.529092 
1 1 1   26   23    3 o  121.673   2.9608  312.189   14.427  313.937   18.373  309.380   23.300  122.422   3.6388  120.924   4.6718 1.498123 5.921669 
1 1 1   26   23    4 o   15.333   4.9122  -4.9867   6.8606  -0.3636   8.8308 -12.0256   10.896   16.326   7.0820   14.340   6.8091 1.986346 9.824354 
1 1 1   26   23    5 o   64.235   3.7319   87.033   9.4934   91.201   15.952   84.747   11.813   65.138   5.9378   63.333   4.5223 1.804810 7.463805 
1 1 1   26   23    6 o   53.568   4.2515   60.915   9.1543   65.585   14.910   58.089   11.598   54.972   6.5759   52.163   5.3907 2.809101 8.503044 
1 1 1   26   23    7 o  105.133   3.5952  235.197   15.567  235.057   21.452  235.353   22.624  105.188   4.9447  105.078   5.2203 0.1099625 7.190365 
1 1 1   26   23    8 o   80.557   3.9042  133.599   11.463  150.932   22.751  127.701   13.271   83.262   6.6250   77.852   4.1330 5.410286 7.808479 
1 1 1   26   23   10 o   34.722   5.6338   30.746   8.2002   15.169   13.657   39.528   10.254   26.661   9.6535   42.784   5.8112 -16.12282 11.26770 
1 1 1   26   23   11 o  110.453   2.9758  256.586   13.127  264.044   21.542  252.182   16.556  111.388   4.6891  109.519   3.6653 1.868996 5.951687 
1 1 1   26   23   12 o   89.493   3.3608  171.403   12.209  166.673   18.853  174.820   16.022   88.147   5.1857   90.839   4.2764 -2.691757 6.721570 
1 1 1   26   23   13 o   20.935   5.3743   8.3028   6.6664  -5.5116   12.594   13.680   7.8576   17.375   7.9265   24.496   7.2596 -7.120148 10.74850 
1 1 1   26   23   14 o   50.372   4.1537   51.771   7.6711   62.992   15.302   48.005   8.8657   53.261   6.9657   47.484   4.5269 5.777481 8.307496 
1 1 1   26   23   15 o   22.816   5.2100   11.725   6.5743  -3.7246   12.041   18.287   7.8472   17.445   7.8753   28.187   6.8231 -10.74274 10.41996 
1 1 1   26   23   16 o   56.529   3.8926   69.831   8.8541   67.729   14.001   71.232   11.430   55.472   6.1196   57.586   4.8123 -2.113682 7.785114 
1 1 1   26   23   17 o   37.364   6.0139   36.031   7.7120   27.684   17.396   38.073   8.6037   32.736   10.954   41.993   4.9676 -9.256649 12.02776 
1 1 1   26   23   18 o   22.328   5.3199   11.047   6.8146  -6.0685   13.073   17.433   7.9853   17.349   7.9744   27.308   7.0436 -9.959240 10.63975 
1 1 1   26   23   19 o   40.151   5.3927   37.260   8.4373   40.886   13.546   34.961   10.785   41.370   8.2287   38.932   6.9723 2.437489 10.78539 
1 1 1   26   23   20 o   61.842   3.7776   84.077   9.5511   73.370   13.684   94.247   13.337   57.703   5.7498   65.980   4.9009 -8.277390 7.555112 
1 1 1   26   23   21 f   18.370   5.7595  -0.4130   8.6869   0.6737   12.136  -1.5548   12.440   18.657   8.1931   18.082   8.0968 0.5749969 11.51893 
1 1 1   26   23   22 o   33.916   6.5528   29.240   9.3997   25.728   12.564   33.706   14.167   31.704   9.1192   36.129   9.4127 -4.424831 13.10568 
1 1 1   26   23   23 o   24.442   5.7439   12.466   8.2632  -3.6844   12.561   24.789   10.972   17.374   7.9220   31.511   8.3195 -14.13718 11.48786 
1 1 1   26   23   24 o   41.466   5.5349   44.754   9.2377   19.097   13.210   69.304   12.923   27.250   9.5331   55.682   5.6269 -28.43141 11.06982 
1 1 1   26   23   25 o   26.366   6.8208   17.490   9.2718   19.102   16.423   16.735   11.233   27.059   10.422   25.672   8.8015 1.387125 13.64161 
1 1 1   26   23   26 o   54.259   5.2856   70.239   11.434   68.401   14.433   73.337   18.736   54.314   6.4431   54.203   8.3806 0.1102600 10.57110 
1 1 1   26   24    0 o  124.464   2.2021  322.073   15.964  322.073   15.964  322.073   15.964  124.464   3.1143  124.464   3.1143 0.000000 0.000000 
1 1 1   26   24    1 o   35.304   4.3486   27.887   6.0007   38.087   8.6127   18.264   8.3654   42.309   4.9357   28.300   7.1611 14.00921 8.697270 
1 1 1   26   24    2 f  104.420   2.6771  229.073   11.525  228.453   16.082  229.727   16.526  104.299   3.7385  104.541   3.8328 -0.2421570 5.354142 
1 1 1   26   24    3 o   52.819   3.8061   59.624   8.2812   63.804   12.009   55.835   11.434   54.598   5.3331   51.040   5.4318 3.557907 7.612254 
1 1 1   26   24    4 o   31.653   5.2186   23.210   6.7046   26.070   9.1481   19.891   9.8549   34.002   6.7613   29.305   7.9512 4.696842 10.43723 
1 1 1   26   24    5 o   80.069   3.4765  138.937   11.077  126.875   17.718  146.677   14.193   76.784   5.5946   83.354   4.1284 -6.570389 6.952959 
1 1 1   26   24    6 o   29.815   6.2527   21.038   8.1451   19.221   13.374   22.110   10.269   28.830   9.6041   30.800   8.0090 -1.969294 12.50530 
1 1 1   26   24    7 o  120.229   2.9605  304.281   14.148  311.046   23.446  300.407   17.743  120.884   4.7026  119.574   3.5977 1.310318 5.920942 
1 1 1   26   24    8 o   40.695   5.4257   38.313   8.5443   35.159   13.971   40.197   10.799   38.407   8.9805   42.984   6.0914 -4.576462 10.85150 
1 1 1   26   24    9 o   68.611   3.7548  102.125   10.312   97.022   16.447  105.430   13.236   66.817   5.9680   70.405   4.5582 -3.587875 7.509587 
1 1 1   26   24   10 o   96.812   3.4018  200.482   13.552  194.833   19.666  205.591   18.701   95.379   4.9991   98.246   4.6151 -2.867638 6.803694 
1 1 1   26   24   11 o   54.785   4.9532   66.184   11.101   55.600   15.084   78.689   16.396   49.851   7.3364   59.719   6.6568 -9.868576 9.906338 
1 1 1   26   24   12 o   36.348   5.8897   32.291   8.8048   23.534   13.845   38.238   11.409   31.111   9.7215   41.586   6.6518 -10.47503 11.77939 
1 1 1   26   24   13 o   68.480   3.4932   98.973   8.8805  105.042   16.863   96.643   10.446   69.318   5.8983   67.643   3.7444 1.674599 6.986481 
1 1 1   26   24   14 o   18.534   5.5483  -0.1691   6.4809   10.523   13.134  -3.6107   7.4514   23.643   9.2606   13.425   6.1138 10.21762 11.09670 
1 1 1   26   24   15 o   15.024   4.8845  -4.7941   6.2133  -1.8256   11.586  -5.9924   7.3613   17.605   7.8536   12.442   5.8099 5.163096 9.769037 
1 1 1   26   24   16 o   42.907   5.0642   44.042   8.1257   35.696   13.410   48.884   10.214   38.344   8.6815   47.470   5.2170 -9.126339 10.12849 
1 1 1   26   24   17 o   84.454   3.5849  159.264   10.606  144.534   21.040  164.282   12.280   80.629   6.3269   88.280   3.3727 -7.650932 7.169727 
1 1 1   26   24   18 o   71.167   3.2424  106.195   8.8594  116.734   16.010  101.543   10.636   73.146   5.3067   69.188   3.7273 3.957771 6.484898 
1 1 1   26   24   19 o   25.223   6.0764   12.086   8.2067   25.930   12.863   2.5819   10.658   31.956   9.2377   18.490   7.8965 13.46588 12.15279 
1 1 1   26   24   20 o  110.541   2.8846  261.998   13.124  241.128   18.436  283.437   18.685  105.930   4.2197  115.152   3.9343 -9.221802 5.769272 
1 1 1   26   24   21 o   55.745   4.0662   69.114   9.2686   69.860   14.059   68.540   12.327   55.741   6.1153   55.749   5.3609 -0.8022308E-02 8.132395 
1 1 1   26   24   22 o   58.429   4.5477   78.838   10.766   88.049   14.647   68.011   15.880   62.829   5.6522   54.030   7.1260 8.798443 9.095487 
1 1 1   26   24   23 o   23.040   6.5704   10.748   9.5263   9.7591   12.536   12.099   14.655   22.213   8.9332   23.867   9.6373 -1.653706 13.14079 
1 1 1   26   24   24 o   78.137   3.5085  135.129   11.292  128.760   16.056  141.363   15.885   76.151   5.1120   80.122   4.8069 -3.971008 7.017044 
1 1 1   26   24   25 o   23.121   7.0013   8.8691   12.026   4.0922   17.044   13.606   16.972   21.560   9.5772   24.683   10.215 -3.123384 14.00267 
1 1 1   26   25    0 o   38.113   4.3549   32.931   8.9231   32.931   8.9231   32.931   8.9231   38.113   6.1587   38.113   6.1587 0.000000 0.000000 
1 1 1   26   25    1 o   70.514   2.6519  104.702   7.7116  106.843   10.945  102.592   10.867   71.240   3.7251   69.789   3.7753 1.451118 5.303730 
1 1 1   26   25    2 o  131.496   2.9826  360.895   15.896  393.989   25.338  339.419   20.412  136.147   4.5124  126.845   3.9016 9.302216 5.965248 
1 1 1   26   25    3 o  104.525   2.5544  230.637   10.941  220.917   16.214  238.764   14.825  102.364   3.8405  106.687   3.3692 -4.323540 5.108845 
1 1 1   26   25    5 o   65.499   3.8515   94.599   9.9829   83.855   15.995  101.454   12.777   61.921   6.2630   69.077   4.4846 -7.155499 7.703022 
1 1 1   26   25    6 o   68.823   3.6511   98.118   10.134  119.707   16.602   85.299   12.793   74.511   5.4024   63.136   4.9128 11.37519 7.302163 
1 1 1   26   25    7 o   28.368   5.9332   19.986   7.8270   9.9680   13.583   24.966   9.5768   23.834   9.3921   32.902   7.2525 -9.068388 11.86639 
1 1 1   26   25    8 o   61.466   3.9873   83.402   9.5216   76.963   16.053   86.896   11.826   59.051   6.5913   63.881   4.4887 -4.829582 7.974542 
1 1 1   26   25    9 o   30.486   5.5140   23.752   7.9932   6.3882   13.493   33.141   9.9216   22.114   9.1265   38.859   6.1905 -16.74511 11.02793 
1 1 1   26   25   10 o   60.827   4.0778   83.297   9.5686   72.366   16.024   89.355   11.929   56.955   6.8213   64.699   4.4704 -7.743900 8.155621 
1 1 1   26   25   11 o   25.545   6.2739   15.076   8.1030   11.506   13.407   17.130   10.171   24.214   9.3918   26.876   8.3212 -2.662107 12.54788 
1 1 1   26   25   12 o   20.714   5.5453   0.7539   6.5936   20.107   12.755  -6.3044   7.7027   28.731   9.3698   12.696   5.9335 16.03444 11.09052 
1 1 1   26   25   13 o   33.822   5.6305   23.045   7.1008   39.701   13.981   17.255   8.2431   40.533   8.6279   27.111   7.2366 13.42148 11.26099 
1 1 1   26   25   14 o   43.719   4.6438   39.174   7.5312   51.277   14.916   35.032   8.7251   47.278   7.6493   40.159   5.2677 7.118683 9.287656 
1 1 1   26   25   15 o   54.439   4.8193   72.281   9.2489   53.298   15.996   81.815   11.336   47.090   8.5509   61.788   4.4482 -14.69776 9.638679 
1 1 1   26   25   16 o  105.536   3.4367  259.479   12.986  199.102   23.685  285.428   15.527   94.690   6.0646  116.382   3.2348 -21.69230 6.873358 
1 1 1   26   25   17 o   49.246   4.7010   59.613   8.0643   44.397   14.240   66.798   9.7845   42.695   8.3859   55.798   4.2516 -13.10343 9.402083 
1 1 1   26   25   18 o   24.620   5.7426   15.102   7.0598   6.5545   13.096   18.604   8.3821   21.387   8.9221   27.854   7.2323 -6.467022 11.48516 
1 1 1   26   25   19 o   62.813   4.3626   88.945   11.077   89.619   14.394   87.965   17.348   63.660   5.4822   61.966   6.7878 1.694485 8.725141 
1 1 1   26   25   20 o   21.551   6.2071   6.6253   9.1908   14.251   12.643  -1.9211   13.384   24.709   9.2287   18.393   8.3033 6.316053 12.41425 
1 1 1   26   25   21 o   14.044   4.7683 -17.9016   8.0347  -1.9523   12.158 -30.2695   10.706   17.497   7.9047   10.592   5.3351 6.904383 9.536689 
1 1 1   26   25   22 o   72.154   4.3222  120.493   12.278  125.447   15.522  112.209   20.070   75.329   4.9958   68.978   7.0547 6.351028 8.644461 
1 1 1   26   25   23 o   29.226   6.9996   22.713   10.078   17.017   13.255   30.517   15.514   25.718   9.4800   32.734   10.301 -7.016008 13.99919 
1 1 1   26   26    0 o   50.779   3.2801   55.411   9.5288   55.411   9.5288   55.411   9.5288   50.779   4.6388   50.779   4.6388 0.000000 0.000000 
1 1 1   26   26    1 o   18.586   5.0623   5.5212   5.5852   2.7389   7.9547   8.2265   7.8438   16.911   6.9958   20.261   7.3191 -3.349665 10.12469 
1 1 1   26   26    2 o  118.577   2.9093  296.172   13.079  303.460   23.811  293.024   15.651  118.972   4.8524  118.181   3.2110 0.7908630 5.818646 
1 1 1   26   26    3 o   33.719   5.5747   24.444   7.0132   33.254   13.393   21.116   8.2321   37.113   8.8702   30.325   6.7548 6.787806 11.14939 
1 1 1   26   26    4 o   57.333   3.9536   72.332   8.3172   69.287   15.631   73.534   9.8232   55.779   6.7944   58.886   4.0446 -3.107773 7.907150 
1 1 1   26   26    5 o   33.848   5.9669   28.342   8.2454   23.308   13.475   31.355   10.425   30.808   9.5848   36.889   7.1097 -6.081190 11.93380 
1 1 1   26   26    6 o   51.259   4.6634   60.523   9.1960   51.492   15.315   65.615   11.500   47.383   7.8366   55.134   5.0572 -7.751408 9.326707 
1 1 1   26   26    7 f   44.903   4.9732   40.763   8.5099   64.892   15.409   30.173   10.208   53.715   6.9551   36.092   7.1103 17.62276 9.946374 
1 1 1   26   26    8 o   61.267   4.5380   86.596   10.138   75.674   18.634   91.189   12.083   57.277   7.8879   65.256   4.4895 -7.978989 9.076061 
1 1 1   26   26    9 o   16.879   5.5052  -4.5897   7.8859  -6.5724   15.515  -3.8991   9.1569   18.832   8.6676   14.927   6.7898 3.904846 11.01042 
1 1 1   26   26   10 o   23.468   5.6119   11.443   7.5481  -1.9668   12.026   20.159   9.6955   17.874   7.9854   29.062   7.8872 -11.18804 11.22379 
1 1 1   26   26   11 o   18.231   5.4569  -1.1369   7.1829   10.017   11.921  -7.4943   9.0001   22.862   8.8592   13.599   6.3739 9.263651 10.91383 
1 1 1   26   26   12 o   83.790   3.4185  161.253   10.449  127.826   18.731  176.354   12.590   76.103   5.9674   91.476   3.3369 -15.37285 6.837028 
1 1 1   26   26   13 o   21.517   5.8416   9.1155   6.9087   4.0900   14.010   10.730   7.9414   21.133   9.0402   21.901   7.4008 -0.7681770 11.68324 
1 1 1   26   26   14 o   67.562   3.7156  101.104   9.0679   96.573   17.421  102.788   10.620   65.548   6.4440   69.575   3.7008 -4.027260 7.431132 
1 1 1   26   26   15 o   38.978   6.7037   42.748   9.2871   29.629   22.374   45.478   10.208   32.517   12.251   45.439   5.4468 -12.92204 13.40736 
1 1 1   26   26   16 o   92.604   4.5261  199.665   13.844  182.352   29.455  204.573   15.684   87.350   8.1757   97.858   3.8860 -10.50793 9.052248 
1 1 1   26   26   17 o   55.345   3.9364   70.955   8.1010   59.515   14.257   76.409   9.8446   50.962   6.7830   59.728   3.9963 -8.766666 7.872722 
1 1 1   26   26   18 o   31.460   5.7658   24.530   7.0868   24.435   13.310   24.568   8.3722   30.522   9.5307   32.397   6.4918 -1.874676 11.53160 
1 1 1   26   26   19 o   83.253   3.2688  151.377   11.203  141.716   15.884  160.939   15.803   80.441   4.7877   86.064   4.4518 -5.622932 6.537635 
1 1 1   26   26   20 o   37.530   5.6115   36.423   8.5191   25.391   12.923   44.903   11.329   30.776   9.3533   44.285   6.2027 -13.50899 11.22309 
1 1 1   26   26   21 o   47.359   5.0884   55.647   9.1162   37.763   13.315   71.430   12.508   38.239   8.6451   56.479   5.3693 -18.23967 10.17684 
1 1 1   26   26   22 o   15.290   5.0803  -7.8319   8.2231 -11.8040   12.284  -4.6064   11.069   14.805   7.0850   15.776   7.2828 -0.9716587 10.16051 
1 1 1   26   27    0 o   12.167   5.3689   2.4622   7.7734   2.4622   7.7734   2.4622   7.7734   12.167   7.5928   12.167   7.5928 0.000000 0.000000 
1 1 1   26   27    1 o   57.453   3.5283   74.326   7.8353   60.853   12.827   82.346   9.8962   52.592   5.9134   62.314   3.8505 -9.721500 7.056581 
1 1 1   26   27    2 o   38.204   5.1985   29.850   7.1645   44.950   14.243   24.736   8.2896   43.462   8.2476   32.947   6.3304 10.51484 10.39694 
1 1 1   26   27    3 o   21.784   5.8981   7.5377   6.8100   14.455   12.884   4.8561   8.0221   25.507   9.3549   18.060   7.1857 7.447845 11.79611 
1 1 1   26   27    4 o   78.634   3.3914  137.312   9.8127  122.985   18.043  143.330   11.693   74.825   5.8465   82.444   3.4388 -7.619171 6.782833 
1 1 1   26   27    5 o   63.011   3.7127   84.341   8.7586   90.731   16.435   81.806   10.351   64.002   6.2258   62.021   4.0466 1.981789 7.425342 
1 1 1   26   27    6 o   60.351   3.9808   83.580   8.5764   70.963   16.190   88.502   10.112   56.080   6.9997   64.623   3.7938 -8.542252 7.961679 
1 1 1   26   27    7 o   21.554   5.8873   8.4784   7.2556   10.088   11.759   7.4890   9.2198   22.823   8.8114   20.285   7.8104 2.538427 11.77466 
1 1 1   26   27    8 o   64.249   3.5486   88.733   9.2714   93.149   14.498   85.677   12.060   65.366   5.3775   63.132   4.6316 2.234520 7.097104 
1 1 1   26   27    9 o   26.361   5.3580   15.296   7.7834  -2.8917   11.752   29.506   10.388   17.298   7.7973   35.425   7.3508 -18.12701 10.71597 
1 1 1   26   27   10 o   19.522   5.6989   2.2427   7.6840   11.707   12.010  -4.3158   9.9979   23.612   8.9568   15.432   7.0487 8.179898 11.39776 
1 1 1   26   27   11 o   27.127   5.4921   19.094   6.9064   8.6186   12.198   24.036   8.3787   22.049   8.8314   32.205   6.5314 -10.15621 10.98417 
1 1 1   26   27   12 o   31.342   5.3638   26.347   7.0375   13.672   12.865   31.760   8.4069   24.676   9.2910   38.009   5.3627 -13.33322 10.72761 
1 1 1   26   27   13 o   34.633   5.7644   25.418   7.3506   40.724   14.640   20.259   8.4997   40.149   9.0567   29.118   7.1336 11.03068 11.52871 
1 1 1   26   27   14 o   61.449   4.0724   82.253   9.6073   89.206   17.249   79.126   11.568   62.498   6.6915   60.400   4.6436 2.098125 8.144871 
1 1 1   26   27   15 o   19.582   5.8772   4.3853   8.1351 -25.0771   21.344   9.3928   8.7993   18.196   8.8596   20.968   7.7247 -2.771454 11.75431 
1 1 1   26   27   16 o   45.698   5.0251   46.345   7.8894   54.778   16.288   43.760   9.0178   46.696   8.7796   44.701   4.8913 1.994839 10.05019 
1 1 1   26   27   17 o   43.156   6.6905   47.070   8.8027   50.771   22.620   46.410   9.5560   40.453   12.391   45.858   5.0523 -5.405018 13.38106 
1 1 1   26   27   18 o   40.907   6.4084   48.032   10.717   28.691   17.922   58.797   13.370   31.337   11.092   50.478   6.4221 -19.14055 12.81684 
1 1 1   26   27   19 o   90.915   3.2283  180.868   12.085  167.373   16.838  195.206   17.356   87.289   4.6771   94.541   4.4510 -7.251999 6.456538 
1 1 1   26   27   20 o   29.852   6.1610   24.179   8.5409   15.377   13.034   30.802   11.306   24.817   9.3505   34.887   8.0248 -10.07057 12.32190 
1 1 1   26   28    0 o   56.928   3.7092   70.326   12.076   70.326   12.076   70.326   12.076   56.928   5.2456   56.928   5.2456 0.000000 0.000000 
1 1 1   26   28    1 o   21.837   5.6266   9.7154   6.2938   11.670   10.881   8.7325   7.7156   23.302   8.5891   20.373   7.2705 2.929167 11.25314 
1 1 1   26   28    2 o   31.317   5.6860   18.588   6.8463   38.574   13.808   12.073   7.8836   39.723   8.6712   22.912   7.3575 16.81055 11.37207 
1 1 1   26   28    3 o   83.945   3.1482  147.421   9.8698  160.699   18.681  142.279   11.625   85.827   5.2772   82.063   3.4346 3.764664 6.296469 
1 1 1   26   28    4 f   28.248   5.9825   19.404   7.0736   18.256   13.772   19.815   8.2441   27.468   9.7231   29.028   6.9731 -1.560324 11.96508 
1 1 1   26   28    5 o   95.948   3.0735  194.921   11.190  204.332   20.426  190.886   13.376   96.864   5.1127   95.031   3.4126 1.833229 6.147031 
1 1 1   26   28    6 o   36.748   5.1091   31.210   7.0082   32.177   12.695   30.786   8.4051   36.056   8.6478   37.440   5.4430 -1.384224 10.21819 
1 1 1   26   28    7 o   68.973   3.1376   99.938   8.4644  110.547   14.774   94.753   10.327   71.212   5.0299   66.733   3.7522 4.479256 6.275295 
1 1 1   26   28    8 f   18.128   5.3769   1.0657   6.2850   10.134   11.812  -2.5163   7.4232   22.544   8.7954   13.712   6.1876 8.831738 10.75386 
1 1 1   26   28    9 o   18.696   5.4279   4.9524   6.5206   1.7802   11.604   6.4161   7.8827   18.671   8.1087   18.721   7.2180 -0.4985046E-01 10.85590 
1 1 1   26   28   10 o   17.393   5.3175   1.1684   6.3386   4.7175   11.956  -0.2193   7.4758   20.038   8.4523   14.749   6.4547 5.289412 10.63505 
1 1 1   26   28   11 o   58.188   3.6234   76.547   8.0697   67.066   13.740   81.539   9.9706   54.628   6.0982   61.748   3.9150 -7.120110 7.246751 
1 1 1   26   28   12 o   23.567   5.7540   10.211   6.5405   21.762   12.033   5.3677   7.7921   29.168   9.0546   17.966   7.1028 11.20236 11.50807 
1 1 1   26   28   13 o   29.948   5.4475   23.671   7.0057   14.260   12.667   27.818   8.4089   24.657   9.2319   35.239   5.7856 -10.58257 10.89502 
1 1 1   26   28   14 o   75.459   4.1739  138.707   11.252  102.913   20.107  155.028   13.577   65.925   7.3950   84.993   3.8732 -19.06738 8.347896 
1 1 1   26   28   15 f   41.796   5.6392   52.426   8.2689   24.486   15.708   63.137   9.7254   29.702   10.395   53.890   4.3756 -24.18814 11.27833 
1 1 1   26   28   16 o   52.880   4.2729   62.168   8.2551   67.544   16.022   60.225   9.6321   53.222   7.2988   52.539   4.4450 0.6826515 8.545828 
1 1 1   26   28   17 o   25.917   6.2515   14.745   7.1442   24.943   14.447   11.444   8.2195   29.916   9.9828   21.918   7.5279 7.997887 12.50302 
1 1 1   26   28   18 o   51.431   5.1073   64.316   9.8858   59.725   16.557   66.859   12.323   48.347   8.6195   54.514   5.4810 -6.167000 10.21457 
1 1 1   26   29    0 o   19.375   7.1069   12.823   10.396   12.823   10.396   12.823   10.396   19.375   10.051   19.375   10.051 0.000000 0.000000 
1 1 1   26   29    1 o   53.387   3.8762   63.030   8.5214   66.647   12.025   59.382   12.078   55.044   5.2966   51.729   5.6609 3.315979 7.752402 
1 1 1   26   29    2 o   37.651   5.3229   32.774   7.3443   35.754   13.906   31.621   8.6488   37.504   9.0861   37.798   5.5478 -0.2943001 10.64589 
1 1 1   26   29    3 o   39.271   5.5102   41.739   7.6159   26.809   14.630   47.289   8.9198   31.837   10.000   46.706   4.6304 -14.86902 11.02040 
1 1 1   26   29    4 o   40.575   5.2937   38.246   7.6845   40.527   14.783   37.402   8.9954   39.921   9.1711   41.229   5.2899 -1.308815 10.58739 
1 1 1   26   29    5 o   22.823   5.8121   12.068   7.0715   3.9774   13.895   14.896   8.2148   20.732   8.9384   24.914   7.4317 -4.181610 11.62430 
1 1 1   26   29    6 o  100.341   2.7368  218.978   11.013  195.559   17.135  235.461   14.375   95.212   4.3635  105.470   3.3047 -10.25771 5.473630 
1 1 1   26   29    7 o   45.337   4.2714   46.830   7.3879   44.080   12.888   48.176   9.0163   43.567   7.1723   47.106   4.6407 -3.538578 8.542705 
1 1 1   26   29    8 f   50.760   4.0749   60.459   7.8553   47.894   13.044   67.610   9.8396   45.520   6.9476   56.000   4.2601 -10.48000 8.149749 
1 1 1   26   29    9 o   22.911   5.7991   11.817   6.5964   12.825   11.896   11.370   7.9265   23.743   8.9356   22.079   7.3942 1.663546 11.59823 
1 1 1   26   29   10 o   27.797   5.5357   20.615   6.8177   12.112   12.451   24.256   8.1478   23.414   9.0591   32.179   6.3645 -8.764818 11.07136 
1 1 1   26   29   11 f   36.211   5.1548   28.932   7.0638   41.693   12.696   23.210   8.5010   41.278   7.7420   31.144   6.8080 10.13345 10.30954 
1 1 1   26   29   12 o   61.919   3.5539   87.015   8.4585   77.455   14.343   92.112   10.474   58.398   5.9551   65.440   3.8805 -7.041687 7.107800 
1 1 1   26   29   13 o   23.842   5.8993   11.339   6.7893   22.385   12.547   6.7654   8.0734   28.927   9.2812   18.758   7.2845 10.16927 11.79853 
1 1 1   26   29   14 o   33.392   5.8205   34.314   9.0912   8.1883   17.930   43.355   10.548   23.121   10.060   43.663   5.8571 -20.54198 11.64095 
1 1 1   26   29   15 o   16.758   5.2113   1.2309   6.6469  -4.5479   12.747   3.3890   7.7898   16.923   7.8132   16.593   6.8981 0.3304501 10.42263 
1 1 1   26   30    0 o   91.214   2.8369  176.166   15.027  176.166   15.027  176.166   15.027   91.214   4.0120   91.214   4.0120 0.000000 0.000000 
1 1 1   26   30    1 o   22.952   5.8515   11.563   7.4697   5.2751   10.712   17.514   10.421   19.465   8.0906   26.440   8.4559 -6.974360 11.70301 
1 1 1   26   30    2 o   56.215   4.1354   71.671   9.4184   66.804   14.374   75.333   12.468   54.022   6.4514   58.408   5.1754 -4.385960 8.270735 
1 1 1   26   30    3 f   35.810   5.2822   28.802   7.1674   39.204   12.833   24.085   8.6408   39.810   8.0912   31.810   6.7925 7.999876 10.56440 
1 1 1   26   30    4 o   42.768   5.1249   43.207   7.8560   43.874   14.733   42.942   9.2865   41.430   8.8880   44.106   5.1049 -2.675503 10.24976 
1 1 1   26   30    5 o   50.667   4.5884   65.300   8.0826   41.451   13.358   79.075   10.152   40.767   8.2280   60.566   4.0640 -19.79849 9.176901 
1 1 1   26   30    6 o   21.652   5.6956   7.5479   6.5182   18.696   11.997   2.8792   7.7641   26.913   9.0965   16.392   6.8567 10.52077 11.39129 
1 1 1   26   30    7 o   16.570   5.1908  -0.2088   6.5629   2.5176   11.636  -1.4807   7.9477   18.671   8.1141   14.469   6.4759 4.201627 10.38151 
1 1 1   26   30    8 o   66.236   3.4134   99.822   8.8409   83.576   14.200  110.105   11.298   60.905   5.6529   71.567   3.8274 -10.66171 6.826763 
1 1 1   26   30    9 f   34.825   5.3217   28.076   7.0671   36.406   12.494   24.157   8.5699   37.937   8.2222   31.713   6.7586 6.223753 10.64343 
1 1 1   26   30   10 o   41.205   4.8947   41.751   7.4358   35.923   12.743   44.760   9.1563   37.429   8.4543   44.982   4.9354 -7.553070 9.789466 
1 1 1   26   30   11 o   59.806   3.7826   83.980   8.5002   68.445   14.523   92.075   10.483   54.268   6.4886   65.345   3.8898 -11.07736 7.565198 
1 1 1   26   30   12 o   49.533   4.2451   57.625   7.8894   51.491   13.881   60.551   9.5887   46.410   7.2519   52.655   4.4152 -6.245075 8.490228 
1 1 1   26   31    0 o   12.622   5.8134   0.8790   10.366   0.8790   10.366   0.8790   10.366   12.622   8.2213   12.622   8.2213 0.000000 0.000000 
1 1 1   26   31    1 o   19.708   5.7312   6.3896   7.4920   6.3615   10.615   6.4175   10.576   19.703   8.1091   19.713   8.1012 -0.9185791E-02 11.46241 
1 1 1   26   31    2 o   19.104   5.6380   3.2983   8.0775  -7.2927   12.325   11.271   10.694   15.932   7.4649   22.276   8.4513 -6.343981 11.27601 
1 1 1   26   31    3 o   35.054   5.9769   31.313   8.4268   33.727   13.250   29.673   10.920   35.733   8.9962   34.375   7.8717 1.357742 11.95390 
1 1 1   26   31    4 o   49.813   4.7684   58.553   9.6853   53.715   14.319   62.634   13.149   47.357   7.3311   52.268   6.0997 -4.910645 9.536852 
1 1 1   26   31    5 o   18.585   5.1401   5.2307   6.5787  -9.0287   11.771   11.709   7.9334   15.087   7.1386   22.083   7.3974 -6.995989 10.28015 
1 1 1   26   31    6 o   46.280   4.7844   54.298   7.7832   40.001   13.461   61.479   9.5397   39.462   8.5197   53.099   4.3560 -13.63665 9.568726 
1 1 1   26   31    7 o   27.388   5.7719   20.072   7.1708   14.074   12.458   23.044   8.7689   24.075   9.1247   30.701   7.0710 -6.626242 11.54378 
1 1 1   27    0    1 o   35.327   5.1665   28.954   9.3962   28.954   9.3962   28.954   9.3962   35.327   7.3066   35.327   7.3066 0.000000 0.000000 
1 1 1   27    0    2 o   42.277   4.1495   39.095   9.6694   39.095   9.6694   39.095   9.6694   42.277   5.8683   42.277   5.8683 0.000000 0.000000 
1 1 1   27    0    3 o  108.021   2.3027  241.651   14.479  241.651   14.479  241.651   14.479  108.021   3.2565  108.021   3.2565 0.000000 0.000000 
1 1 1   27    0    4 o  105.558   2.3333  230.817   14.334  230.817   14.334  230.817   14.334  105.558   3.2998  105.558   3.2998 0.000000 0.000000 
1 1 1   27    0    5 o   92.581   2.7207  178.054   14.634  178.054   14.634  178.054   14.634   92.581   3.8476   92.581   3.8476 0.000000 0.000000 
1 1 1   27    0    6 o   13.568   5.8259   3.5504   8.5806   3.5504   8.5806   3.5504   8.5806   13.568   8.2390   13.568   8.2390 0.000000 0.000000 
1 1 1   27    0    7 o  151.580   2.1992  475.117   19.425  475.117   19.425  475.117   19.425  151.580   3.1101  151.580   3.1101 0.000000 0.000000 
1 1 1   27    0    8 o   16.189   6.7297   6.3782   10.766   6.3782   10.766   6.3782   10.766   16.189   9.5173   16.189   9.5173 0.000000 0.000000 
1 1 1   27    0    9 f   46.503   6.4319   49.886   15.537   49.886   15.537   49.886   15.537   46.503   9.0961   46.503   9.0961 0.000000 0.000000 
1 1 1   27    0   10 o  188.692   3.2849  738.559   36.104  738.559   36.104  738.559   36.104  188.692   4.6455  188.692   4.6455 0.000000 0.000000 
1 1 1   27    0   11 o   22.199   7.2760   15.100   10.420   15.100   10.420   15.100   10.420   22.199   10.290   22.199   10.290 0.000000 0.000000 
1 1 1   27    0   12 o   17.143   6.3608   8.9525   8.4001   8.9525   8.4001   8.9525   8.4001   17.143   8.9955   17.143   8.9955 0.000000 0.000000 
1 1 1   27    0   13 o   12.214   5.4872   1.0620   8.5256   1.0620   8.5256   1.0620   8.5256   12.214   7.7601   12.214   7.7601 0.000000 0.000000 
1 1 1   27    0   14 o  207.847   2.3006  893.887   27.876  893.887   27.876  893.887   27.876  207.847   3.2536  207.847   3.2536 0.000000 0.000000 
1 1 1   27    0   15 o   76.415   2.6243  121.714   11.634  121.714   11.634  121.714   11.634   76.415   3.7114   76.415   3.7114 0.000000 0.000000 
1 1 1   27    0   16 o  228.924   2.3725  1084.98   31.664  1084.98   31.664  1084.98   31.664  228.924   3.3552  228.924   3.3552 0.000000 0.000000 
1 1 1   27    0   17 o  100.223   2.3668  208.522   13.801  208.522   13.801  208.522   13.801  100.223   3.3472  100.223   3.3472 0.000000 0.000000 
1 1 1   27    0   18 o   27.176   6.1112   19.486   8.5287   19.486   8.5287   19.486   8.5287   27.176   8.6425   27.176   8.6425 0.000000 0.000000 
1 1 1   27    0   19 o   12.785   5.8209   0.3998   9.9969   0.3998   9.9969   0.3998   9.9969   12.785   8.2320   12.785   8.2320 0.000000 0.000000 
1 1 1   27    0   20 o   76.674   3.1766  123.450   14.095  123.450   14.095  123.450   14.095   76.674   4.4924   76.674   4.4924 0.000000 0.000000 
1 1 1   27    0   21 o   10.322   5.1991 -18.9206   13.738 -18.9206   13.738 -18.9206   13.738   10.322   7.3526   10.322   7.3526 0.000000 0.000000 
1 1 1   27    0   22 o   43.611   5.7095   43.909   13.059   43.909   13.059   43.909   13.059   43.611   8.0745   43.611   8.0745 0.000000 0.000000 
1 1 1   27    0   23 o   53.291   4.1713   61.507   12.560   61.507   12.560   61.507   12.560   53.291   5.8990   53.291   5.8990 0.000000 0.000000 
1 1 1   27    0   24 o   49.931   4.4181   54.673   12.322   54.673   12.322   54.673   12.322   49.931   6.2481   49.931   6.2481 0.000000 0.000000 
1 1 1   27    0   25 o   41.118   5.6101   39.421   12.011   39.421   12.011   39.421   12.011   41.118   7.9338   41.118   7.9338 0.000000 0.000000 
1 1 1   27    0   26 o   26.185   8.3842   21.765   13.802   21.765   13.802   21.765   13.802   26.185   11.857   26.185   11.857 0.000000 0.000000 
1 1 1   27    0   27 o  105.534   2.9309  233.077   17.978  233.077   17.978  233.077   17.978  105.534   4.1449  105.534   4.1449 0.000000 0.000000 
1 1 1   27    0   28 o   27.107   7.6290   21.987   11.658   21.987   11.658   21.987   11.658   27.107   10.789   27.107   10.789 0.000000 0.000000 
1 1 1   27    0   29 o   13.415   6.3233  -2.8516   13.431  -2.8516   13.431  -2.8516   13.431   13.415   8.9425   13.415   8.9425 0.000000 0.000000 
1 1 1   27    0   30 o   39.756   6.3625   38.745   12.867   38.745   12.867   38.745   12.867   39.756   8.9980   39.756   8.9980 0.000000 0.000000 
1 1 1   27    0   31 o   23.593   9.1504   19.371   18.093   19.371   18.093   19.371   18.093   23.593   12.941   23.593   12.941 0.000000 0.000000 
1 1 1   27    0   32 o   56.511   7.9125   79.326   23.179   79.326   23.179   79.326   23.179   56.511   11.190   56.511   11.190 0.000000 0.000000 
1 1 1   27    0   33 o   13.797   6.8286 -16.2416   20.521 -16.2416   20.521 -16.2416   20.521   13.797   9.6571   13.797   9.6571 0.000000 0.000000 
1 1 1   27    0   34 o   54.816   8.0784   76.504   22.771   76.504   22.771   76.504   22.771   54.816   11.425   54.816   11.425 0.000000 0.000000 
1 1 1   27    1    0 o   12.782   5.6280   2.1693   8.4956   2.1693   8.4956   2.1693   8.4956   12.782   7.9592   12.782   7.9592 0.000000 0.000000 
1 1 1   27    1    1 o  114.187   2.2784  269.676   10.730  271.376   15.174  267.976   15.175  114.548   3.2117  113.826   3.2324 0.7219620 4.556706 
1 1 1   27    1    2 o   40.062   4.0949   33.413   6.7661   33.458   9.5697   33.369   9.5678   40.089   5.7878   40.035   5.7944 0.5393982E-01 8.189856 
1 1 1   27    1    3 o  209.597   2.2973  907.897   19.850  934.985   28.619  882.786   27.555  212.604   3.2638  206.589   3.2339 6.014236 4.594614 
1 1 1   27    1    4 o   45.544   3.6429   43.412   6.7699   36.224   9.5828   50.573   9.5653   41.724   5.5685   49.363   4.6982 -7.639107 7.285715 
1 1 1   27    1    5 o  164.315   2.2076  558.305   14.960  550.531   21.023  566.280   21.294  163.156   3.1241  165.474   3.1200 -2.317963 4.415251 
1 1 1   27    1    6 o   91.703   2.4427  174.056   9.2366  178.605   13.074  169.523   13.051   92.903   3.4121   90.503   3.4963 2.400490 4.885356 
1 1 1   27    1    7 o   84.226   2.5201  146.868   8.7536  147.812   12.318  145.905   12.442   84.502   3.5342   83.950   3.5935 0.5523148 5.040224 
1 1 1   27    1    8 o  161.643   2.9415  536.942   19.057  562.018   31.151  521.944   24.091  164.536   4.5904  158.750   3.6794 5.785767 5.882967 
1 1 1   27    1    9 o  195.003   3.2630  789.944   26.243  789.141   37.007  790.756   37.220  194.907   4.6036  195.099   4.6255 -0.1924591 6.525976 
1 1 1   27    1   10 o   92.421   3.6379  177.910   13.864  182.891   19.689  173.011   19.526   93.713   5.0939   91.129   5.1950 2.584320 7.275717 
1 1 1   27    1   11 o   86.169   2.6622  153.472   9.3632  150.340   12.326  157.745   14.398   85.167   3.5089   87.172   4.0045 -2.005531 5.324327 
1 1 1   27    1   12 o   22.540   5.3177   9.3103   6.1478   15.345   8.8274   3.6270   8.5669   26.620   7.6402   18.460   7.3986 8.159161 10.63544 
1 1 1   27    1   13 o   93.185   2.4029  179.985   9.2338  175.672   12.961  184.431   13.159   92.049   3.4138   94.320   3.3825 -2.271423 4.805799 
1 1 1   27    1   14 o  175.899   2.2271  641.117   16.155  648.221   23.071  634.282   22.629  176.852   3.1630  174.947   3.1362 1.904541 4.454219 
1 1 1   27    1   15 o   22.322   5.3162   9.0730   6.1826   15.231   8.8025   3.0777   8.6858   26.448   7.6407   18.196   7.3939 8.252293 10.63247 
1 1 1   27    1   16 o   98.920   2.3549  203.168   9.6032  195.893   13.581  210.444   13.581   97.137   3.3898  100.703   3.2699 -3.566620 4.709850 
1 1 1   27    1   17 o  133.118   2.2226  367.568   12.203  363.533   17.216  371.641   17.299  132.382   3.1530  133.855   3.1334 -1.472900 4.445229 
1 1 1   27    1   18 o   74.190   2.6282  114.402   8.0384  109.692   11.230  119.350   11.511   72.619   3.7495   75.760   3.6839 -3.140785 5.256395 
1 1 1   27    1   19 o   99.648   2.6076  206.096   10.431  209.881   16.870  203.754   13.272  100.277   4.0790   99.019   3.2497 1.257339 5.215251 
1 1 1   27    1   20 o   48.279   4.3329   49.959   8.4259   63.230   12.086   37.408   11.753   54.743   5.3527   41.815   6.8150 12.92876 8.665780 
1 1 1   27    1   21 o   85.233   4.3306  151.179   14.929  138.702   19.026  171.170   24.083   80.927   5.7001   89.539   6.5212 -8.611816 8.661198 
1 1 1   27    1   22 o   47.913   5.0841   50.949   9.4154   35.131   13.185   67.409   13.450   39.453   8.3624   56.372   5.7848 -16.91813 10.16829 
1 1 1   27    1   23 o   22.745   6.0033   9.1213   7.5816   10.353   10.574   7.8185   10.877   23.395   8.4907   22.095   8.4893 1.299700 12.00663 
1 1 1   27    1   24 f   61.625   3.7623   80.451   9.5556   76.379   13.399   84.666   13.631   60.009   5.4138   63.240   5.2260 -3.231361 7.524638 
1 1 1   27    1   25 o  116.299   3.5500  285.017   16.967  253.439   23.265  320.894   24.799  109.364   5.1579  123.234   4.8790 -13.87019 7.099939 
1 1 1   27    1   26 o   54.280   5.4941   66.101   10.979   63.456   19.522   67.324   13.278   52.424   9.3727   56.136   5.7350 -3.711704 10.98811 
1 1 1   27    1   27 f   37.160   6.1866   30.979   9.5300   19.864   12.580   45.949   14.599   29.428   9.2778   44.892   8.1864 -15.46474 12.37315 
1 1 1   27    1   28 o   46.473   4.5154   46.863   8.6543   47.457   12.324   46.286   12.156   46.762   6.3899   46.184   6.3816 0.5778046 9.030811 
1 1 1   27    1   29 o   59.879   3.8995   77.254   9.6226   73.639   13.585   80.894   13.632   58.415   5.6384   61.343   5.3881 -2.928188 7.798902 
1 1 1   27    1   30 o   54.961   4.0496   65.556   9.1472   59.085   12.862   72.179   13.011   52.089   5.9869   57.833   5.4549 -5.743744 8.099263 
1 1 1   27    1   31 o   40.727   6.5258   41.449   10.204   43.939   12.194   35.631   18.640   44.477   6.6472   36.978   11.232 7.499157 13.05167 
1 1 1   27    1   32 o   38.058   8.4297   30.887   16.634   73.502   27.254   5.5901   20.998   51.248   12.903   24.867   10.852 26.38193 16.85939 
1 1 1   27    1   33 o   20.471   6.7467 -13.9293   14.438   1.9686   20.417 -29.8301   20.419   23.543   10.469   17.399   8.5129 6.144804 13.49347 
1 1 1   27    1   34 o   35.175   8.7174   35.776   15.725   39.250   21.727   31.956   22.786   36.822   12.240   33.528   12.416 3.294437 17.43477 
1 1 1   27    1   35 o   23.762   10.742   2.0085   22.490   0.0000   0.0000   2.0085   22.490  ?   ?    23.762   10.742      ?      ? 
1 1 1   27    2    0 o   23.844   6.7150   16.342   9.0305   16.342   9.0305   16.342   9.0305   23.844   9.4965   23.844   9.4965 0.000000 0.000000 
1 1 1   27    2    1 o   55.282   3.1962   63.259   7.2801   60.161   10.033   66.703   10.579   53.856   4.5170   56.708   4.5233 -2.852142 6.392472 
1 1 1   27    2    2 o   60.540   2.9940   76.012   7.4712   74.447   10.684   77.510   10.451   59.923   4.3230   61.156   4.1434 -1.233253 5.988000 
1 1 1   27    2    3 o   26.978   5.3661   15.485   6.3556   11.114   8.8761   20.084   9.1047   23.581   7.8226   30.374   7.3476 -6.793650 10.73223 
1 1 1   27    2    4 o  171.002   2.2071  604.575   15.564  591.045   21.814  618.605   22.213  169.053   3.1286  172.952   3.1140 -3.898788 4.414149 
1 1 1   27    2    5 o  158.859   2.2164  521.526   14.516  539.526   20.860  504.624   20.214  161.515   3.1314  156.202   3.1376 5.312515 4.432799 
1 1 1   27    2    6 o  116.101   2.2617  278.763   10.829  274.027   15.185  283.665   15.447  115.098   3.1988  117.105   3.1982 -2.006592 4.523310 
1 1 1   27    2    7 o  140.778   2.2152  409.920   12.862  412.434   18.246  407.437   18.133  141.207   3.1329  140.349   3.1325 0.8579254 4.430359 
1 1 1   27    2    8 o  252.580   3.2297  1306.07   32.430  1392.75   54.316  1258.06   40.427  258.797   5.0887  246.363   3.9786 12.43472 6.459416 
1 1 1   27    2    9 o  228.762   3.1135  1083.33   28.625  1101.18   46.140  1072.16   36.498  230.118   4.8614  227.405   3.8914 2.712967 6.227085 
1 1 1   27    2   10 o   40.972   6.1792   37.295   10.444   51.938   14.673   22.260   14.868   49.694   7.1590   32.250   10.074 17.44328 12.35838 
1 1 1   27    2   11 o   71.425   2.9251  105.722   8.5167  104.446   11.191  107.479   13.129   70.950   3.8241   71.899   4.4274 -0.9482956 5.850284 
1 1 1   27    2   12 o   72.000   2.8577  106.894   8.4339  101.120   11.207  114.432   12.806   69.793   3.8934   74.207   4.1842 -4.413918 5.715427 
1 1 1   27    2   13 o   86.362   2.4530  154.641   8.7319  162.276   12.452  147.254   12.248   88.466   3.4126   84.257   3.5246 4.209328 4.905954 
1 1 1   27    2   14 o   88.521   2.4080  162.490   8.7900  166.199   12.560  158.930   12.305   89.511   3.4022   87.530   3.4085 1.980415 4.815929 
1 1 1   27    2   15 o   63.553   2.8982   84.151   7.5430   71.597   10.503   97.522   10.840   58.617   4.3443   68.489   3.8373 -9.871971 5.796414 
1 1 1   27    2   16 o   95.134   2.3597  187.838   9.2581  184.518   13.013  191.242   13.174   94.281   3.3465   95.987   3.3277 -1.705986 4.719424 
1 1 1   27    2   17 o   30.888   5.0040   21.046   6.2420   22.329   8.7792   19.734   8.8766   31.883   6.8782   29.893   7.2697 1.990093 10.00794 
1 1 1   27    2   18 o   84.871   2.4852  149.687   8.6994  149.250   12.262  150.130   12.344   84.748   3.5080   84.995   3.5213 -0.2471085 4.970500 
1 1 1   27    2   19 o   74.153   2.9480  115.143   8.7467  113.666   14.152  116.055   11.126   73.649   4.6591   74.656   3.6133 -1.006882 5.896009 
1 1 1   27    2   20 o   96.245   3.2813  194.163   12.650  193.563   16.077  195.140   20.497   96.246   4.0501   96.244   5.1637 0.1968384E-02 6.562572 
1 1 1   27    2   21 o  118.573   7.0652  343.346   22.708  356.007   24.609  270.738   58.932  130.255   4.5807  106.891   13.367 23.36424 14.13047 
1 1 1   27    2   22 o   45.976   4.7645   45.094   8.9376   46.589   13.765   44.004   11.752   46.517   7.1744   45.434   6.2714 1.082432 9.529030 
1 1 1   27    2   23 o  102.024   2.9935  218.975   12.534  203.308   18.202  233.100   17.284   98.443   4.4831  105.604   3.9683 -7.160828 5.987083 
1 1 1   27    2   24 o   63.250   3.7131   85.350   9.4027   61.015   12.988  112.151   13.630   53.488   5.8873   73.012   4.5263 -19.52354 7.426115 
1 1 1   27    2   25 o  126.151   2.7796  331.869   14.423  312.554   19.541  354.986   21.378  122.164   3.8783  130.138   3.9829 -7.974045 5.559206 
1 1 1   27    2   26 o   52.679   5.1682   65.208   10.056   46.992   16.052   76.976   12.902   45.155   8.9352   60.202   5.1963 -15.04724 10.33633 
1 1 1   27    2   27 f   25.941   6.4653   13.552   8.5974   9.9140   11.311   18.529   13.230   23.189   8.7158   28.693   9.5519 -5.504532 12.93069 
1 1 1   27    2   28 o   32.697   5.8585   24.744   8.1182   32.912   11.696   17.153   11.277   37.928   7.7390   27.466   8.7975 10.46166 11.71704 
1 1 1   27    2   29 o   36.868   5.7204   31.596   8.4388   30.453   11.469   32.946   12.462   36.216   7.9002   37.520   8.2753 -1.303539 11.44087 
1 1 1   27    2   30 o   43.294   5.3713   44.709   8.9650   26.584   12.879   61.746   12.487   33.199   9.1239   53.388   5.6707 -20.18935 10.74260 
1 1 1   27    2   31 o   27.583   6.9417   17.927   10.148   21.927   12.259   9.2193   18.088   30.057   9.1044   25.110   10.481 4.946121 13.88341 
1 1 1   27    2   32 o   51.670   7.2210   69.896   14.795   87.919   19.881   47.527   22.149   61.803   7.7994   41.537   12.155 20.26677 14.44201 
1 1 1   27    2   33 o   20.610   6.8111 -13.0620   14.461  -0.0068   21.412 -24.0116   19.609   23.440   10.549   17.779   8.6185 5.660488 13.62214 
1 1 1   27    2   34 o   23.169   7.4414  -4.0239   15.344 -15.1070   19.839   12.474   24.206   19.183   9.1316   27.155   11.752 -7.971237 14.88270 
1 1 1   27    2   35 o   32.425   12.334   30.172   22.814   0.0000   0.0000   30.172   22.814  ?   ?    32.425   12.334      ?      ? 
1 1 1   27    3    0 o  112.701   2.2711  262.958   14.902  262.958   14.902  262.958   14.902  112.701   3.2119  112.701   3.2119 0.000000 0.000000 
1 1 1   27    3    1 o   17.326   5.0702   0.2897   6.1472  -4.5166   8.4260   5.7585   8.9881   14.549   6.5763   20.103   7.7188 -5.553428 10.14038 
1 1 1   27    3    2 o  135.831   2.2074  381.515   12.366  376.874   17.387  386.265   17.590  134.995   3.1229  136.666   3.1206 -1.671783 4.414798 
1 1 1   27    3    3 o   23.484   5.5194   10.962   6.2777   12.531   8.8301   9.3596   8.9268   24.594   7.7750   22.375   7.8360 2.219961 11.03872 
1 1 1   27    3    4 o   55.246   3.1791   63.438   7.2136   56.455   10.150   70.564   10.254   52.152   4.7190   58.340   4.2614 -6.188423 6.358294 
1 1 1   27    3    5 o   84.945   2.5398  149.310   8.8678  166.450   12.743  133.214   12.348   89.683   3.4450   80.207   3.7328 9.476471 5.079536 
1 1 1   27    3    6 o  263.104   2.4892  1432.90   27.012  1433.91   38.251  1431.88   38.151  263.196   3.5237  263.012   3.5170 0.1845398 4.978480 
1 1 1   27    3    7 o  106.076   2.5313  234.232   10.922  224.936   16.718  241.154   14.425  104.191   3.8903  107.961   3.2396 -3.769005 5.062598 
1 1 1   27    3    8 o   78.842   3.5607  127.019   11.318  139.719   18.373  119.252   14.369   81.907   5.4385   75.777   4.5975 6.130699 7.121419 
1 1 1   27    3    9 o   50.020   4.8172   50.570   9.6085   59.923   16.253   45.544   11.913   53.373   7.3831   46.667   6.1895 6.705696 9.634308 
1 1 1   27    3   10 o   32.490   5.7059   18.118   7.7748   8.0985   9.3309   40.871   14.061   21.699   7.9606   43.281   8.1766 -21.58221 11.41177 
1 1 1   27    3   11 o   20.675   4.6696   3.6203   6.4413   18.168   8.3379 -17.9127   10.144   28.817   7.0688   12.533   6.1035 16.28315 9.339256 
1 1 1   27    3   12 o   59.160   3.2057   72.455   7.7814   69.321   10.399   76.443   11.730   57.733   4.3672   60.587   4.6940 -2.853577 6.411422 
1 1 1   27    3   13 o  131.549   2.3433  359.156   12.658  363.328   17.173  354.192   18.731  132.421   3.1443  130.677   3.4753 1.743744 4.686627 
1 1 1   27    3   14 o   41.197   3.8699   35.549   6.5751   35.274   9.3294   35.819   9.2680   41.035   5.5123   41.360   5.4330 -0.3250656 7.739732 
1 1 1   27    3   15 o  123.386   2.2570  315.696   11.484  307.066   16.122  324.584   16.361  121.670   3.2128  125.102   3.1709 -3.431862 4.514062 
1 1 1   27    3   16 o   39.420   4.2246   33.762   6.4708   44.080   9.2321   23.799   9.0721   45.910   4.8756   32.929   6.9006 12.98122 8.449228 
1 1 1   27    3   17 o   51.510   3.4569   55.271   7.3033   53.534   9.7617   57.481   11.007   50.624   4.6752   52.395   5.0934 -1.770721 6.913735 
1 1 1   27    3   18 o   23.955   5.8045   11.397   6.6581   11.317   11.538   11.436   8.1525   24.581   8.8772   23.329   7.4810 1.252041 11.60905 
1 1 1   27    3   19 o   46.010   4.2948   47.978   7.3449   36.995   11.993   54.571   9.2913   40.958   7.3702   51.062   4.4117 -10.10390 8.589688 
1 1 1   27    3   20 o   90.688   3.3927  172.271   12.215  170.913   15.305  174.651   20.271   90.421   4.1040   90.956   5.4035 -0.5343628 6.785304 
1 1 1   27    3   21 o   67.180   4.2104   95.795   11.452   96.108   17.988   95.581   14.851   67.086   6.5010   67.275   5.3524 -0.1887817 8.420889 
1 1 1   27    3   22 o   86.135   3.5849  162.617   12.077  132.873   19.365  181.548   15.450   79.086   5.9369   93.185   4.0199 -14.09929 7.169791 
1 1 1   27    3   23 o   64.912   3.6620   89.193   9.7408   86.259   14.478   91.620   13.167   63.839   5.4986   65.985   4.8380 -2.145454 7.323961 
1 1 1   27    3   24 o   58.470   3.8864   72.472   9.3463   65.305   12.913   80.358   13.546   55.392   5.6520   61.549   5.3359 -6.157352 7.772854 
1 1 1   27    3   25 o   65.919   4.0063   93.569   10.700   86.441   16.354   98.903   14.148   63.472   6.2471   68.367   5.0174 -4.894985 8.012530 
1 1 1   27    3   26 o   38.616   5.4002   33.007   8.4194   40.994   12.470   26.317   11.413   43.413   6.9647   33.820   8.2547 9.592876 10.80031 
1 1 1   27    3   27 o   42.262   5.6049   40.183   9.5325   34.359   13.269   46.396   13.703   38.510   8.5744   46.014   7.2206 -7.504509 11.20970 
1 1 1   27    3   28 o   65.043   4.4966   94.441   11.182   84.373   19.228   99.586   13.745   61.665   7.5601   68.421   4.8708 -6.756527 8.993285 
1 1 1   27    3   29 o   35.440   5.9293   30.093   8.6429   22.799   12.623   36.531   11.859   30.922   9.2096   39.957   7.4706 -9.035027 11.85855 
1 1 1   27    3   30 o   91.698   3.0364  178.424   11.482  174.662   16.114  182.303   16.366   90.708   4.3072   92.687   4.2810 -1.978973 6.072782 
1 1 1   27    3   31 o   40.580   7.2559   37.647   10.985   32.635   12.719   52.356   21.789   36.827   8.5401   44.334   11.733 -7.507702 14.51189 
1 1 1   27    3   32 o   68.803   5.5856  108.287   15.716  102.109   20.714  116.669   24.128   66.861   7.5113   70.745   8.2691 -3.883644 11.17129 
1 1 1   27    3   33 f   41.784   8.5778   48.652   15.633   49.561   22.807   47.847   21.471   41.943   12.351   41.624   11.906 0.3188133 17.15563 
1 1 1   27    3   34 o   37.714   10.899   42.287   22.899   75.437   50.929   33.886   25.637   41.495   17.471   33.932   13.034 7.562809 21.79744 
1 1 1   27    3   35 o   28.503   11.878   18.911   23.176   0.0000   0.0000   18.911   23.176  ?   ?    28.503   11.878      ?      ? 
1 1 1   27    4    0 o  215.404   2.3207  959.020   29.143  959.020   29.143  959.020   29.143  215.404   3.2820  215.404   3.2820 0.000000 0.000000 
1 1 1   27    4    1 o  191.237   2.2580  756.439   17.810  756.360   25.195  756.518   25.178  191.227   3.1945  191.247   3.1920 -0.2035522E-01 4.515955 
1 1 1   27    4    2 o  148.269   2.2068  454.648   13.494  447.735   19.042  461.621   19.126  147.135   3.1378  149.404   3.1038 -2.268768 4.413591 
1 1 1   27    4    3 f  108.471   2.4588  240.844   10.896  225.500   14.282  262.211   16.853  104.400   3.3168  112.542   3.6307 -8.141708 4.917584 
1 1 1   27    4    4 o   59.652   3.0194   73.917   7.3797   84.918   10.560   63.417   10.317   64.018   3.9995   55.286   4.5244 8.731529 6.038760 
1 1 1   27    4    5 o  118.883   2.2590  292.321   11.076  296.476   15.757  288.264   15.571  119.718   3.1913  118.048   3.1980 1.670486 4.517915 
1 1 1   27    4    6 o   66.734   3.0992   92.686   8.4225   90.441   12.895   94.356   11.123   65.993   4.7377   67.474   3.9967 -1.481033 6.198330 
1 1 1   27    4    7 o   84.527   2.7586  148.326   9.4870  146.548   14.625  149.618   12.465   84.054   4.2187   85.001   3.5556 -0.9472885 5.517238 
1 1 1   27    4    8 o  152.550   2.9363  482.901   18.007  482.704   28.887  483.026   23.028  152.420   4.5951  152.680   3.6569 -0.2604523 5.872653 
1 1 1   27    4    9 o   89.200   3.3869  166.307   11.938  162.812   19.861  168.285   14.937   88.347   5.4507   90.053   4.0216 -1.705910 6.773748 
1 1 1   27    4   10 o  120.007   2.4782  299.011   12.086  301.527   15.833  295.500   18.708  120.666   3.1814  119.348   3.8007 1.318619 4.956480 
1 1 1   27    4   11 o  211.839   2.4987  931.375   21.618  937.185   28.689  923.742   32.884  212.686   3.2705  210.992   3.7788 1.694046 4.997501 
1 1 1   27    4   12 o   29.471   5.5149   19.270   6.8094   21.141   8.9914   16.754   10.427   31.056   7.1654   27.885   8.3854 3.171421 11.02986 
1 1 1   27    4   13 o   58.717   3.2710   71.115   7.8397   58.044   10.568   87.112   11.691   52.746   4.8577   64.687   4.3819 -11.94096 6.542053 
1 1 1   27    4   14 o   44.425   3.8761   41.240   7.0839   45.616   10.293   37.302   9.7639   46.675   5.3469   42.175   5.6131 4.499672 7.752143 
1 1 1   27    4   15 o   55.945   3.0690   65.109   7.0701   60.201   9.7744   70.493   10.239   53.729   4.4108   58.161   4.2683 -4.432152 6.137910 
1 1 1   27    4   16 o   62.256   2.8419   80.683   7.2925   76.835   10.233   84.652   10.395   60.739   4.0849   63.774   3.9520 -3.035023 5.683726 
1 1 1   27    4   17 o  102.707   2.3237  218.946   9.8414  224.902   13.961  213.062   13.875  104.103   3.2515  101.312   3.3206 2.791183 4.647426 
1 1 1   27    4   18 o   71.029   3.1277  109.301   8.7612   89.333   13.806  122.765   11.336   65.236   5.1311   76.822   3.5778 -11.58657 6.255323 
1 1 1   27    4   19 o   59.518   3.4983   77.323   8.1109   64.502   13.223   85.056   10.270   55.196   5.8084   63.840   3.9004 -8.643593 6.996511 
1 1 1   27    4   20 o   79.790   3.9295  132.572   11.948  129.348   14.307  140.005   21.723   78.574   4.4148   81.007   6.5017 -2.433472 7.858909 
1 1 1   27    4   21 o   58.415   4.6231   78.914   10.086   55.195   16.634   92.702   12.683   50.383   8.0047   66.446   4.6278 -16.06243 9.246182 
1 1 1   27    4   22 o   30.515   6.4398   16.439   8.6743   34.997   15.735   8.3376   10.397   38.907   9.8083   22.123   8.3474 16.78456 12.87954 
1 1 1   27    4   23 o  103.627   3.0586  223.186   12.907  237.299   20.151  213.368   16.807  106.270   4.5975  100.985   4.0353 5.285286 6.117231 
1 1 1   27    4   24 o   37.765   6.1051   35.141   9.3273   21.903   15.836   42.173   11.542   31.203   10.451   44.326   6.3131 -13.12238 12.21016 
1 1 1   27    4   25 o   65.692   6.5625  106.959   12.922   82.458   28.345  113.386   14.518   58.113   12.214   73.272   4.8041 -15.15950 13.12493 
1 1 1   27    4   26 o   24.091   6.1231   11.637   7.8177   9.0210   11.643   13.784   10.550   22.899   8.7868   25.283   8.5301 -2.384157 12.24623 
1 1 1   27    4   27 o   55.140   4.4042   64.438   9.8400   49.685   13.075   83.711   14.943   47.828   6.6281   62.452   5.8015 -14.62386 8.808466 
1 1 1   27    4   28 o   40.758   5.6592   38.146   9.1308   37.207   12.259   39.317   13.685   40.360   7.6441   41.157   8.3472 -0.7971382 11.31845 
1 1 1   27    4   29 o   59.911   3.8926   77.391   9.6130   77.271   13.820   77.503   13.381   59.820   5.6013   60.002   5.4069 -0.1817856 7.785156 
1 1 1   27    4   30 o   62.966   3.7682   85.391   9.7765   90.756   14.064   80.374   13.600   64.917   5.2527   61.015   5.4042 3.901768 7.536351 
1 1 1   27    4   31 f   55.719   5.7005   71.266   11.185   70.234   13.076   74.081   21.593   56.743   5.5872   54.696   9.9380 2.047112 11.40093 
1 1 1   27    4   32 o   24.037   7.2878   6.3368   12.881   5.3648   17.440   7.5032   19.105   23.351   10.040   24.723   10.566 -1.372236 14.57570 
1 1 1   27    4   33 o   59.980   7.1043   90.525   16.956   77.490   24.153  103.192   23.810   54.248   11.167   65.712   8.7853 -11.46378 14.20861 
1 1 1   27    4   34 o   33.420   9.8046   33.432   22.811   3.0818   51.199   40.948   25.479   30.357   14.511   36.483   13.189 -6.126125 19.60919 
1 1 1   27    4   35 o   24.325   8.0347  -6.2674   20.725 -92.1891   50.343   11.266   22.741   22.542   11.381   26.109   11.345 -3.566927 16.06949 
1 1 1   27    4   36 o   28.150   12.111   19.146   25.406   0.0000   0.0000   19.146   25.406  ?   ?    28.150   12.111      ?      ? 
1 1 1   27    5    0 o  192.096   2.2594  762.763   25.300  762.763   25.300  762.763   25.300  192.096   3.1953  192.096   3.1953 0.000000 0.000000 
1 1 1   27    5    1 o   95.985   2.3889  190.583   9.4527  182.435   13.251  199.026   13.488   93.893   3.4218   98.078   3.3344 -4.184998 4.777771 
1 1 1   27    5    2 o  136.185   2.2196  383.431   12.463  398.038   17.808  369.407   17.449  138.729   3.1122  133.640   3.1656 5.089233 4.439265 
1 1 1   27    5    3 f   64.766   2.9146   86.936   7.7847   87.454   11.110   86.436   10.911   64.953   4.1470   64.578   4.0966 0.3751984 5.829251 
1 1 1   27    5    4 o   94.890   2.4176  186.376   9.4426  171.031   13.228  202.318   13.483   90.896   3.5284   98.884   3.3060 -7.987625 4.835248 
1 1 1   27    5    5 o   36.748   4.5466   29.050   6.6360   22.983   9.4325   34.995   9.3375   32.498   7.2244   40.998   5.5221 -8.499435 9.093166 
1 1 1   27    5    6 o   25.166   5.5021   13.414   6.7961   4.3299   10.953   19.100   8.6658   20.729   8.3453   29.603   7.1729 -8.874193 11.00425 
1 1 1   27    5    7 o   55.319   4.1837   60.526   8.8299   72.820   16.481   55.576   10.457   58.944   6.7792   51.693   4.9048 7.251572 8.367487 
1 1 1   27    5    8 o  219.662   3.3738  1002.10   30.531  1035.00   44.498  972.844   41.967  223.036   4.8373  216.287   4.7045 6.749176 6.747689 
1 1 1   27    5    9 o  128.454   2.9940  336.298   15.485  314.855   19.601  371.907   25.258  123.189   3.8577  133.720   4.5797 -10.53120 5.987953 
1 1 1   27    5   10 o   46.745   4.1636   45.634   7.9847   44.841   10.713   46.625   11.977   46.321   5.6074   47.169   6.1563 -0.8480530 8.327258 
1 1 1   27    5   11 f   68.067   3.3491  101.383   8.8665  116.125   11.382   78.629   14.141   74.813   3.6887   61.321   5.5911 13.49203 6.698249 
1 1 1   27    5   12 o   93.131   2.5824  181.564   9.7991  192.064   13.122  168.329   14.733   96.255   3.3054   90.008   3.9686 6.246803 5.164866 
1 1 1   27    5   13 o   70.709   2.9349  103.808   8.4758  102.503   11.199  105.558   12.968   70.232   3.8661   71.187   4.4168 -0.9556046 5.869802 
1 1 1   27    5   14 o   67.916   2.7315   95.979   7.6462   98.560   10.722   93.307   10.908   68.859   3.7751   66.974   3.9487 1.885139 5.462984 
1 1 1   27    5   15 o   73.891   2.6095  113.496   7.9504  109.927   11.193  117.130   11.295   72.712   3.7324   75.070   3.6479 -2.358147 5.218967 
1 1 1   27    5   16 o   74.938   2.5875  116.674   7.9955  114.302   11.160  119.175   11.461   74.158   3.6488   75.719   3.6698 -1.561043 5.175009 
1 1 1   27    5   17 o   14.977   4.6236  -1.5945   5.4470  -3.8075   7.6629   0.6657   7.7441   13.910   6.2807   16.045   6.7871 -2.135262 9.247274 
1 1 1   27    5   18 o   55.225   3.4159   62.376   7.5741   70.808   12.501   57.485   9.5204   58.022   5.2238   52.428   4.4028 5.594383 6.831738 
1 1 1   27    5   19 o   22.455   5.7243   9.0213   6.5921   12.062   10.910   7.2728   8.2733   24.614   8.6601   20.296   7.4882 4.317682 11.44859 
1 1 1   27    5   20 o   70.116   4.8221  103.241   13.801   86.777   18.195  125.549   21.179   63.616   6.9345   76.615   6.7024 -12.99996 9.644108 
1 1 1   27    5   21 o   48.065   5.5878   54.737   9.6840   40.918   16.746   61.680   11.870   42.091   9.8249   54.039   5.3259 -11.94780 11.17556 
1 1 1   27    5   22 o   38.999   6.0310   31.818   9.1207   45.349   15.730   24.965   11.195   44.773   8.8319   33.225   8.2153 11.54796 12.06206 
1 1 1   27    5   23 o   28.755   6.4140   18.226   8.4484   20.246   12.846   16.686   11.215   29.997   9.3626   27.514   8.7692 2.482943 12.82800 
1 1 1   27    5   24 o   99.716   3.6814  215.458   14.245  195.996   24.046  225.981   17.681   95.665   6.0944  103.767   4.1314 -8.102150 7.362717 
1 1 1   27    5   25 o   43.794   5.4085   43.094   9.2189   40.454   14.764   44.782   11.803   41.935   8.8160   45.654   6.2680 -3.719685 10.81709 
1 1 1   27    5   26 o  117.633   2.8379  290.603   13.764  297.280   19.771  284.323   19.174  118.935   4.0304  116.332   3.9963 2.602364 5.675769 
1 1 1   27    5   27 o   30.975   6.0574   22.047   7.9591   24.702   12.053   19.993   10.599   32.515   8.7812   29.435   8.3463 3.079706 12.11489 
1 1 1   27    5   28 o   31.609   6.4401   23.506   8.8654   20.447   12.056   27.107   13.082   29.520   9.0465   33.699   9.1684 -4.178267 12.88018 
1 1 1   27    5   29 o   27.534   6.0677   17.210   8.2237   8.1257   11.934   25.424   11.348   22.265   8.7942   32.802   8.3624 -10.53732 12.13541 
1 1 1   27    5   30 o   49.330   5.7159   57.629   10.429   60.690   12.799   51.580   17.992   52.765   5.8811   45.894   9.8030 6.870438 11.43184 
1 1 1   27    5   31 o   39.953   7.2547   39.481   10.958   38.156   12.686   43.375   21.748   40.183   7.9363   39.723   12.146 0.4596558 14.50939 
1 1 1   27    5   32 o   54.050   6.8694   71.410   14.830   69.294   19.596   74.247   22.689   54.093   8.7834   54.007   10.564 0.8586884E-01 13.73873 
1 1 1   27    5   33 o   21.274   6.8076  -1.9900   12.768  -1.1400   17.180  -3.0390   19.085   21.048   9.4633   21.501   9.7887 -0.4526062 13.61516 
1 1 1   27    5   34 o   32.223   9.4837   29.429   21.108   5.0228   45.951   35.957   23.764   29.738   14.080   34.707   12.708 -4.969151 18.96739 
1 1 1   27    5   35 o   29.718   9.7716   3.6339   21.649   60.828   50.713  -9.1117   23.940   37.546   16.607   21.889   10.303 15.65695 19.54326 
1 1 1   27    5   36 o   25.168   11.273   8.6933   24.129   0.0000   0.0000   8.6933   24.129  ?   ?    25.168   11.273      ?      ? 
1 1 1   27    6    0 o  144.902   2.6183  434.750   22.097  434.750   22.097  434.750   22.097  144.902   3.7028  144.902   3.7028 0.000000 0.000000 
1 1 1   27    6    1 o  139.666   2.2155  403.449   12.762  398.891   17.951  408.106   18.146  138.868   3.1342  140.464   3.1322 -1.595184 4.431012 
1 1 1   27    6    2 o  109.050   2.3141  245.993   10.406  253.209   14.835  239.004   14.601  110.627   3.2514  107.474   3.2938 3.152313 4.628275 
1 1 1   27    6    3 o  168.238   2.2289  585.535   15.465  592.800   21.882  578.285   21.860  169.283   3.1341  167.192   3.1700 2.091293 4.457754 
1 1 1   27    6    4 o  206.563   2.4978  882.445   21.023  876.882   27.625  890.100   32.406  205.853   3.2537  207.272   3.7907 -1.418884 4.995624 
1 1 1   27    6    5 o   73.329   3.2094  111.177   9.3051  113.382   15.624  109.964   11.584   73.820   5.1316   72.839   3.8558 0.9805374 6.418775 
1 1 1   27    6    6 o   86.754   3.0795  161.686   10.275  140.361   17.455  172.994   12.710   82.107   5.1543   91.402   3.3716 -9.295586 6.159096 
1 1 1   27    6    7 o  171.303   2.9703  603.476   20.298  631.797   33.577  587.165   25.482  174.304   4.6706  168.302   3.6709 6.001617 5.940571 
1 1 1   27    6    8 o   96.995   2.8612  195.357   11.434  194.289   16.535  196.336   15.828   96.725   4.1448   97.265   3.9456 -0.5401230 5.722466 
1 1 1   27    6    9 f   54.985   3.8812   63.214   8.7797   68.726   12.471   57.798   12.362   57.391   5.2685   52.578   5.7007 4.812557 7.762452 
1 1 1   27    6   10 o  118.733   2.4885  294.225   12.023  305.262   15.937  279.646   18.317  121.394   3.1830  116.073   3.8262 5.320465 4.977084 
1 1 1   27    6   11 o  107.581   2.3264  239.987   10.304  258.842   14.676  221.656   14.470  111.768   3.1836  103.395   3.3932 8.372955 4.652883 
1 1 1   27    6   12 o  109.663   2.4914  250.387   11.162  256.075   14.896  243.103   16.855  111.139   3.2496  108.187   3.7773 2.951897 4.982816 
1 1 1   27    6   13 o   91.373   2.6149  173.178   9.7676  171.424   12.951  175.493   14.875   90.880   3.4553   91.866   3.9258 -0.9861984 5.229786 
1 1 1   27    6   14 o   80.356   2.5203  134.107   8.3502  135.373   11.986  132.914   11.640   80.718   3.6002   79.993   3.5280 0.7246170 5.040670 
1 1 1   27    6   15 o  109.103   2.2742  246.908   10.231  240.054   14.337  254.021   14.605  107.557   3.2319  110.649   3.2004 -3.091408 4.548381 
1 1 1   27    6   16 o   89.054   2.6214  164.433   9.5002  167.630   14.744  162.164   12.423   89.736   3.9838   88.371   3.4083 1.364067 5.242805 
1 1 1   27    6   17 o   78.206   3.1295  127.732   10.090  128.930   14.519  126.614   14.031   78.548   4.4817   77.864   4.3691 0.6832581 6.258982 
1 1 1   27    6   18 o   34.507   5.4733   26.831   8.0400   14.249   11.459   39.029   11.283   26.182   8.8900   42.831   6.3873 -16.64879 10.94662 
1 1 1   27    6   19 o   55.181   3.5846   63.368   8.1015   70.435   12.383   58.080   10.712   57.812   5.1932   52.550   4.9426 5.261688 7.169234 
1 1 1   27    6   20 o  103.343   3.6774  229.947   14.429  238.112   17.498  212.600   25.508  106.747   3.9744   99.938   6.1883 6.809326 7.354709 
1 1 1   27    6   21 o   81.250   3.0578  138.495   10.209  124.029   14.340  153.365   14.539   76.882   4.5222   85.618   4.1171 -8.736290 6.115644 
1 1 1   27    6   22 o   93.013   3.2973  183.519   12.267  174.127   19.638  189.529   15.708   90.816   5.2428   95.210   4.0001 -4.394646 6.594563 
1 1 1   27    6   23 o   23.475   6.0868   9.9976   7.7934   13.847   11.424   6.6466   10.659   25.713   8.8724   21.236   8.3354 4.476490 12.17366 
1 1 1   27    6   24 o   59.639   4.4377   74.277   10.553   84.424   17.732   68.712   13.131   62.471   6.8819   56.808   5.6045 5.663467 8.875307 
1 1 1   27    6   25 o   20.349   5.8159   5.0249   7.5622   3.9592   11.026   5.9715   10.391   20.056   8.2605   20.642   8.1892 -0.5859032 11.63181 
1 1 1   27    6   26 o   58.402   3.8224   72.247   9.1701   81.557   13.615   64.518   12.406   61.845   5.3378   54.960   5.4729 6.884922 7.644896 
1 1 1   27    6   27 o   54.622   4.0386   63.700   9.0587   72.581   13.350   56.121   12.332   58.185   5.5628   51.059   5.8562 7.126404 8.077120 
1 1 1   27    6   28 o   34.943   6.2247   28.649   8.9411   25.202   11.957   33.021   13.466   32.606   8.7212   37.281   8.8841 -4.674984 12.44938 
1 1 1   27    6   29 o   44.658   5.0818   45.404   8.8302   60.302   12.733   31.601   12.256   52.689   5.8593   36.626   8.3046 16.06287 10.16357 
1 1 1   27    6   30 o   35.036   7.3404   29.402   10.294   27.936   11.825   33.990   20.917   34.167   8.4409   35.904   12.012 -1.736988 14.68089 
1 1 1   27    6   31 o   47.658   6.4906   51.938   11.306   47.839   13.254   62.883   21.661   46.068   6.9757   49.249   10.948 -3.181160 12.98127 
1 1 1   27    6   32 o   53.527   6.7006   68.801   14.377   58.938   19.003   82.003   21.986   48.559   9.8258   58.496   9.1128 -9.937813 13.40111 
1 1 1   27    6   33 o   56.494   8.8298   92.148   20.533   71.099   30.646  109.294   27.659   47.290   14.411   65.698   10.208 -18.40828 17.65951 
1 1 1   27    6   34 o   38.372   11.005   45.204   22.937   83.439   51.809   35.883   25.580   42.349   17.713   34.395   13.066 7.954330 22.01063 
1 1 1   27    6   35 o   28.131   8.9475   14.375   21.108 -14.3474   47.478   21.451   23.564   27.240   13.252   29.023   12.026 -1.783236 17.89501 
1 1 1   27    6   36 o   43.894   13.113   63.030   25.560   0.0000   0.0000   63.030   25.560  ?   ?    43.894   13.113      ?      ? 
1 1 1   27    7    0 o   29.138   6.2704   21.919   9.3056   21.919   9.3056   21.919   9.3056   29.138   8.8677   29.138   8.8677 0.000000 0.000000 
1 1 1   27    7    1 o  115.284   2.8157  277.013   12.591  271.085   21.783  279.987   15.430  114.248   4.6228  116.321   3.2161 -2.072594 5.631467 
1 1 1   27    7    2 o  288.678   2.6036  1726.26   30.998  1713.96   43.533  1738.92   44.149  287.639   3.6694  289.717   3.6947 -2.078400 5.207263 
1 1 1   27    7    3 o  151.532   2.2223  475.162   13.889  474.815   19.692  475.505   19.592  151.476   3.1519  151.589   3.1336 -0.1130371 4.444576 
1 1 1   27    7    4 o   45.168   4.0387   42.045   7.4484   46.196   11.557   39.096   9.7412   47.028   5.9584   43.309   5.4535 3.719872 8.077335 
1 1 1   27    7    5 o  136.785   2.4079  386.326   13.414  395.047   20.779  380.095   17.565  138.060   3.6491  135.510   3.1427 2.550476 4.815882 
1 1 1   27    7    6 o   75.162   2.8809  118.157   8.7866  111.894   13.500  122.760   11.574   73.372   4.4610   76.952   3.6466 -3.580093 5.761756 
1 1 1   27    7    7 o  111.733   3.1532  261.974   14.091  249.317   22.603  270.021   18.022  109.386   5.0100  114.081   3.8303 -4.695534 6.306461 
1 1 1   27    7    8 o  201.981   2.6665  846.342   22.213  837.650   31.226  855.246   31.604  200.932   3.7680  203.029   3.7742 -2.097382 5.333073 
1 1 1   27    7    9 o   39.849   5.1319   34.633   8.0978   24.377   11.359   45.232   11.548   33.238   8.3084   46.460   6.0263 -13.22185 10.26377 
1 1 1   27    7   10 o   27.547   5.4266   17.358   6.8400   23.391   8.6609   7.3567   11.151   32.780   6.6337   22.314   8.5900 10.46637 10.85325 
1 1 1   27    7   11 o   49.881   3.3904   51.869   6.9639   56.012   9.9822   47.940   9.7201   51.835   4.6691   47.927   4.9173 3.908615 6.780880 
1 1 1   27    7   12 o  137.215   2.5547  390.648   14.451  375.471   20.121  406.815   20.768  134.461   3.6282  139.969   3.5975 -5.508118 5.109364 
1 1 1   27    7   13 o   39.309   5.6701   38.162   8.0611   43.864   9.5180   23.694   15.161   45.788   5.0400   32.829   10.159 12.95898 11.34025 
1 1 1   27    7   14 o   55.413   3.1338   64.115   7.1559   66.638   10.066   61.537   10.174   56.533   4.3173   54.294   4.5435 2.239128 6.267594 
1 1 1   27    7   15 o   74.148   2.6404  114.315   8.0679  108.104   11.336  120.691   11.485   72.094   3.8124   76.202   3.6542 -4.107872 5.280873 
1 1 1   27    7   16 o   85.506   2.4892  151.807   8.7736  145.225   12.218  158.815   12.607   83.589   3.5439   87.422   3.4963 -3.832558 4.978315 
1 1 1   27    7   17 o   73.960   2.9053  111.320   8.6686  127.883   14.129  101.322   10.977   78.198   4.3807   69.722   3.8174 8.476089 5.810639 
1 1 1   27    7   18 o   44.633   4.4994   42.687   8.2233   37.904   11.822   47.170   11.446   42.093   6.8096   47.173   5.8829 -5.079712 8.998878 
1 1 1   27    7   19 o   79.682   3.1909  133.002   10.478  125.805   14.588  140.673   15.061   77.441   4.5672   81.923   4.4573 -4.481445 6.381739 
1 1 1   27    7   20 f   70.311   3.2815  104.255   9.4615   98.897   13.922  108.854   12.898   68.545   4.9244   72.077   4.3387 -3.531570 6.563091 
1 1 1   27    7   21 o   50.779   4.1471   54.739   8.6624   49.729   12.126   59.959   12.379   48.352   6.0805   53.206   5.6409 -4.854012 8.294111 
1 1 1   27    7   22 o   54.042   4.5646   62.924   9.7779   60.911   16.058   64.110   12.326   53.062   7.3376   55.022   5.4317 -1.960152 9.129237 
1 1 1   27    7   23 o   58.751   3.7378   73.087   9.0281   81.504   13.059   65.380   12.495   62.041   5.1033   55.461   5.4626 6.579826 7.475561 
1 1 1   27    7   24 o   43.522   5.9598   43.177   9.7594   41.025   17.168   44.204   11.862   41.690   10.093   45.354   6.3415 -3.663891 11.91961 
1 1 1   27    7   25 o   81.554   3.1595  140.104   10.619  147.545   15.343  133.262   14.713   83.638   4.4478   79.470   4.4887 4.167763 6.319098 
1 1 1   27    7   26 o   91.096   2.9748  174.314   11.161  186.271   16.268  163.680   15.341   94.045   4.1941   88.146   4.2198 5.898537 5.949560 
1 1 1   27    7   27 o   49.345   4.4116   53.193   8.9058   46.637   12.757   59.425   12.438   46.171   6.6991   52.519   5.7422 -6.348541 8.823279 
1 1 1   27    7   28 o   20.657   5.9870   4.2143   8.2579  -0.2459   11.155   9.6233   12.284   18.111   7.9063   23.204   8.9925 -5.093418 11.97395 
1 1 1   27    7   29 o   43.693   5.1786   43.570   8.9512   53.218   12.734   34.147   12.585   49.288   6.2639   38.099   8.2483 11.18950 10.35714 
1 1 1   27    7   30 o   79.674   4.5440  143.166   13.215  146.655   15.616  134.368   24.800   82.780   4.5738   76.568   7.8531 6.212051 9.087987 
1 1 1   27    7   31 o   25.068   7.0244   11.798   10.153   10.889   12.163   13.885   18.437   23.416   8.9819   26.720   10.803 -3.303394 14.04884 
1 1 1   27    7   32 f   36.880   7.3204   30.776   10.576   24.456   12.307   48.628   20.683   31.395   9.0241   42.366   11.529 -10.97065 14.64080 
1 1 1   27    7   33 o   32.451   9.0394   29.359   18.335   18.751   28.529   36.823   23.931   29.623   12.789   35.279   12.778 -5.656368 18.07883 
1 1 1   27    7   34 o   39.992   9.5950   57.982   22.668   12.014   47.391   71.619   25.813   30.649   14.447   49.335   12.631 -18.68636 19.19008 
1 1 1   27    7   35 o   33.414   8.7306   31.615   23.207 -88.9737   51.134   62.898   26.044   22.533   11.387   44.294   13.237 -21.76116 17.46115 
1 1 1   27    7   36 o   22.817   10.596  -1.1340   23.951   0.0000   0.0000  -1.1340   23.951  ?   ?    22.817   10.596      ?      ? 
1 1 1   27    8    0 o   14.205   5.9808   4.5798   8.6968   4.5798   8.6968   4.5798   8.6968   14.205   8.4582   14.205   8.4582 0.000000 0.000000 
1 1 1   27    8    1 o   32.863   4.9297   23.515   6.4852   27.491   9.2841   19.727   9.0628   35.688   6.5487   30.039   7.3704 5.649691 9.859408 
1 1 1   27    8    2 o   72.406   2.7624  108.784   8.2460  107.053   11.777  110.449   11.550   71.834   3.9749   72.979   3.8372 -1.145180 5.524839 
1 1 1   27    8    3 o  155.509   2.4141  497.963   15.278  519.034   23.828  483.253   19.909  158.235   3.6511  152.783   3.1594 5.452240 4.828267 
1 1 1   27    8    4 o  103.457   2.6934  221.613   11.482  233.804   16.636  210.524   15.868  106.171   3.7992  100.743   3.8188 5.427299 5.386737 
1 1 1   27    8    5 o  114.548   2.5063  269.861   11.693  285.113   18.226  259.189   15.245  117.238   3.7692  111.857   3.3044 5.381317 5.012585 
1 1 1   27    8    6 f  243.546   2.9869  1248.54   28.637  1176.48   47.544  1289.57   35.875  237.668   4.8502  249.424   3.4873 -11.75616 5.973764 
1 1 1   27    8    7 o   86.577   3.3668  157.303   11.789  149.544   18.323  162.784   15.401   84.650   5.2480   88.504   4.2190 -3.853409 6.733622 
1 1 1   27    8    8 o  261.520   3.2368  1424.78   34.258  1418.15   53.828  1429.30   44.415  260.768   5.0048  262.271   4.1060 -1.502686 6.473572 
1 1 1   27    8    9 o  128.826   2.4315  343.519   12.732  340.385   16.614  347.979   19.818  128.175   3.1428  129.478   3.7110 -1.303101 4.862994 
1 1 1   27    8   10 o  187.562   2.4566  726.788   18.718  712.517   24.334  747.463   29.291  185.408   3.1822  189.717   3.7434 -4.308273 4.913164 
1 1 1   27    8   11 o  101.603   2.3299  213.895   9.7583  222.916   14.057  205.503   13.557  103.670   3.2875   99.536   3.3024 4.134079 4.659795 
1 1 1   27    8   12 o   56.413   3.3183   65.996   7.6529   63.195   10.085   69.797   11.750   55.048   4.4419   57.778   4.9309 -2.729488 6.636610 
1 1 1   27    8   13 o   57.148   3.2940   67.654   7.6737   64.725   10.022   71.804   11.930   55.710   4.3619   58.586   4.9371 -2.875683 6.587966 
1 1 1   27    8   14 o  122.462   2.4324  311.492   12.134  311.799   15.961  311.072   18.676  122.601   3.1564  122.324   3.7018 0.2775116 4.864815 
1 1 1   27    8   15 o  145.328   2.2137  438.144   13.269  434.137   18.732  442.179   18.798  144.658   3.1396  145.997   3.1217 -1.338684 4.427408 
1 1 1   27    8   16 o   21.538   5.6525   8.1190   6.5862   6.3981   10.859   9.1205   8.2839   21.442   8.4143   21.634   7.5501 -0.1916409 11.30503 
1 1 1   27    8   17 o  121.829   2.4515  311.349   12.078  296.256   18.783  321.991   15.772  119.169   3.8216  124.490   3.0717 -5.320686 4.903029 
1 1 1   27    8   18 o  115.868   2.6546  282.210   12.582  247.882   18.129  314.107   17.475  108.914   4.0357  122.821   3.4497 -13.90607 5.309191 
1 1 1   27    8   19 o   76.869   3.2187  124.006   10.203  125.738   14.364  122.242   14.494   77.426   4.4981   76.312   4.6050 1.114769 6.437340 
1 1 1   27    8   20 o   28.162   5.5766   17.973   6.5445   15.760   11.461   19.044   7.9722   27.051   8.8847   29.274   6.7420 -2.223038 11.15316 
1 1 1   27    8   21 o  132.661   2.6162  367.256   14.313  364.603   20.333  369.862   20.151  132.173   3.7299  133.149   3.6695 -0.9754333 5.232335 
1 1 1   27    8   22 o   34.945   6.2501   25.215   8.8767   40.724   15.239   17.252   10.920   42.090   9.0478   27.800   8.6251 14.28927 12.50019 
1 1 1   27    8   23 o   80.409   3.5845  140.960   11.426  118.829   17.953  156.026   14.813   74.607   5.8344   86.212   4.1659 -11.60517 7.168985 
1 1 1   27    8   24 o   38.287   5.7909   34.449   9.0353   23.065   13.492   43.707   12.166   31.578   9.5478   44.997   6.5556 -13.41976 11.58175 
1 1 1   27    8   25 o   53.160   4.3964   61.978   9.3667   55.724   14.619   66.334   12.200   50.528   7.0147   55.793   5.3017 -5.264507 8.792830 
1 1 1   27    8   26 o   29.407   5.1732   18.728   7.8068   0.3550   11.397   34.971   10.716   18.672   8.0723   40.143   6.4721 -21.47108 10.34645 
1 1 1   27    8   27 o   35.877   5.8244   29.970   8.4419   33.408   12.267   26.878   11.635   37.926   8.0891   33.827   8.3821 4.099377 11.64877 
1 1 1   27    8   28 o   45.031   4.7443   44.554   8.7973   47.767   12.862   41.729   12.059   46.557   6.6982   43.506   6.7206 3.050976 9.488538 
1 1 1   27    8   29 o   31.796   6.5008   25.427   9.6742   33.581   12.520   13.346   15.241   37.685   8.2812   25.908   10.023 11.77661 13.00165 
1 1 1   27    8   30 o   32.226   7.5081   23.567   10.274   20.233   11.768   34.259   21.072   28.867   8.9530   35.585   12.055 -6.717573 15.01629 
1 1 1   27    8   31 o   27.467   6.6477   18.010   10.477   27.285   12.591  -2.8593   18.887   33.274   8.9707   21.660   9.8130 11.61352 13.29548 
1 1 1   27    8   32 o   16.360   5.5250 -13.7273   10.212  -6.0634   11.968 -34.2449   19.583   16.445   7.5851   16.274   8.0356 0.1717396 11.05004 
1 1 1   27    8   33 o   35.162   9.4592   35.424   18.751   53.078   30.182   24.328   23.929   39.826   14.362   30.498   12.315 9.328051 18.91846 
1 1 1   27    8   34 o   47.575   9.5317   72.171   19.931   61.818   29.776   80.576   26.828   42.732   14.331   52.419   12.571 -9.687004 19.06341 
1 1 1   27    8   35 o   31.995   9.5680   33.347   22.360   6.4675   50.903   39.774   24.889   29.175   14.080   34.816   12.959 -5.640696 19.13603 
1 1 1   27    8   36 f   31.809   12.783   33.196   25.647   0.0000   0.0000   33.196   25.647  ?   ?    31.809   12.783      ?      ? 
1 1 1   27    9    0 o  221.495   2.3434  1014.71   30.260  1014.71   30.260  1014.71   30.260  221.495   3.3140  221.495   3.3140 0.000000 0.000000 
1 1 1   27    9    1 o   64.716   2.9471   87.456   7.8200   77.964   11.193   96.507   10.930   61.237   4.4316   68.195   3.8860 -6.958363 5.894118 
1 1 1   27    9    2 o   96.244   2.6209  192.995   10.236  187.044   15.837  197.265   13.413   94.911   4.0457   97.577   3.3329 -2.665741 5.241732 
1 1 1   27    9    3 o  132.474   2.7080  364.693   14.015  362.455   23.992  365.852   17.268  132.033   4.4058  132.915   3.1499 -0.8823242 5.415942 
1 1 1   27    9    4 f  114.035   2.6656  269.675   12.534  262.310   17.516  277.404   17.943  112.438   3.7771  115.631   3.7623 -3.192421 5.331165 
1 1 1   27    9    5 o  143.137   2.5900  424.993   15.289  424.707   21.514  425.284   21.733  143.093   3.6454  143.182   3.6801 -0.8926392E-01 5.179927 
1 1 1   27    9    6 o  153.034   2.6076  485.906   16.458  485.728   23.393  486.080   23.158  153.001   3.7070  153.066   3.6683 -0.6517029E-01 5.215166 
1 1 1   27    9    7 o  118.605   2.6666  292.112   13.037  280.645   18.422  303.617   18.452  116.258   3.8420  120.952   3.6988 -4.694656 5.333144 
1 1 1   27    9    8 o   91.342   2.9201  173.626   10.988  182.859   15.524  164.356   15.556   93.798   4.0128   88.885   4.2433 4.912766 5.840219 
1 1 1   27    9    9 o   67.113   3.6081   95.968   9.0252   98.620   10.768   89.708   16.547   68.900   3.7892   65.326   6.1413 3.574173 7.216226 
1 1 1   27    9   10 o   68.216   3.1192   96.819   8.6249   96.122   11.190   97.838   13.537   67.979   3.9912   68.453   4.7946 -0.4741592 6.238460 
1 1 1   27    9   11 o   90.820   2.6803  172.552   9.8146  166.281   15.459  176.786   12.703   89.345   4.1951   92.294   3.3371 -2.948662 5.360530 
1 1 1   27    9   12 o  134.892   2.2299  377.195   12.402  365.272   17.288  389.836   17.801  132.696   3.1587  137.088   3.1484 -4.391922 4.459796 
1 1 1   27    9   13 o   66.222   2.9951   91.360   8.0663   91.183   10.561   91.607   12.497   66.203   3.8676   66.241   4.5743 -0.3796387E-01 5.990245 
1 1 1   27    9   14 o   92.049   2.5845  176.045   9.7023  175.464   12.791  176.833   14.888   91.925   3.3738   92.174   3.9163 -0.2485199 5.169086 
1 1 1   27    9   15 o   25.379   5.2173   13.944   5.9181   17.891   8.3983   10.051   8.3410   28.419   7.1664   22.339   7.5846 6.080502 10.43468 
1 1 1   27    9   16 o   70.782   3.0490  107.074   8.5817   95.305   13.668  114.733   11.026   67.349   4.9204   74.215   3.6022 -6.865906 6.098062 
1 1 1   27    9   17 o   47.485   4.0472   49.477   7.4457   42.006   12.335   53.760   9.3392   44.321   6.7476   50.649   4.4707 -6.327972 8.094299 
1 1 1   27    9   18 o   58.636   3.4489   72.382   8.1708   71.955   12.892   72.668   10.563   58.374   5.3546   58.898   4.3484 -0.5237350 6.897883 
1 1 1   27    9   19 o  104.315   2.7481  226.333   11.764  236.651   17.691  218.153   15.752  106.386   4.0319  102.243   3.7353 4.142891 5.496243 
1 1 1   27    9   20 o   29.246   5.6848   18.870   6.7765   19.924   11.842   18.357   8.2632   29.804   8.9301   28.688   7.0370 1.116220 11.36951 
1 1 1   27    9   21 o   85.211   3.0596  152.337   10.743  152.695   15.535  152.009   14.872   85.276   4.4170   85.146   4.2348 0.1302338 6.119125 
1 1 1   27    9   22 o   96.856   3.2761  197.211   12.674  199.927   20.722  195.588   16.020   97.128   5.1727   96.584   4.0216 0.5441513 6.552102 
1 1 1   27    9   23 o   54.798   4.7090   68.116   10.041   49.517   15.426   81.787   13.226   47.482   7.8770   62.114   5.1626 -14.63231 9.418042 
1 1 1   27    9   24 o   30.032   6.1355   20.965   8.1088   17.297   12.157   23.904   10.884   27.837   9.1510   32.228   8.1753 -4.391346 12.27097 
1 1 1   27    9   25 o   62.594   3.8046   83.304   9.7350   85.991   14.877   81.291   12.874   63.347   5.6939   61.841   5.0476 1.505569 7.609107 
1 1 1   27    9   26 o   42.066   5.1384   39.894   8.5985   37.007   12.893   42.207   11.540   40.067   8.0807   44.065   6.3494 -3.997715 10.27676 
1 1 1   27    9   27 o   43.118   5.3204   41.982   9.2143   42.677   13.734   41.414   12.426   42.950   8.0488   43.286   6.9601 -0.3364220 10.64081 
1 1 1   27    9   28 f   43.488   4.9015   41.910   8.7849   42.940   12.720   40.970   12.147   43.961   7.0153   43.014   6.8471 0.9469910 9.802970 
1 1 1   27    9   29 o   25.846   8.8478  -9.3972   10.349 -11.8373   10.604   39.539   47.488   13.933   6.6445   37.758   16.401 -23.82510 17.69551 
1 1 1   27    9   30 o   28.356   6.6957   19.822   10.934   30.112   12.932  -5.9717   20.474   35.000   8.9294   21.711   9.9797 13.28877 13.39135 
1 1 1   27    9   31 o   22.595   6.8305   5.8863   10.715   8.5493   12.510  -1.4479   20.762   22.348   8.9463   22.843   10.324 -0.4953270 13.66107 
1 1 1   27    9   32 f   51.514   7.1783   62.166   13.865   50.840   16.564   88.665   25.338   45.108   9.2149   57.921   11.009 -12.81271 14.35658 
1 1 1   27    9   33 o   30.167   8.6641   21.487   18.583  -2.2586   29.243   37.572   24.067   25.100   11.673   35.235   12.806 -10.13416 17.32830 
1 1 1   27    9   34 o   26.838   8.4526   11.488   18.838   8.6032   29.120   13.565   24.704   26.737   12.141   26.940   11.763 -0.2028847 16.90522 
1 1 1   27    9   35 o   33.647   10.331   36.612   22.755   66.495   51.420   29.335   25.375   36.421   16.374   30.874   12.602 5.547546 20.66190 
1 1 1   27    9   36 o   43.267   13.371   63.720   26.273   0.0000   0.0000   63.720   26.273  ?   ?    43.267   13.371      ?      ? 
1 1 1   27   10    0 o  119.081   2.6435  294.192   18.320  294.192   18.320  294.192   18.320  119.081   3.7385  119.081   3.7385 0.000000 0.000000 
1 1 1   27   10    1 o   90.909   2.6865  169.797   9.9814  183.895   15.400  159.584   13.107   94.104   3.9678   87.714   3.6231 6.390091 5.373071 
1 1 1   27   10    2 o   83.627   2.8713  145.301   9.8948  144.825   14.285  145.739   13.719   83.482   4.1487   83.772   3.9707 -0.2898865 5.742658 
1 1 1   27   10    3 f   52.645   3.5777   57.406   7.6832   60.505   11.899   55.189   10.062   53.818   5.3604   51.472   4.7398 2.346489 7.155401 
1 1 1   27   10    4 o  100.041   2.7262  207.757   11.247  202.692   15.785  212.981   16.030   98.800   3.8736  101.283   3.8372 -2.483200 5.452421 
1 1 1   27   10    5 o   55.199   3.4771   63.092   7.8527   60.126   10.369   67.080   12.025   53.719   4.6798   56.680   5.1441 -2.961136 6.954298 
1 1 1   27   10    6 f  154.071   2.5918  492.395   16.463  472.558   22.970  513.346   23.606  150.876   3.6913  157.267   3.6393 -6.391068 5.183683 
1 1 1   27   10    7 o  119.534   2.6457  296.721   13.043  300.708   18.556  292.829   18.337  120.328   3.7390  118.740   3.7442 1.587967 5.291405 
1 1 1   27   10    8 o  119.771   2.6512  297.730   13.090  287.223   18.170  309.066   18.873  117.578   3.7469  121.965   3.7519 -4.387695 5.302404 
1 1 1   27   10    9 o  101.793   2.5189  212.507   10.416  200.593   13.453  230.340   16.460   98.323   3.3174  105.263   3.7912 -6.940140 5.037710 
1 1 1   27   10   10 o   43.070   3.7797   39.486   6.5685   48.360   9.2404   30.423   9.3388   48.123   4.6556   38.018   5.9557 10.10408 7.559416 
1 1 1   27   10   11 o   74.750   2.5926  116.045   7.9884  121.762   11.477  110.673   11.126   76.540   3.6355   72.961   3.6974 3.578308 5.185280 
1 1 1   27   10   12 o   90.840   2.4196  171.268   9.0475  157.041   12.627  186.280   12.970   86.947   3.5211   94.734   3.3195 -7.787209 4.839159 
1 1 1   27   10   13 o  102.656   2.5264  219.120   10.551  219.678   13.840  218.346   16.303  102.878   3.2618  102.434   3.8589 0.4438171 5.052749 
1 1 1   27   10   14 o   64.194   3.5363   86.489   8.7624   86.595   10.670   86.271   15.357   64.446   4.0142   63.941   5.8230 0.5047112 7.072584 
1 1 1   27   10   15 o   86.758   3.4709  162.534   11.941  178.016   15.412  139.288   18.886   92.326   4.0474   81.190   5.6397 11.13554 6.941772 
1 1 1   27   10   16 o  141.408   2.4209  416.758   13.814  413.934   21.886  418.628   17.810  140.869   3.7669  141.946   3.0420 -1.077332 4.841837 
1 1 1   27   10   17 o   87.700   2.8574  162.195   10.155  152.274   15.621  169.456   13.364   85.234   4.4435   90.166   3.5936 -4.932266 5.714767 
1 1 1   27   10   18 o   72.928   3.2861  111.739   9.8805  110.004   14.096  113.415   13.853   72.349   4.7240   73.507   4.5693 -1.157761 6.572225 
1 1 1   27   10   19 o   21.870   5.8669   7.3991   7.1163   10.999   11.650   5.2562   8.9883   24.255   8.8953   19.484   7.6523 4.770277 11.73389 
1 1 1   27   10   20 o  138.816   2.5041  404.221   14.062  389.036   21.921  414.837   18.329  136.426   3.8959  141.206   3.1472 -4.780685 5.008277 
1 1 1   27   10   21 o   60.157   3.6938   76.820   9.1473   73.848   13.171   79.589   12.713   58.971   5.4154   61.343   5.0249 -2.372482 7.387521 
1 1 1   27   10   22 o  135.279   3.8367  414.271   18.514  334.860   34.708  445.853   21.888  124.516   6.7583  146.042   3.6338 -21.52630 7.673325 
1 1 1   27   10   23 o   50.740   4.4318   56.115   9.1403   48.063   13.362   63.196   12.531   47.056   6.8849   54.425   5.5822 -7.369492 8.863592 
1 1 1   27   10   24 o   82.149   3.0843  142.192   10.445  146.475   15.076  138.240   14.484   83.327   4.3867   80.971   4.3370 2.355682 6.168685 
1 1 1   27   10   25 o   85.841   3.2726  153.013   11.424  174.248   18.085  138.916   14.735   90.593   4.8402   81.088   4.4060 9.504845 6.545215 
1 1 1   27   10   26 o   66.353   3.6784   94.375   10.033   93.521   14.753   95.111   13.686   65.966   5.4223   66.739   4.9721 -0.7736435 7.356787 
1 1 1   27   10   27 o   85.523   3.1871  154.693   11.194  164.292   16.790  147.012   15.019   87.825   4.6353   83.222   4.3756 4.602539 6.374266 
1 1 1   27   10   28 o   65.510   3.8020   93.289   10.185   86.885   15.063   98.684   13.824   63.194   5.7793   67.826   4.9418 -4.631161 7.604066 
1 1 1   27   10   29 o   43.901   9.0200   49.912   12.872   49.197   13.466   57.481   43.811   46.748   6.9841   41.054   16.633 5.693806 18.03998 
1 1 1   27   10   30 o   49.994   6.7980   61.563   11.906   61.957   13.817   60.429   23.468   52.817   6.3425   47.171   12.026 5.646145 13.59610 
1 1 1   27   10   31 f   30.316   7.6259   21.071   10.991   17.313   12.902   31.010   20.983   26.917   9.4209   33.716   11.994 -6.799692 15.25185 
1 1 1   27   10   32 o   25.631   7.4702   12.787   12.317   12.295   15.185   13.734   21.061   24.598   9.8530   26.663   11.231 -2.065149 14.94045 
1 1 1   27   10   33 o   28.646   8.3821   16.508   17.764  -6.2398   27.097   33.651   23.524   23.648   11.076   33.644   12.584 -9.995882 16.76419 
1 1 1   27   10   34 o   25.022   8.0615   2.4621   17.877   19.277   28.749  -8.1398   22.827   28.683   12.603   21.361   10.056 7.321787 16.12300 
1 1 1   27   10   35 o   23.152   7.9597 -10.5610   20.506 -40.8310   49.984  -4.4355   22.485   24.650   12.284   21.654   10.126 2.995647 15.91946 
1 1 1   27   11    0 o   17.624   6.7728   9.2755   9.8184   9.2755   9.8184   9.2755   9.8184   17.624   9.5782   17.624   9.5782 0.000000 0.000000 
1 1 1   27   11    1 o   25.488   5.7992   13.096   7.1368   8.1860   9.9555   18.288   10.236   22.059   8.1991   28.917   8.2033 -6.858448 11.59831 
1 1 1   27   11    2 o   44.653   4.3261   41.974   7.9424   45.393   11.175   38.486   11.290   46.532   5.8230   42.774   6.3995 3.758816 8.652210 
1 1 1   27   11    3 o  100.724   3.1664  215.149   12.753  193.846   20.119  229.457   16.489   96.341   5.0633  105.106   3.8036 -8.764610 6.332804 
1 1 1   27   11    4 o  114.830   2.6489  273.462   12.536  261.089   17.365  286.931   18.117  112.119   3.7552  117.541   3.7371 -5.421768 5.297856 
1 1 1   27   11    5 o  170.488   2.5834  602.712   18.150  582.850   25.041  624.696   26.345  167.543   3.6238  173.434   3.6829 -5.890762 5.166766 
1 1 1   27   11    6 o  118.379   3.2246  292.245   15.703  292.015   23.044  292.444   21.456  118.288   4.7233  118.470   4.3911 -0.1823730 6.449135 
1 1 1   27   11    7 o   26.194   6.1267   14.013   7.7112   11.793   10.479   16.636   11.388   24.490   8.4948   27.899   8.8308 -3.408867 12.25339 
1 1 1   27   11    8 o   75.436   2.8713  118.677   8.7896  119.639   11.477  117.311   13.668   75.872   3.6677   75.000   4.4186 0.8724518 5.742524 
1 1 1   27   11    9 o   22.999   5.5040   10.446   6.5086   14.669   8.5729   4.7002   10.000   25.951   7.5529   20.048   8.0081 5.903637 11.00796 
1 1 1   27   11   10 o   20.687   5.3355   7.4460   5.9664   9.5146   8.4784   5.4165   8.3977   22.070   7.6418   19.304   7.4480 2.766111 10.67101 
1 1 1   27   11   11 o   18.644   4.8704   3.6494   5.5936   11.294   7.9157  -3.9759   7.9055   23.177   7.3652   14.111   6.3749 9.065276 9.740867 
1 1 1   27   11   12 o   64.871   2.7721   87.617   7.4165   87.763   10.444   87.468   10.534   64.929   3.8999   64.813   3.9406 0.1156464 5.544140 
1 1 1   27   11   13 o   56.758   3.2541   66.982   7.5613   63.992   10.012   70.952   11.536   55.331   4.3870   58.184   4.8072 -2.853222 6.508107 
1 1 1   27   11   14 o   79.431   2.7526  132.877   8.8942  140.522   11.862  123.059   13.442   82.155   3.5008   76.708   4.2487 5.446289 5.505190 
1 1 1   27   11   15 o   59.727   3.4870   74.702   8.5572   78.509   12.782   71.609   11.519   61.067   5.0751   58.388   4.7834 2.678532 6.974017 
1 1 1   27   11   16 o   82.328   2.8006  141.785   9.2486  140.746   14.889  142.439   11.802   81.956   4.4047   82.699   3.4600 -0.7426605 5.601161 
1 1 1   27   11   17 o   83.712   2.8834  146.271   9.8469  148.552   15.128  144.595   12.971   84.194   4.3564   83.230   3.7785 0.9645004 5.766756 
1 1 1   27   11   18 o   16.936   5.0442  -6.6378   6.7238   9.1565   10.658 -17.0793   8.6659   22.734   8.4769   11.139   5.4699 11.59451 10.08848 
1 1 1   27   11   19 o   69.348   3.1299  101.258   8.6914   99.268   14.005  102.505   11.084   68.645   4.9465   70.050   3.8364 -1.405052 6.259885 
1 1 1   27   11   20 o   48.241   4.2176   49.946   8.3002   47.747   12.525   51.667   11.083   47.153   6.4402   49.330   5.4474 -2.177021 8.435113 
1 1 1   27   11   21 o   45.103   5.6084   44.360   10.014   40.802   12.803   49.967   16.071   43.346   7.1613   46.860   8.6331 -3.514149 11.21671 
1 1 1   27   11   22 o   32.822   6.9126   28.501   10.510  -1.1070   25.286   34.684   11.556   26.321   11.680   39.323   7.3965 -13.00166 13.82518 
1 1 1   27   11   23 o   80.768   3.2543  137.707   10.792  120.865   14.962  155.974   15.582   75.539   4.8023   85.997   4.3931 -10.45827 6.508584 
1 1 1   27   11   24 o   42.133   5.0329   39.576   8.4942   35.916   12.254   42.961   11.785   39.733   7.7558   44.534   6.4163 -4.800922 10.06584 
1 1 1   27   11   25 o   16.125   5.2215  -6.0387   7.8596 -10.6917   12.210  -2.7468   10.270   15.723   7.3869   16.527   7.3817 -0.8037863 10.44294 
1 1 1   27   11   26 o   49.456   4.3844   53.240   8.9262   54.918   13.104   51.788   12.192   50.121   6.3390   48.791   6.0587 1.329700 8.768747 
1 1 1   27   11   27 o   34.044   6.1180   26.991   8.5439   32.894   13.304   22.848   11.146   37.075   8.8273   31.012   8.4735 6.063288 12.23606 
1 1 1   27   11   28 o   64.070   3.8717   89.092   10.220   94.856   14.665   83.649   14.251   66.142   5.3759   61.998   5.5732 4.143288 7.743460 
1 1 1   27   11   29 o   63.963   9.0891  135.134   14.869  141.387   15.717   81.868   45.871   81.108   4.6984   46.817   17.560 34.29099 18.17816 
1 1 1   27   11   30 o   64.695   5.4116   96.896   12.709   97.983   14.955   94.069   24.112   67.027   5.4096   62.362   9.3744 4.664894 10.82322 
1 1 1   27   11   31 o   25.976   7.4890   7.9489   12.372  -1.9396   15.045   28.604   21.743   19.596   8.8288   32.356   12.099 -12.75973 14.97796 
1 1 1   27   11   32 o   23.554   7.2636   4.1554   12.394  -1.3385   14.966   16.150   22.113   19.574   8.8135   27.534   11.548 -7.959879 14.52718 
1 1 1   27   11   33 o   20.385   6.9123 -19.0032   17.143 -39.3532   27.459  -6.0065   21.944   19.156   9.4693   21.615   10.072 -2.459015 13.82459 
1 1 1   27   11   34 o   51.887   8.6497   86.175   19.397   59.232   29.796  105.990   25.553   40.198   14.294   63.577   9.7448 -23.37937 17.29947 
1 1 1   27   11   35 o   26.213   9.0237 -10.0657   20.170   53.663   50.797 -21.9938   21.977   33.938   15.644   18.487   8.9988 15.45100 18.04748 
1 1 1   27   12    0 o   91.351   2.7840  173.761   14.772  173.761   14.772  173.761   14.772   91.351   3.9372   91.351   3.9372 0.000000 0.000000 
1 1 1   27   12    1 o   48.897   3.9332   50.172   7.9246   48.053   11.265   52.248   11.151   47.853   5.7074   49.942   5.4134 -2.088715 7.866357 
1 1 1   27   12    2 o  124.182   2.5935  320.316   13.283  315.983   18.689  324.737   18.881  123.332   3.6741  125.032   3.6613 -1.699753 5.186943 
1 1 1   27   12    3 o   26.712   5.7784   15.052   7.1496   20.075   10.200   10.200   10.024   30.138   8.0525   23.286   8.2896 6.851486 11.55684 
1 1 1   27   12    4 o   31.401   5.0032   20.108   6.5985   11.808   8.5829   32.104   10.318   23.795   7.6807   39.007   6.4136 -15.21219 10.00634 
1 1 1   27   12    5 o   73.548   2.9203  110.594   8.7324  101.262   11.264  124.649   13.824   69.767   3.9146   77.329   4.3345 -7.562225 5.840502 
1 1 1   27   12    6 o   44.715   4.4202   42.143   8.1445   44.705   11.680   39.719   11.363   46.053   6.1493   43.377   6.3512 2.675735 8.840337 
1 1 1   27   12    7 o   82.543   3.0075  141.819   10.225  152.402   14.738  131.997   14.199   85.524   4.1782   79.563   4.3270 5.960716 6.014959 
1 1 1   27   12    8 o   54.285   3.4828   60.424   7.6809   55.016   9.8839   68.669   12.204   51.319   4.6697   57.252   5.1684 -5.932983 6.965526 
1 1 1   27   12    9 o   54.560   3.4839   63.521   7.6297   69.073   10.001   55.791   11.801   57.574   4.2118   51.546   5.5507 6.027248 6.967735 
1 1 1   27   12   10 o  131.310   2.3815  357.451   12.738  361.648   19.670  354.419   16.716  131.904   3.6156  130.716   3.1006 1.188736 4.763034 
1 1 1   27   12   11 o   79.281   2.7268  129.817   8.8393  138.739   13.585  123.265   11.641   81.588   4.0370   76.974   3.6666 4.613098 5.453600 
1 1 1   27   12   12 o  108.231   2.4014  243.921   10.684  247.549   14.592  239.730   15.686  109.140   3.2417  107.322   3.5438 1.817963 4.802813 
1 1 1   27   12   13 o   56.755   3.4075   68.702   7.8024   73.853   10.282   61.708   11.981   59.427   4.1947   54.083   5.3711 5.344566 6.815034 
1 1 1   27   12   14 o   84.037   2.9718  146.471   10.248  160.390   15.476  135.602   13.676   87.538   4.2865   80.536   4.1173 7.002419 5.943603 
1 1 1   27   12   15 o   40.645   4.9168   36.526   7.9088   31.612   11.776   40.564   10.674   37.573   7.8521   43.717   5.9199 -6.144272 9.833659 
1 1 1   27   12   16 o  117.870   2.5756  289.067   12.381  294.339   19.055  285.215   16.288  118.704   3.8921  117.035   3.3744 1.668533 5.151176 
1 1 1   27   12   17 o   73.521   3.0397  112.211   9.0069  117.945   14.507  108.613   11.490   74.926   4.6944   72.116   3.8628 2.810287 6.079407 
1 1 1   27   12   18 o   98.333   2.8309  203.565   11.374  190.255   16.943  214.485   15.346   95.278   4.3115  101.387   3.6698 -6.109291 5.661778 
1 1 1   27   12   19 o   81.491   2.8579  135.226   9.2315  153.253   15.745  125.783   11.396   85.368   4.4719   77.615   3.5598 7.752800 5.715812 
1 1 1   27   12   20 o   56.008   3.4863   64.868   7.7663   71.775   13.075   61.103   9.6536   58.106   5.4559   53.909   4.3417 4.197083 6.972601 
1 1 1   27   12   21 o   24.577   6.3705   11.704   8.6150   5.6273   14.118   15.309   10.874   22.724   9.3518   26.431   8.6532 -3.707346 12.74107 
1 1 1   27   12   22 f   29.192   6.6940   17.960   8.8700   25.052   15.242   14.328   10.907   32.670   10.199   25.714   8.6734 6.956373 13.38801 
1 1 1   27   12   23 o   21.802   6.0026   7.6109   7.8234   4.8098   11.832   9.7869   10.429   20.893   8.5755   22.711   8.4015 -1.818521 12.00517 
1 1 1   27   12   24 o   42.197   4.8810   38.938   8.4807   40.831   12.438   37.294   11.593   43.119   6.9941   41.274   6.8102 1.844933 9.762001 
1 1 1   27   12   25 o   24.432   6.2472   12.388   8.2314   8.2464   12.531   15.531   10.917   22.662   8.9921   26.202   8.6747 -3.540854 12.49432 
1 1 1   27   12   26 o   90.350   3.7372  177.262   13.676  185.846   18.031  165.634   20.986   93.354   4.6830   87.347   5.8253 6.006721 7.474306 
1 1 1   27   12   27 o   31.227   7.0894   23.967   10.273   24.637   13.253   22.958   16.262   31.749   9.4322   30.704   10.586 1.044975 14.17872 
1 1 1   27   12   28 o   84.177   4.3184  160.951   13.746  169.481   16.765  143.453   24.010   88.906   4.5720   79.447   7.3274 9.458443 8.636783 
1 1 1   27   12   29 o   74.583   4.4966  117.822   12.693  109.430   15.000  138.981   23.820   71.078   5.1168   78.089   7.3957 -7.011398 8.993218 
1 1 1   27   12   30 o   45.536   7.4082   76.858   14.322   86.666   15.090 -12.2728   45.489   62.633   5.8413   28.439   13.616 34.19475 14.81630 
1 1 1   27   12   31 o   38.424   8.1091   36.074   13.050   25.957   15.496   60.740   24.197   31.282   10.334   45.565   12.499 -14.28214 16.21810 
1 1 1   27   12   32 o   55.348   6.8605   71.434   14.550   58.499   17.413  101.365   26.487   48.201   9.0921   62.494   10.276 -14.29247 13.72109 
1 1 1   27   12   33 f   33.869   9.3003   36.865   18.387   42.372   28.614   32.991   23.997   35.147   13.696   32.591   12.586 2.555367 18.60065 
1 1 1   27   12   34 o   26.033   8.2217   11.874   17.706   16.076   27.852   9.0236   22.938   27.317   12.182   24.749   11.045 2.568031 16.44333 
1 1 1   27   13    0 o   23.361   7.1319   16.418   9.9994   16.418   9.9994   16.418   9.9994   23.361   10.086   23.361   10.086 0.000000 0.000000 
1 1 1   27   13    1 o   22.290   5.4260   7.6841   6.8498   16.926   9.6093  -1.8642   9.7670   27.781   7.9708   16.800   7.3644 10.98122 10.85207 
1 1 1   27   13    2 o   51.339   3.6228   56.109   7.5212   61.402   10.027   49.300   11.373   54.245   4.4818   48.433   5.6932 5.812622 7.245634 
1 1 1   27   13    3 o   46.243   3.8078   45.372   7.1304   48.073   9.4168   41.742   10.916   47.960   4.7606   44.526   5.9443 3.434441 7.615599 
1 1 1   27   13    4 f   77.330   2.9918  119.607   9.1137  108.860   11.127  141.517   15.887   72.356   3.7284   82.304   4.6800 -9.947975 5.983601 
1 1 1   27   13    5 o  140.612   2.5757  410.686   14.930  393.223   20.848  429.073   21.392  137.535   3.6752  143.688   3.6097 -6.153015 5.151431 
1 1 1   27   13    6 o   58.992   3.5259   73.046   8.5412   65.487   12.109   80.532   12.050   55.898   5.2522   62.086   4.7056 -6.187904 7.051770 
1 1 1   27   13    7 o  191.967   2.6292  766.125   20.816  757.401   29.292  775.026   29.588  190.861   3.7210  193.072   3.7156 -2.210129 5.258480 
1 1 1   27   13    8 o   82.312   2.7029  138.053   9.0414  124.993   11.640  157.917   14.356   77.540   3.6397   87.084   3.9968 -9.543877 5.405764 
1 1 1   27   13    9 o  105.969   2.2681  233.046   9.9113  227.547   13.878  238.772   14.160  104.692   3.2140  107.246   3.2011 -2.554031 4.536233 
1 1 1   27   13   10 o   55.631   3.0435   64.775   6.9646   59.315   9.8391   70.258   9.8597   53.247   4.4802   58.015   4.1206 -4.767677 6.086983 
1 1 1   27   13   11 f   82.638   2.4694  142.100   8.4130  136.333   11.769  148.126   12.031   80.916   3.5265   84.359   3.4577 -3.442818 4.938810 
1 1 1   27   13   12 o  108.034   2.2827  242.576   10.168  235.933   14.185  249.598   14.584  106.514   3.2289  109.555   3.2275 -3.041443 4.565375 
1 1 1   27   13   13 f   24.464   5.1835   12.751   5.9454   7.0355   8.4560   18.338   8.3608   20.243   7.5501   28.684   7.1042 -8.441059 10.36693 
1 1 1   27   13   14 o   29.928   5.8652   19.146   7.4802   26.463   11.864   14.318   9.6371   34.164   8.4631   25.691   8.1226 8.472919 11.73039 
1 1 1   27   13   15 o  120.098   2.6485  297.761   13.019  327.055   19.964  276.081   17.174  125.135   3.8681  115.062   3.6189 10.07372 5.297020 
1 1 1   27   13   16 o   44.950   5.1910   44.625   8.1368   43.321   15.877   45.089   9.4759   43.623   9.1179   46.277   4.9647 -2.653919 10.38194 
1 1 1   27   13   17 o   50.198   4.1203   52.825   8.4748   60.786   12.867   46.725   11.263   53.493   5.8317   46.903   5.8224 6.590992 8.240697 
1 1 1   27   13   18 o   52.489   4.0168   59.332   8.5788   52.420   12.691   65.148   11.641   49.478   6.2191   55.499   5.0855 -6.020885 8.033673 
1 1 1   27   13   19 o  112.445   2.5455  259.864   11.399  280.903   19.055  248.139   14.226  115.759   3.9911  109.130   3.1606 6.629379 5.091003 
1 1 1   27   13   20 o   39.376   5.1195   40.279   7.3008   19.857   12.478   50.909   9.0025   29.577   9.2269   49.175   4.4386 -19.59846 10.23899 
1 1 1   27   13   21 o   32.409   6.2962   24.945   8.6012   20.892   14.332   27.226   10.753   30.260   9.9354   34.559   7.7368 -4.298676 12.59246 
1 1 1   27   13   22 f   82.031   3.8140  148.020   12.256  127.297   19.905  160.674   15.554   76.766   6.2868   87.295   4.3201 -10.52915 7.628009 
1 1 1   27   13   23 o   69.063   3.5345  102.705   9.9305   86.067   14.303  118.189   13.798   63.385   5.4711   74.740   4.4761 -11.35503 7.068903 
1 1 1   27   13   24 o   23.711   6.1436   11.033   7.8547   14.223   11.790   8.4860   10.533   25.591   9.0028   21.831   8.3620 3.760153 12.28714 
1 1 1   27   13   25 o   52.239   4.4141   60.725   9.3054   50.484   13.745   69.392   12.644   47.725   6.9827   56.752   5.4017 -9.026505 8.828146 
1 1 1   27   13   26 o   79.016   3.4669  134.705   11.108  128.448   17.104  139.269   14.607   77.114   5.3778   80.918   4.3768 -3.803314 6.933797 
1 1 1   27   13   27 o   31.291   6.4926   24.237   9.0562   19.762   13.189   28.230   12.457   28.585   9.5379   33.998   8.8116 -5.412081 12.98524 
1 1 1   27   13   28 o   21.896   6.5614   5.3719   10.030   7.8350   12.212   0.2641   17.585   21.931   8.8178   21.861   9.7188 0.7001114E-01 13.12282 
1 1 1   27   13   29 o   44.862   6.5879   58.378   11.291   71.193   13.511   28.709   20.557   56.886   5.7585   32.839   11.851 24.04689 13.17587 
1 1 1   27   13   30 o   38.316   9.5664   36.244   13.029   34.043   13.535   64.014   48.074   36.786   8.9960   39.846   16.886 -3.060570 19.13270 
1 1 1   27   13   31 o   41.006   7.3488   50.117   13.509   60.721   16.327   27.103   24.053   50.679   7.8111   31.332   12.450 19.34707 14.69762 
1 1 1   27   13   32 o   37.701   8.2864   38.814   13.237   33.707   15.652   51.637   24.803   35.153   10.198   40.249   13.063 -5.095985 16.57274 
1 1 1   27   13   33 o   23.867   11.166  -1.5069   27.395  -1.5069   27.395   0.0000   0.0000   23.867   11.166  ?   ?       ?      ? 
1 1 1   27   13   34 f   25.496   8.6489  -0.7548   21.135   15.548   47.091  -4.8671   23.650   29.076   13.903   21.916   10.291 7.160545 17.29780 
1 1 1   27   14    0 o   99.804   2.7057  207.201   15.698  207.201   15.698  207.201   15.698   99.804   3.8264   99.804   3.8264 0.000000 0.000000 
1 1 1   27   14    1 o   53.447   3.4023   58.632   7.4187   52.628   9.6617   67.257   11.580   50.195   4.6669   56.699   4.9520 -6.503845 6.804543 
1 1 1   27   14    2 o   85.480   2.6487  151.718   9.2410  150.463   12.197  153.410   14.158   85.114   3.4745   85.845   3.9988 -0.7309799 5.297437 
1 1 1   27   14    3 o   68.312   2.9222   97.621   8.1225   99.887   10.721   94.567   12.445   69.307   3.7504   67.317   4.4824 1.990410 5.844460 
1 1 1   27   14    4 o   32.279   4.9459   21.582   6.5643   14.199   8.5646   32.094   10.220   25.580   7.5788   38.979   6.3569 -13.39980 9.891786 
1 1 1   27   14    5 o   80.972   2.9962  136.797   9.9993  132.104   14.221  141.386   14.063   79.578   4.3328   82.367   4.1396 -2.789284 5.992408 
1 1 1   27   14    6 o  103.874   2.7289  224.597   11.690  227.656   16.670  221.637   16.398  104.569   3.8652  103.180   3.8533 1.388695 5.457765 
1 1 1   27   14    7 o   42.033   4.2639   36.413   6.9455   24.882   9.0018   53.378   10.918   33.665   6.7184   50.401   5.2524 -16.73519 8.527888 
1 1 1   27   14    8 o   94.868   2.3469  187.049   9.1813  183.942   12.836  190.304   13.138   94.064   3.3087   95.672   3.3294 -1.607880 4.693848 
1 1 1   27   14    9 o   70.711   2.6411  104.257   7.7012  102.736   10.934  105.754   10.849   70.191   3.7768   71.232   3.6928 -1.040817 5.282135 
1 1 1   27   14   10 o   81.853   2.4865  139.389   8.3860  148.416   12.063  130.945   11.666   84.427   3.4641   79.279   3.5679 5.148041 4.972967 
1 1 1   27   14   11 o  118.698   2.4830  296.476   11.941  275.552   18.324  311.923   15.744  114.894   3.8668  122.501   3.1160 -7.607063 4.966091 
1 1 1   27   14   12 o   43.811   3.6750   40.976   6.5081   50.089   9.1971   31.836   9.2106   48.862   4.5637   38.759   5.7616 10.10286 7.350091 
1 1 1   27   14   13 o  139.942   2.4384  406.409   13.847  416.463   21.727  399.532   17.970  141.275   3.7287  138.608   3.1433 2.666794 4.876828 
1 1 1   27   14   14 o   44.581   4.7072   45.317   7.9549   31.447   11.932   56.414   10.673   37.410   7.9767   51.752   5.0002 -14.34203 9.414349 
1 1 1   27   14   15 o   66.410   3.4156   91.782   9.3056  103.479   14.045   82.629   12.424   70.135   4.8553   62.685   4.8054 7.450134 6.831223 
1 1 1   27   14   16 o   36.457   5.1011   27.985   7.1438   35.961   12.217   23.840   8.8065   40.127   7.6610   32.787   6.7375 7.339333 10.20224 
1 1 1   27   14   17 o   96.504   2.8140  194.222   11.149  204.090   16.738  186.352   14.947   98.645   4.1140   94.363   3.8406 4.282600 5.628053 
1 1 1   27   14   18 o   24.446   5.7296   12.075   6.3661   15.378   11.373   10.568   7.6824   26.608   8.8560   22.284   7.2721 4.323933 11.45916 
1 1 1   27   14   19 o   50.032   3.7793   53.514   7.3757   52.126   12.565   54.244   9.1103   49.285   6.1815   50.779   4.3499 -1.493706 7.558599 
1 1 1   27   14   20 o   62.558   3.9826   84.877   8.9673   80.992   17.393   86.284   10.465   61.010   6.9121   64.107   3.9581 -3.097458 7.965141 
1 1 1   27   14   21 o   41.286   5.6867   37.219   9.0022   45.427   15.365   32.929   11.108   44.356   8.7098   38.216   7.3140 6.140057 11.37343 
1 1 1   27   14   22 o   36.269   7.1778   34.551   10.912   15.111   25.620   38.859   12.061   30.412   12.566   42.126   6.9415 -11.71378 14.35553 
1 1 1   27   14   23 o   75.858   3.4726  122.751   10.863  124.614   15.511  120.957   15.219   76.417   4.9214   75.299   4.9005 1.118675 6.945180 
1 1 1   27   14   24 f   27.670   5.6977   14.185   8.1316   32.706   12.432   0.3373   10.750   37.317   8.2928   18.023   7.8158 19.29378 11.39549 
1 1 1   27   14   25 o   23.700   5.9013   10.752   8.0666  -0.6017   12.226   19.503   10.734   18.674   8.2116   28.725   8.4778 -10.05082 11.80265 
1 1 1   27   14   26 o   35.795   6.1334   31.033   8.8105   30.705   14.154   31.241   11.258   35.137   9.5268   36.453   7.7275 -1.315742 12.26684 
1 1 1   27   14   27 o   45.689   5.5611   49.975   9.9042   39.776   14.872   58.105   13.277   40.194   9.1731   51.183   6.2894 -10.98894 11.12211 
1 1 1   27   14   28 o   36.442   6.6464   36.235   10.904   45.048   13.285   18.042   19.087   44.502   7.2379   28.381   11.150 16.12192 13.29281 
1 1 1   27   14   29 o   30.675   7.1115   24.958   10.521   28.316   12.648   17.415   18.957   33.600   8.9619   27.749   11.044 5.851305 14.22305 
1 1 1   27   14   30 o   33.996   7.1772   37.363   15.260   52.062   16.280 -69.0207   43.798   45.615   8.9732   22.377   11.204 23.23842 14.35433 
1 1 1   27   14   31 o   24.052   7.3920   3.1791   13.261  -6.6471   16.379   21.876   22.593   18.869   8.7623   29.235   11.907 -10.36607 14.78393 
1 1 1   27   14   32 o   37.123   8.2541   40.421   13.565   38.113   16.474   45.280   23.907   36.956   10.380   37.291   12.837 -0.3355293 16.50829 
1 1 1   27   14   33 f   58.551   8.6266  106.888   20.704   72.444   30.039  138.056   28.575   44.582   14.367   72.520   9.5535 -27.93823 17.25320 
1 1 1   27   15    0 o   93.159   2.3724  180.339   12.853  180.339   12.853  180.339   12.853   93.159   3.3551   93.159   3.3551 0.000000 0.000000 
1 1 1   27   15    1 o  121.633   2.2276  306.993   11.171  319.124   15.975  295.385   15.627  123.991   3.1238  119.276   3.1765 4.713966 4.455159 
1 1 1   27   15    2 o   38.516   4.5241   31.952   6.8717   32.145   8.9030   31.668   10.808   39.074   5.5243   37.958   7.1659 1.115990 9.048124 
1 1 1   27   15    3 o   79.550   2.7340  132.481   8.8193  135.393   11.542  128.395   13.672   80.686   3.4682   78.413   4.2274 2.272865 5.468024 
1 1 1   27   15    4 o   26.169   5.6774   14.502   7.1368   7.2408   10.312   21.178   9.8877   21.544   8.2687   30.793   7.7819 -9.248529 11.35474 
1 1 1   27   15    5 o   76.433   3.1019  122.677   9.7240  108.163   13.770  137.117   13.734   71.839   4.6472   81.027   4.1097 -9.187332 6.203702 
1 1 1   27   15    6 o   64.124   3.3984   86.329   8.9839   86.291   12.894   86.366   12.524   64.093   4.8777   64.155   4.7332 -0.6234741E-01 6.796707 
1 1 1   27   15    7 o   84.764   2.4861  149.621   8.6904  146.333   12.221  152.984   12.360   83.818   3.5353   85.710   3.4964 -1.892944 4.972175 
1 1 1   27   15    8 o   88.700   2.3864  163.720   8.7291  167.820   12.426  159.727   12.265   89.801   3.3550   87.600   3.3946 2.201393 4.772797 
1 1 1   27   15    9 o  123.984   2.2100  319.501   11.300  326.509   16.074  312.656   15.888  125.333   3.1096  122.636   3.1411 2.697411 4.419992 
1 1 1   27   15   10 o   71.747   2.6027  107.328   7.7000  103.987   10.805  110.776   10.976   70.606   3.7104   72.888   3.6510 -2.281807 5.205451 
1 1 1   27   15   11 o   74.361   2.5879  115.341   7.9349  118.751   11.243  111.957   11.201   75.467   3.6120   73.255   3.7072 2.211952 5.175885 
1 1 1   27   15   12 o   17.665   5.0199   1.6685   6.2761  -9.8044   10.375   8.2900   7.8819   14.572   6.8342   20.758   7.3548 -6.186551 10.03987 
1 1 1   27   15   13 o   21.090   5.5727   7.5965   6.3021   8.1313   10.646   7.3080   7.8194   22.145   8.4248   20.034   7.2968 2.110941 11.14545 
1 1 1   27   15   14 o  110.222   2.7980  253.974   12.714  254.879   17.740  253.019   18.232  110.447   3.8943  109.997   4.0186 0.4500732 5.595996 
1 1 1   27   15   15 o   44.889   4.7343   45.557   8.1545   32.774   12.029   56.426   11.092   38.131   7.9081   51.646   5.2074 -13.51530 9.468641 
1 1 1   27   15   16 o   26.213   5.7130   12.812   7.1530   24.888   11.540   5.2763   9.1155   32.942   8.4518   19.485   7.6890 13.45674 11.42601 
1 1 1   27   15   17 o   76.180   3.1336  123.345   9.7392  109.595   14.296  135.254   13.304   72.042   4.8112   80.318   4.0162 -8.275673 6.267157 
1 1 1   27   15   18 o   78.924   2.8647  131.651   8.9181  127.453   14.838  134.024   11.158   77.723   4.6288   80.126   3.3764 -2.402725 5.729375 
1 1 1   27   15   19 o   18.609   5.4237   3.5246   6.3503   2.1074   11.553   4.1381   7.6016   19.557   8.2822   17.661   7.0050 1.895285 10.84738 
1 1 1   27   15   20 o   65.160   3.8367   87.821   9.0672   96.788   18.037   84.788   10.489   66.808   6.5459   63.511   4.0041 3.296402 7.673428 
1 1 1   27   15   21 o   30.104   5.8242   21.170   7.8920   11.959   11.492   29.392   10.857   24.335   8.8484   35.874   7.5756 -11.53940 11.64834 
1 1 1   27   15   22 o   33.655   6.2524   28.997   9.2480   15.251   15.522   36.563   11.515   27.164   10.210   40.145   7.2200 -12.98123 12.50475 
1 1 1   27   15   23 f   18.087   5.5057  -0.4607   7.8183  -8.6125   11.914   5.7053   10.361   15.967   7.4342   20.206   8.1231 -4.238654 11.01144 
1 1 1   27   15   24 o   29.670   6.2761   20.528   8.3205   25.744   12.483   16.359   11.161   32.695   8.9813   26.646   8.7688 6.048662 12.55210 
1 1 1   27   15   25 o   51.820   4.2703   59.133   9.0962   56.131   13.163   61.878   12.584   50.400   6.3324   53.239   5.7310 -2.839668 8.540674 
1 1 1   27   15   26 o   30.992   6.2656   24.028   8.8543   15.064   13.294   31.174   11.870   25.916   9.5027   36.069   8.1689 -10.15389 12.53125 
1 1 1   27   15   27 o   69.876   4.9830  103.684   13.646   90.050   16.500  133.195   24.274   63.685   6.2816   76.067   7.7372 -12.38113 9.966097 
1 1 1   27   15   28 o   62.954   6.2382   95.070   16.111  107.400   23.229   83.640   22.365   67.334   8.3642   58.574   9.2574 8.759830 12.47635 
1 1 1   27   15   29 o   17.545   5.8475  -8.9429   10.112  -8.6846   12.163  -9.5207   18.193   15.752   7.3916   19.337   9.0631 -3.585026 11.69507 
1 1 1   27   15   30 o   43.769   9.3938   49.071   16.450   49.071   16.450   0.0000   0.0000   43.769   9.3938  ?   ?       ?      ? 
1 1 1   27   15   31 o   15.207   5.3033 -26.4871   11.704 -17.1013   14.082 -47.4526   21.047   15.120   7.3231   15.293   7.6728 -0.1729879 10.60660 
1 1 1   27   15   32 o   42.878   7.8679   52.127   13.647   48.145   17.080   59.154   22.693   41.934   10.014   43.821   12.139 -1.887466 15.73589 
1 1 1   27   16    0 o   63.983   2.8125   85.926   10.403   85.926   10.403   85.926   10.403   63.983   3.9775   63.983   3.9775 0.000000 0.000000 
1 1 1   27   16    1 o  156.162   2.1954  506.773   14.140  511.978   20.071  501.645   19.923  156.960   3.1004  155.365   3.1091 1.595337 4.390782 
1 1 1   27   16    2 o   56.248   3.0424   66.414   6.9880   78.402   10.015   55.038   9.7553   61.273   3.9628   51.224   4.6175 10.04940 6.084833 
1 1 1   27   16    3 o  120.482   2.2218  301.687   11.039  294.491   15.512  309.070   15.712  119.021   3.1600  121.943   3.1240 -2.921448 4.443500 
1 1 1   27   16    4 f   65.819   3.1513   90.669   8.3476   91.259   13.363   90.292   10.690   65.880   4.9180   65.757   3.9416 0.1233826 6.302574 
1 1 1   27   16    5 o  111.676   2.5061  260.176   11.376  257.683   17.604  261.963   14.906  111.117   3.8411  112.234   3.2200 -1.117294 5.012265 
1 1 1   27   16    6 o   21.325   5.5813   8.1188   6.4891   5.4440   10.569   9.7373   8.2213   20.674   8.2408   21.977   7.5296 -1.303015 11.16270 
1 1 1   27   16    7 o   61.252   2.8189   78.390   7.1208   78.404   10.140   78.377   10.002   61.251   4.0139   61.252   3.9591 -0.3128052E-03 5.637897 
1 1 1   27   16    8 o   17.712   4.8734   3.0657   5.5376   8.6154   7.6474  -3.0521   8.0292   20.889   7.2563   14.536   6.5073 6.352087 9.746745 
1 1 1   27   16    9 o   32.122   4.6000   22.851   5.9778   15.155   8.4139   30.695   8.4944   26.136   7.4453   38.108   5.4044 -11.97199 9.200041 
1 1 1   27   16   10 o   72.987   2.5818  111.102   7.7715  111.731   11.070  110.491   10.912   73.187   3.6675   72.787   3.6350 0.3999710 5.163661 
1 1 1   27   16   11 o   71.780   2.6965  107.297   7.9586  110.900   11.800  104.290   10.779   72.856   3.9270   70.704   3.6964 2.152489 5.393004 
1 1 1   27   16   12 o   75.511   2.8626  119.848   8.6600  116.636   13.911  121.880   11.066   74.549   4.5243   76.472   3.5084 -1.922646 5.725235 
1 1 1   27   16   13 o   29.388   5.5206   18.787   6.5752   22.176   11.124   16.967   8.1518   31.238   8.4357   27.537   7.1236 3.701345 11.04118 
1 1 1   27   16   14 o   69.258   3.1063   99.014   8.6943  109.786   14.025   92.291   11.080   72.163   4.7123   66.354   4.0487 5.809189 6.212669 
1 1 1   27   16   15 o   19.696   5.5385   5.2311   6.6810   3.6155   10.600   6.2959   8.6052   19.645   8.0964   19.747   7.5596 -0.1013508 11.07699 
1 1 1   27   16   16 o   37.022   5.9737   42.258   11.290   58.075   12.531 -25.9032   26.013   52.151   5.8259   21.892   10.431 30.25871 11.94746 
1 1 1   27   16   17 o   38.639   5.1112   33.383   7.7955   31.474   12.195   34.703   10.137   37.080   8.1921   40.197   6.1145 -3.116665 10.22238 
1 1 1   27   16   18 o   71.499   3.1321  110.242   8.7415   99.899   14.576  116.051   10.924   68.534   5.1565   74.463   3.5570 -5.928902 6.264280 
1 1 1   27   16   19 o   41.504   5.1781   36.489   7.5989   42.615   15.206   34.451   8.7728   42.812   8.9021   40.195   5.2917 2.616180 10.35616 
1 1 1   27   16   20 o   24.743   5.6886   13.735   6.5625   10.900   11.372   15.151   8.0356   23.663   8.7694   25.823   7.2482 -2.160072 11.37714 
1 1 1   27   16   21 o   52.554   4.1633   60.796   8.8018   46.687   12.574   74.350   12.325   46.148   6.6064   58.960   5.0682 -12.81263 8.326569 
1 1 1   27   16   22 o   98.784   3.4293  213.660   13.565  178.443   20.648  240.401   17.993   90.948   5.5046  106.620   4.0915 -15.67171 6.858636 
1 1 1   27   16   23 f   54.123   4.1025   63.658   9.1409   63.726   13.332   63.597   12.557   54.064   5.9791   54.181   5.6190 -0.1169319 8.205037 
1 1 1   27   16   24 o   50.358   5.1245   58.854   10.033   64.724   13.194   50.804   15.449   54.375   5.8833   46.340   8.3923 8.035236 10.24907 
1 1 1   27   16   25 o   60.199   4.0864   78.149   10.059   92.370   15.417   67.610   13.272   64.898   5.7598   55.501   5.7981 9.397011 8.172709 
1 1 1   27   16   26 o   42.558   5.6887   42.502   9.5735   47.507   14.456   38.591   12.777   44.762   8.1296   40.355   7.9595 4.406975 11.37733 
1 1 1   27   16   27 o   54.053   6.3959   75.366   12.817   88.652   16.382   54.395   20.581   62.996   6.3050   45.111   11.130 17.88407 12.79178 
1 1 1   27   16   28 o   56.267   5.9854   77.601   12.616   80.547   15.665   72.166   21.280   59.753   6.3564   52.781   10.144 6.971489 11.97084 
1 1 1   27   16   29 o   70.886   5.1214  115.908   14.765  111.499   19.229  122.243   23.047   69.859   6.6738   71.913   7.7702 -2.054047 10.24287 
1 1 1   27   16   30 o   25.377   7.2527   13.368   12.679   22.174   15.835  -2.3668   21.167   28.800   10.400   21.955   10.112 6.845007 14.50550 
1 1 1   27   16   31 o   22.700   9.6476   8.6530   15.769   8.6530   15.769   0.0000   0.0000   22.700   9.6476  ?   ?       ?      ? 
1 1 1   27   16   32 f   29.762   8.9114   22.047   18.571   46.471   30.637   7.8579   23.351   35.053   14.012   24.472   11.015 10.58169 17.82271 
1 1 1   27   17    0 o   27.172   5.9648   19.386   8.2804   19.386   8.2804   19.386   8.2804   27.172   8.4355   27.172   8.4355 0.000000 0.000000 
1 1 1   27   17    1 o   20.139   4.9855   6.6507   5.5710   0.4416   7.8577   12.926   7.8996   15.959   6.7971   24.320   7.2953 -8.361262 9.971055 
1 1 1   27   17    2 f   62.119   2.8381   80.667   7.2653   84.791   10.312   76.603   10.238   63.713   3.9242   60.524   4.1012 3.189735 5.676213 
1 1 1   27   17    3 o   41.054   3.9333   36.379   6.3345   46.131   9.0947   27.190   8.8278   46.863   4.7054   35.245   6.3042 11.61761 7.866573 
1 1 1   27   17    4 o   36.694   4.8611   30.978   6.8874   22.915   10.863   36.398   8.9063   31.848   8.2157   41.540   5.1983 -9.691936 9.722179 
1 1 1   27   17    5 o   14.992   4.7777  -5.2079   6.0607   0.4028   9.9990  -8.4665   7.6201   17.828   7.6321   12.157   5.7495 5.670711 9.555390 
1 1 1   27   17    6 o   25.682   5.1646   14.481   5.8991   19.051   8.3463   9.9189   8.3390   29.228   7.0131   22.137   7.5833 7.091381 10.32912 
1 1 1   27   17    7 o   38.921   3.9150   32.053   6.2840   32.642   8.9586   31.481   8.8169   39.274   5.5305   38.567   5.5428 0.7069588 7.830022 
1 1 1   27   17    8 o   73.558   2.5796  112.882   7.8131  121.370   11.130  104.635   10.971   76.310   3.5362   70.807   3.7566 5.503922 5.159161 
1 1 1   27   17    9 o  118.952   2.2211  294.140   10.895  288.064   15.233  300.502   15.588  117.696   3.1381  120.208   3.1441 -2.512154 4.442159 
1 1 1   27   17   10 o   47.878   3.3885   48.478   6.6363   41.526   9.3968   55.395   9.3737   44.366   5.1353   51.391   4.4224 -7.025471 6.777097 
1 1 1   27   17   11 o   51.979   3.7692   60.514   7.5280   45.898   12.168   69.576   9.5818   46.309   6.3708   57.650   4.0298 -11.34103 7.538329 
1 1 1   27   17   12 o   59.472   3.2792   72.883   7.7584   80.638   13.058   68.650   9.6457   61.724   5.1291   57.220   4.0871 4.503803 6.558381 
1 1 1   27   17   13 o   48.679   3.8732   51.435   7.4505   46.285   12.060   54.613   9.4750   46.431   6.2974   50.927   4.5109 -4.496567 7.746311 
1 1 1   27   17   14 o   19.830   5.5763   4.9491   6.4594   7.2426   11.370   3.8560   7.8491   21.925   8.6079   17.735   7.0911 4.189747 11.15254 
1 1 1   27   17   15 o   62.412   3.5018   84.004   8.8025   73.282   13.426   92.088   11.658   58.647   5.5504   66.178   4.2711 -7.530529 7.003545 
1 1 1   27   17   16 o   64.899   3.7466   88.894   9.9847   79.668   13.442  100.251   14.913   61.163   5.3285   68.635   5.2682 -7.471817 7.493167 
1 1 1   27   17   17 o   19.802   5.4323   6.0606   6.4952  -1.2180   11.536   9.4387   7.8592   18.205   7.9916   21.398   7.3604 -3.193060 10.86468 
1 1 1   27   17   18 f   29.539   5.3606   21.417   6.8013   11.316   12.229   25.940   8.1838   24.304   9.0766   34.773   5.7062 -10.46882 10.72125 
1 1 1   27   17   19 o   26.681   5.4337   18.363   7.0338  -0.3597   14.460   24.165   8.0504   20.428   8.9578   32.934   6.1529 -12.50553 10.86738 
1 1 1   27   17   20 f   39.657   5.1764   42.167   7.3997   19.973   12.808   53.287   9.0659   29.183   9.3785   50.131   4.3847 -20.94876 10.35289 
1 1 1   27   17   21 o   55.594   4.4768   65.739   10.118   55.307   13.084   81.261   15.959   50.274   6.3102   60.915   6.3522 -10.64153 8.953697 
1 1 1   27   17   22 o   16.394   5.5828 -13.8112   8.4330  -6.7233   18.296 -15.7233   9.5027   20.703   9.4856   12.085   5.8902 8.617165 11.16561 
1 1 1   27   17   23 o   20.516   5.9382   5.6291   7.9915   3.8669   12.148   6.9736   10.611   20.227   8.5253   20.805   8.2685 -0.5782108 11.87637 
1 1 1   27   17   24 o   19.783   5.8724   3.9605   8.0552   4.7506   12.079   3.3278   10.810   20.471   8.5569   19.096   8.0450 1.375122 11.74488 
1 1 1   27   17   25 o   47.262   5.0254   51.430   9.4333   43.833   13.551   58.573   13.140   43.104   7.9139   51.421   6.1958 -8.317020 10.05079 
1 1 1   27   17   26 o   55.783   4.8951   73.171   9.8634   39.185   13.643  110.382   14.276   40.131   8.5069   71.434   4.8455 -31.30332 9.790134 
1 1 1   27   17   27 o   36.272   7.4181   33.562   11.554   26.312   14.626   45.597   18.843   31.663   10.006   40.881   10.954 -9.217342 14.83621 
1 1 1   27   17   28 o   36.184   7.5395   33.816   11.385   29.660   13.748   42.887   20.311   33.762   9.4823   38.607   11.724 -4.845032 15.07891 
1 1 1   27   17   29 o   44.075   8.8840   61.009   16.999   54.633   29.382   64.217   20.841   39.633   14.183   48.517   10.702 -8.884754 17.76802 
1 1 1   27   17   30 o   17.949   6.0427 -11.8977   12.184  -7.8781   15.534 -18.3233   19.640   17.849   8.3685   18.050   8.7193 -0.2007046 12.08543 
1 1 1   27   17   31 o   76.042   6.4056  133.981   20.090  133.981   20.090   0.0000   0.0000   76.042   6.4056  ?   ?       ?      ? 
1 1 1   27   18    0 o   24.652   6.2346   16.904   8.1877   16.904   8.1877   16.904   8.1877   24.652   8.8171   24.652   8.8171 0.000000 0.000000 
1 1 1   27   18    1 f   25.824   5.1693   14.700   5.7999   12.164   8.0856   17.387   8.3242   23.741   7.4308   27.907   7.1882 -4.165997 10.33865 
1 1 1   27   18    2 o  126.023   2.2045  330.242   11.458  331.099   16.165  329.376   16.245  126.191   3.1058  125.854   3.1295 0.3367157 4.409086 
1 1 1   27   18    3 o   57.037   3.4025   70.217   7.6823   61.049   12.261   76.143   9.8570   53.712   5.5347   60.362   3.9593 -6.649910 6.805049 
1 1 1   27   18    4 o   91.117   2.6141  172.478   9.6237  176.783   15.305  169.663   12.376   91.953   4.0357   90.281   3.3238 1.672028 5.228216 
1 1 1   27   18    5 o   38.200   4.9390   35.968   7.0598   19.087   11.301   46.771   9.0409   29.208   8.7177   47.192   4.6449 -17.98430 9.877961 
1 1 1   27   18    6 o   29.653   4.7130   19.467   5.8496   26.325   8.2458   12.519   8.2996   35.245   5.6724   24.061   7.5281 11.18377 9.425977 
1 1 1   27   18    7 o   44.022   3.6099   41.290   6.4412   50.035   9.1273   32.614   9.0913   48.817   4.5332   39.227   5.6192 9.590515 7.219803 
1 1 1   27   18    8 o   72.312   2.6309  109.216   7.8458  110.405   11.073  108.018   11.119   72.714   3.6922   71.910   3.7488 0.8040924 5.261701 
1 1 1   27   18    9 o   31.220   4.7078   21.708   5.8833   24.545   8.3834   18.954   8.2586   33.358   6.3248   29.082   6.9750 4.276049 9.415632 
1 1 1   27   18   10 o   89.420   2.6520  166.814   9.5111  169.195   15.400  165.346   12.093   89.789   4.1584   89.051   3.2926 0.7383881 5.304084 
1 1 1   27   18   11 o   40.487   4.7720   38.815   7.0686   27.672   11.815   45.027   8.8215   34.756   8.3469   46.217   4.6278 -11.46034 9.543971 
1 1 1   27   18   12 o   62.158   3.3673   84.024   8.3013   70.499   13.010   93.311   10.781   57.578   5.4786   66.737   3.9167 -9.158718 6.734650 
1 1 1   27   18   13 o   38.250   4.9124   34.219   7.0516   26.144   11.742   38.774   8.8192   33.708   8.4591   42.792   4.9969 -9.084091 9.824732 
1 1 1   27   18   14 o   80.350   3.1101  136.300   10.260  133.458   15.153  138.707   13.943   79.484   4.6223   81.215   4.1625 -1.730591 6.220294 
1 1 1   27   18   15 o   61.261   3.6038   78.854   8.9980   85.678   14.046   74.104   11.718   63.380   5.3732   59.141   4.8040 4.239384 7.207655 
1 1 1   27   18   16 o   63.899   3.8599   87.365   10.156   91.999   14.268   82.606   14.459   65.696   5.2658   62.102   5.6451 3.594551 7.719821 
1 1 1   27   18   17 o   56.873   3.8268   70.887   8.6349   61.982   13.700   76.757   11.122   53.510   6.2076   60.235   4.4768 -6.725204 7.653553 
1 1 1   27   18   18 o   30.296   6.4457   21.792   7.5434   16.973   18.741   22.724   8.2404   28.838   11.126   31.754   6.5105 -2.915722 12.89130 
1 1 1   27   18   19 o   31.233   5.6143   23.409   6.8984   20.025   12.766   24.804   8.1986   29.182   9.3616   33.285   6.2002 -4.103413 11.22862 
1 1 1   27   18   20 o   63.241   3.5619   89.804   8.5888   73.374   14.447   98.786   10.681   58.027   6.0363   68.454   3.7833 -10.42664 7.123891 
1 1 1   27   18   21 o   19.272   5.1744 -10.3005   7.5622   19.354   11.929 -30.2220   9.7777   28.554   9.0382   9.9907   5.0405 18.56308 10.34874 
1 1 1   27   18   22 o   27.914   6.5212   14.741   8.6185   30.996   15.445   7.3911   10.386   34.949   10.128   20.879   8.2174 14.07036 13.04249 
1 1 1   27   18   23 o   25.486   5.2221   12.897   7.8187  -8.4964   11.956   28.881   10.335   15.847   7.4015   35.125   7.3688 -19.27787 10.44419 
1 1 1   27   18   24 o   63.947   3.6658   89.601   9.5574   79.083   13.985   98.818   13.092   60.098   5.6420   67.796   4.6819 -7.698532 7.331627 
1 1 1   27   18   25 o   43.122   5.5818   44.631   9.5385   35.641   13.882   52.673   13.129   37.852   9.0197   48.391   6.5780 -10.53883 11.16357 
1 1 1   27   18   26 o   91.382   4.4193  186.661   16.596  174.775   22.341  201.299   24.792   88.294   6.1348   94.471   6.3629 -6.176888 8.838652 
1 1 1   27   18   27 f   26.958   7.3371   17.194   11.161   16.685   13.809   18.153   18.954   26.271   9.6773   27.646   11.031 -1.374430 14.67416 
1 1 1   27   18   28 o   25.810   7.1942   10.395   12.385  -5.2585   16.626   29.908   18.563   19.266   8.9049   32.354   11.302 -13.08805 14.38830 
1 1 1   27   18   29 o   70.353   5.6793  118.155   15.681  112.074   19.305  129.952   26.886   69.357   6.7487   71.350   9.1363 -1.992981 11.35857 
1 1 1   27   18   30 o   18.058   5.9264 -11.9111   11.814   5.5182   15.034 -40.0528   19.103   21.244   9.2277   14.871   7.4391 6.373043 11.85288 
1 1 1   27   19    0 o   31.609   5.3831   24.260   8.6057   24.260   8.6057   24.260   8.6057   31.609   7.6128   31.609   7.6128 0.000000 0.000000 
1 1 1   27   19    1 o   26.013   5.1252   15.040   5.7656   12.207   8.1699   17.851   8.1378   23.764   7.4746   28.263   7.0142 -4.498934 10.25033 
1 1 1   27   19    2 o   53.125   3.0498   59.176   6.6809   59.718   9.5669   58.660   9.3339   53.356   4.3474   52.895   4.2784 0.4605598 6.099560 
1 1 1   27   19    3 o   49.298   3.7153   51.804   7.2804   49.794   11.870   53.017   9.2178   48.351   5.9523   50.245   4.4481 -1.894032 7.430678 
1 1 1   27   19    4 o   28.330   5.4171   18.303   6.4046   16.190   10.470   19.566   8.0959   27.050   8.4541   29.611   6.7757 -2.560207 10.83428 
1 1 1   27   19    5 o   29.534   4.8451   19.471   5.7929   21.410   8.3424   17.666   8.0502   30.994   6.7196   28.073   6.9819 2.921600 9.690208 
1 1 1   27   19    6 o   50.880   3.3192   55.368   6.6076   34.842   9.0765   78.512   9.6378   40.506   5.4329   61.254   3.8148 -20.74845 6.638477 
1 1 1   27   19    7 f   46.000   3.3647   44.645   6.3819   46.068   9.0882   43.260   8.9640   46.733   4.7151   45.267   4.8012 1.465576 6.729325 
1 1 1   27   19    8 o   68.720   2.6605   98.769   7.5218  108.430   10.792   89.641   10.490   72.021   3.6330   65.420   3.8877 6.600525 5.320965 
1 1 1   27   19    9 o   37.700   4.5584   30.171   6.7350   34.510   11.141   27.672   8.4548   39.367   7.1238   36.033   5.6891 3.334488 9.116722 
1 1 1   27   19   10 o   52.791   3.6176   58.659   7.5318   60.408   12.726   57.716   9.3441   53.191   5.8007   52.391   4.3243 0.8001289 7.235190 
1 1 1   27   19   11 o   62.627   3.4244   88.923   8.1431   63.556   13.164  104.646   10.364   54.504   5.8559   70.750   3.5517 -16.24545 6.848801 
1 1 1   27   19   12 o   97.647   2.7089  201.289   10.708  192.415   16.615  207.593   14.004   95.624   4.2127   99.670   3.4066 -4.045097 5.417704 
1 1 1   27   19   13 o  103.741   2.7600  226.448   11.722  221.626   17.573  230.313   15.732  102.623   4.1519  104.859   3.6377 -2.236557 5.520052 
1 1 1   27   19   14 o   57.715   3.4625   69.663   7.8510   74.064   13.474   67.401   9.6605   58.842   5.5517   56.587   4.1392 2.255848 6.924925 
1 1 1   27   19   15 o   39.647   5.9135   36.735   9.3011   33.177   14.074   39.495   12.393   37.486   9.1767   41.809   7.4609 -4.322838 11.82696 
1 1 1   27   19   16 o   78.198   3.1208  128.792   10.007  135.790   15.135  123.357   13.337   79.993   4.5875   76.404   4.2325 3.589348 6.241693 
1 1 1   27   19   17 o   31.689   6.2407   24.777   8.1192   18.941   15.782   26.877   9.4682   28.976   10.392   34.401   6.9130 -5.425619 12.48149 
1 1 1   27   19   19 o   51.143   3.8634   53.708   7.6917   65.137   13.791   48.547   9.2669   54.600   6.1240   47.687   4.7117 6.913643 7.726762 
1 1 1   27   19   20 o   90.777   3.1247  175.518   11.660  176.811   17.225  174.424   15.841   90.968   4.5911   90.585   4.2401 0.3837738 6.249483 
1 1 1   27   19   21 o   15.316   4.9852  -8.4647   7.3592   0.7129   11.242 -15.3467   9.7350   18.314   7.9673   12.317   5.9941 5.996667 9.970340 
1 1 1   27   19   22 o   28.863   6.9063   18.021   9.0484   27.853   17.002   14.137   10.688   32.850   10.823   24.876   8.5818 7.973383 13.81265 
1 1 1   27   19   23 o   50.915   5.5596   65.436   10.057   46.040   17.050   75.786   12.455   42.703   9.8770   59.127   5.1071 -16.42401 11.11927 
1 1 1   27   19   24 o   64.692   3.8114   91.951   10.128   85.008   14.549   98.479   14.107   62.106   5.6798   67.277   5.0840 -5.171501 7.622814 
1 1 1   27   19   25 o   19.724   5.8975   4.2112   8.2704   2.8260   12.202   5.3883   11.248   19.451   8.3809   19.998   8.2995 -0.5468750 11.79499 
1 1 1   27   19   26 o   34.480   7.3675   31.041   11.027   27.335   13.784   37.631   18.379   32.318   9.6234   36.641   11.158 -4.323441 14.73497 
1 1 1   27   19   27 o   21.006   6.5694   2.8159   10.954   4.0672   13.691   0.5910   18.257   20.495   8.8541   21.518   9.7073 -1.022757 13.13873 
1 1 1   27   19   28 o   46.886   7.3832   60.494   13.940   53.635   19.433   67.764   20.007   43.516   10.862   50.257   10.004 -6.741135 14.76649 
1 1 1   27   19   29 f   47.016   7.2588   59.786   13.339   55.695   16.842   66.672   21.850   46.095   9.1815   47.937   11.245 -1.841496 14.51752 
1 1 1   27   20    0 f  106.456   2.2712  235.592   14.074  235.592   14.074  235.592   14.074  106.456   3.2120  106.456   3.2120 0.000000 0.000000 
1 1 1   27   20    1 o   77.087   2.5267  124.123   8.0309  128.693   11.468  119.725   11.250   78.488   3.5427   75.687   3.6037 2.801132 5.053474 
1 1 1   27   20    2 o   14.843   4.6249  -1.6291   5.5108  -1.8311   7.9101  -1.4386   7.6817   14.871   6.5690   14.816   6.5121 0.5430317E-01 9.249858 
1 1 1   27   20    3 o   69.848   2.9876  103.189   8.3823   99.111   13.317  105.866   10.787   68.543   4.7107   71.153   3.6759 -2.610229 5.975137 
1 1 1   27   20    4 o   97.692   2.5873  197.309   10.224  210.709   16.343  188.693   13.105  100.275   3.9516   95.108   3.3407 5.167404 5.174510 
1 1 1   27   20    5 o   46.805   3.3580   46.461   6.4487   42.611   9.3210   49.995   8.9312   44.870   5.0366   48.741   4.4427 -3.871323 6.716054 
1 1 1   27   20    6 o  119.825   2.2304  299.205   11.021  294.462   15.603  303.927   15.570  118.866   3.1826  120.784   3.1255 -1.917732 4.460707 
1 1 1   27   20    7 o   36.273   4.1810   28.630   6.0824   25.863   8.6920   31.286   8.5144   34.184   6.4003   38.362   5.3813 -4.178238 8.361917 
1 1 1   27   20    8 o   72.248   3.1968  117.308   8.8531   84.458   14.090  138.734   11.380   62.986   5.4240   81.509   3.3850 -18.52325 6.393556 
1 1 1   27   20    9 o   27.941   5.2802   14.141   7.2845   33.224   11.408   1.0027   9.4655   38.375   7.4764   17.506   7.4583 20.86854 10.56045 
1 1 1   27   20   10 o   55.817   4.0031   69.795   8.2328   59.092   14.866   74.530   9.8874   52.083   6.9205   59.552   4.0255 -7.469086 8.006104 
1 1 1   27   20   11 o   53.784   4.6608   71.036   8.5079   45.755   14.954   83.137   10.346   44.671   8.4254   62.898   3.9879 -18.22737 9.321508 
1 1 1   27   20   12 f   94.633   2.7464  187.132   10.504  192.809   16.706  183.421   13.508   95.653   4.2344   93.614   3.4985 2.039490 5.492734 
1 1 1   27   20   13 o   36.366   5.0795   34.556   7.0259   16.083   11.883   44.486   8.7118   26.905   9.0531   45.827   4.6091 -18.92186 10.15891 
1 1 1   27   20   14 o   57.519   3.4297   69.176   7.7909   74.861   13.269   66.185   9.6247   59.054   5.4477   55.985   4.1682 3.068935 6.859422 
1 1 1   27   20   15 o   83.218   3.0442  146.932   10.346  144.679   15.691  148.665   13.762   82.491   4.6119   83.945   3.9748 -1.453827 6.088443 
1 1 1   27   20   16 o   66.518   3.4334   95.759   9.2215   87.050   14.162  102.170   12.150   63.585   5.4000   69.450   4.2418 -5.864437 6.866831 
1 1 1   27   20   17 o   34.900   6.0781   32.044   8.5478   18.016   16.875   36.885   9.9138   28.592   10.665   41.209   5.8329 -12.61690 12.15611 
1 1 1   27   20   18 o   24.260   5.5969   13.849   6.6049   6.0618   12.353   16.966   7.8160   21.404   8.7711   27.117   6.9548 -5.713406 11.19385 
1 1 1   27   20   19 o   27.695   6.1011   18.969   7.4038   12.252   15.619   20.915   8.4084   25.347   10.045   30.043   6.9275 -4.696409 12.20218 
1 1 1   27   20   20 o   42.494   5.2563   41.922   8.8209   39.878   13.623   43.398   11.575   40.787   8.3787   44.202   6.3491 -3.414669 10.51254 
1 1 1   27   20   21 o   63.288   3.7190   87.590   9.6199   80.494   14.177   93.646   13.097   60.637   5.6685   65.938   4.8157 -5.300812 7.437900 
1 1 1   27   20   22 o   21.610   6.3138   2.8445   8.6503   16.365   15.928  -2.8118   10.302   26.982   10.295   16.238   7.3117 10.74463 12.62766 
1 1 1   27   20   23 o   47.243   5.0110   52.297   9.2677   41.092   13.333   62.773   12.892   41.285   8.1193   53.201   5.8752 -11.91681 10.02198 
1 1 1   27   20   24 o   21.966   6.1647   8.5760   8.3966   12.808   12.384   4.9751   11.423   24.049   9.1016   19.883   8.3170 4.165525 12.32936 
1 1 1   27   20   25 o   22.671   6.6127   4.5633   10.008  -3.7405   12.434   19.838   16.864   17.283   7.8811   28.060   10.621 -10.77694 13.22541 
1 1 1   27   20   26 o   22.893   6.6505   5.6356   9.9274  -2.2353   12.195   21.097   17.092   17.473   7.9035   28.314   10.698 -10.84043 13.30102 
1 1 1   27   20   27 o   33.394   7.5646   30.899   12.096   21.157   16.098   43.536   18.334   27.981   10.421   38.807   10.968 -10.82589 15.12918 
1 1 1   27   20   28 o   33.939   8.4550   36.404   14.702   35.516   20.384   37.366   21.225   33.653   11.838   34.225   12.075 -0.5720100 16.91001 
1 1 1   27   21    0 o   31.495   5.2294   24.001   8.3471   24.001   8.3471   24.001   8.3471   31.495   7.3955   31.495   7.3955 0.000000 0.000000 
1 1 1   27   21    1 o   43.710   3.5187   40.455   6.3300   44.064   9.0701   37.028   8.8384   45.646   4.8177   41.774   5.1298 3.871819 7.037445 
1 1 1   27   21    2 o   85.294   2.7471  152.528   9.4507  152.558   15.012  152.509   12.164   85.153   4.2743   85.434   3.4520 -0.2813721 5.494202 
1 1 1   27   21    3 o   56.151   3.4526   66.827   7.7454   66.465   12.591   67.048   9.8241   55.843   5.4666   56.459   4.2189 -0.6157188 6.905244 
1 1 1   27   21    4 o   87.359   2.9903  160.655   10.769  157.630   15.376  163.567   15.087   86.518   4.3089   88.199   4.1472 -1.681381 5.980503 
1 1 1   27   21    5 o   46.421   3.7887   45.407   7.1157   43.408   9.1286   48.502   11.359   45.258   4.8904   47.583   5.7880 -2.325813 7.577439 
1 1 1   27   21    6 o   76.871   2.6665  123.158   8.4047  130.500   12.721  117.470   11.196   78.844   3.9120   74.898   3.6244 3.945831 5.332922 
1 1 1   27   21    7 o   40.747   4.1093   37.240   6.3195   23.023   8.8890   51.769   8.9860   31.957   6.9427   49.536   4.3982 -17.57963 8.218581 
1 1 1   27   21    8 o   66.361   3.0561   91.823   8.1100   97.038   13.350   88.772   10.210   67.675   4.7829   65.047   3.8056 2.627144 6.112165 
1 1 1   27   21    9 o   26.290   5.6740   15.537   6.5787   15.315   10.873   15.666   8.2627   26.288   8.6550   26.293   7.3393 -0.4776001E-02 11.34792 
1 1 1   27   21   10 o   24.085   5.7585   11.562   6.6029   16.540   11.110   8.8438   8.2101   27.087   8.7382   21.082   7.5024 6.004507 11.51706 
1 1 1   27   21   11 o   23.622   5.7541   11.637   6.5665   12.756   11.133   11.041   8.1315   24.642   8.7400   22.602   7.4868 2.040312 11.50820 
1 1 1   27   21   12 o   39.682   4.8722   38.667   7.0368   25.405   11.796   45.993   8.7676   32.820   8.6078   46.545   4.5672 -13.72528 9.744406 
1 1 1   27   21   13 o   77.334   2.9688  130.105   9.0044  113.516   14.680  140.112   11.401   72.926   4.8805   81.743   3.3817 -8.816383 5.937613 
1 1 1   27   21   14 o   41.851   4.6665   37.513   7.8773   43.307   12.842   34.018   9.9739   44.194   7.0457   39.509   6.1208 4.684826 9.333019 
1 1 1   27   21   16 o   43.163   7.8462   47.834   12.935   44.237   27.197   48.885   14.704   39.818   13.693   46.508   7.6658 -6.689919 15.69236 
1 1 1   27   21   17 o   62.368   3.7184   84.878   9.2698   80.758   14.834   87.518   11.874   60.725   5.9227   64.011   4.4974 -3.286091 7.436731 
1 1 1   27   21   18 o   69.340   3.4484  104.451   9.6303   99.296   15.110  107.977   12.498   67.533   5.4247   71.148   4.2590 -3.614517 6.896809 
1 1 1   27   21   19 o   25.626   5.8345   15.002   6.6422   16.152   12.075   14.502   7.9536   26.320   9.1194   24.932   7.2803 1.387735 11.66903 
1 1 1   27   21   20 o   20.191   5.9245   4.8602   7.9395   6.3386   12.675   3.9057   10.185   21.441   8.8471   18.941   7.8822 2.500189 11.84905 
1 1 1   27   21   21 o   27.098   6.3017   17.919   8.2399   14.626   12.683   20.324   10.839   25.374   9.2852   28.823   8.5224 -3.449785 12.60344 
1 1 1   27   21   22 o   46.360   5.7950   53.419   9.9459   45.626   17.059   57.433   12.242   41.876   10.012   50.845   5.8376 -8.968906 11.58997 
1 1 1   27   21   23 o   22.607   6.0688   9.7125   8.5097  -0.2920   12.968   17.278   11.277   18.745   8.3393   26.468   8.8192 -7.723154 12.13759 
1 1 1   27   21   24 o   31.529   6.0846   23.717   8.7354   39.034   13.308   12.120   11.579   39.684   8.3927   23.375   8.8120 16.30962 12.16913 
1 1 1   27   21   25 o   38.187   6.9143   38.530   10.646   37.065   13.306   41.137   17.746   38.187   8.6487   38.187   10.790 0.6484985E-04 13.82855 
1 1 1   27   21   26 o   38.890   7.3308   41.666   11.911   36.202   15.725   49.020   18.242   36.046   10.148   41.734   10.583 -5.688019 14.66161 
1 1 1   27   21   27 o   29.696   7.5856   25.441   12.156   29.915   16.442   20.049   18.052   32.074   10.647   27.317   10.807 4.756765 15.17114 
1 1 1   27   22    0 o   17.610   6.3767   9.8541   8.3006   9.8541   8.3006   9.8541   8.3006   17.610   9.0180   17.610   9.0180 0.000000 0.000000 
1 1 1   27   22    1 o   27.228   5.9726   16.807   7.0889   15.059   13.089   17.533   8.4327   26.676   9.4750   27.779   7.2741 -1.103302 11.94519 
1 1 1   27   22    2 o   68.555   3.0309   99.468   8.3896   96.989   13.191  101.153   10.872   67.674   4.7259   69.435   3.7963 -1.761002 6.061865 
1 1 1   27   22    3 o   19.950   5.4114   6.3961   6.4255   0.7173   10.627   9.6685   8.0672   18.262   7.8445   21.638   7.4564 -3.376017 10.82282 
1 1 1   27   22    4 o  137.045   2.2150  391.963   12.520  390.766   17.756  393.147   17.655  136.830   3.1463  137.260   3.1186 -0.4304810 4.430010 
1 1 1   27   22    5 o   86.332   2.4184  155.928   8.6112  157.189   12.204  154.678   12.152   86.682   3.4137   85.983   3.4266 0.6996841 4.836812 
1 1 1   27   22    6 o   25.245   5.1671   14.226   5.7752   17.852   8.3388   10.883   8.0060   28.001   7.1848   22.489   7.4278 5.511944 10.33410 
1 1 1   27   22    7 o   20.441   5.3690   4.0255   6.2038   15.616   10.764  -1.7402   7.5916   26.379   8.6077   14.504   6.4198 11.87540 10.73806 
1 1 1   27   22    8 o   77.904   2.8142  124.359   8.7840  142.545   14.602  114.045   10.996   82.101   4.3122   73.708   3.6171 8.392815 5.628378 
1 1 1   27   22    9 o   33.181   5.2285   23.861   6.7318   31.054   11.518   20.129   8.2965   36.649   7.8558   29.713   6.9019 6.936146 10.45702 
1 1 1   27   22   10 o   44.566   4.4105   45.027   7.4140   39.253   12.266   48.350   9.3063   41.487   7.4419   47.644   4.7359 -6.157032 8.821036 
1 1 1   27   22   11 o   71.859   3.5296  113.296   9.3169  103.813   17.314  117.161   11.054   69.062   6.0783   74.656   3.5900 -5.593864 7.059281 
1 1 1   27   22   12 o   54.051   4.0394   62.981   8.9303   65.562   13.632   61.040   11.819   54.873   6.0235   53.230   5.3836 1.642422 8.078752 
1 1 1   27   22   13 o   19.331   5.5153   3.9905   6.5171   9.1476   11.194   1.3461   8.0157   22.394   8.6103   16.268   6.8946 6.125832 11.03051 
1 1 1   27   22   14 o   91.005   2.9439  174.989   10.949  180.866   16.759  170.613   14.462   92.179   4.4080   89.831   3.9033 2.348213 5.887805 
1 1 1   27   22   15 o   41.683   5.1714   44.147   7.6455   29.029   13.424   51.406   9.3016   34.352   9.2631   49.014   4.6012 -14.66278 10.34289 
1 1 1   27   22   16 o   57.472   4.7104   76.584   9.7722   67.103   18.233   80.406   11.575   53.707   8.2310   61.238   4.5829 -7.530876 9.420852 
1 1 1   27   22   17 o   19.316   5.5674   1.3781   6.8491   12.954   12.223  -3.9203   8.2692   24.530   9.0915   14.101   6.4289 10.42960 11.13487 
1 1 1   27   22   18 o   39.383   5.3936   38.330   8.1370   28.128   13.242   44.519   10.314   33.622   9.2564   45.145   5.5391 -11.52296 10.78718 
1 1 1   27   22   19 o   52.070   3.9908   59.536   7.9120   59.413   14.133   59.592   9.5485   51.407   6.6657   52.734   4.3901 -1.327480 7.981569 
1 1 1   27   22   20 o   16.601   5.2534  -2.7203   7.6152  -9.6122   11.784   2.2215   9.9786   15.300   7.2096   17.901   7.6430 -2.601117 10.50682 
1 1 1   27   22   21 o   63.872   3.8496   91.671   9.8997   73.645   14.454  107.598   13.587   57.296   6.1166   70.447   4.6761 -13.15122 7.699219 
1 1 1   27   22   22 o   36.115   6.7073   32.431   9.7788   39.908   16.545   28.416   12.123   38.654   10.221   33.577   8.6876 5.076691 13.41465 
1 1 1   27   22   23 o   46.437   5.1357   51.156   9.5017   47.022   14.000   54.686   12.938   43.877   8.0321   48.997   6.4021 -5.119137 10.27137 
1 1 1   27   22   24 o   22.684   6.1451   11.226   8.2937   5.8710   12.794   15.107   10.892   20.627   8.7246   24.741   8.6562 -4.113327 12.29016 
1 1 1   27   22   25 o   48.779   5.7342   55.408   10.968   43.620   13.682   76.607   18.348   41.592   8.2671   55.967   7.9484 -14.37535 11.46833 
1 1 1   27   22   26 o   27.170   6.8766   18.508   11.087   31.188   14.968   3.0939   16.504   33.288   10.055   21.053   9.3836 12.23501 13.75324 
1 1 1   27   23    0 o   39.964   4.1686   35.715   9.0966   35.715   9.0966   35.715   9.0966   39.964   5.8953   39.964   5.8953 0.000000 0.000000 
1 1 1   27   23    1 o   32.146   5.1974   23.852   6.5845   22.747   10.778   24.510   8.3169   31.200   8.2499   33.093   6.3239 -1.893551 10.39484 
1 1 1   27   23    2 f   55.958   3.3869   66.860   7.5726   65.700   12.261   67.576   9.6285   55.340   5.3719   56.575   4.1264 -1.235374 6.773773 
1 1 1   27   23    3 o   96.314   2.6551  197.344   10.291  183.892   16.116  206.607   13.373   93.281   4.1889   99.348   3.2637 -6.067261 5.310267 
1 1 1   27   23    4 o   78.770   2.5334  130.264   8.2288  133.779   11.752  126.885   11.526   79.817   3.5700   77.723   3.5954 2.093750 5.066719 
1 1 1   27   23    5 o   86.104   2.6552  157.299   9.3176  166.190   12.491  146.146   13.990   89.025   3.4019   83.184   4.0777 5.841026 5.310405 
1 1 1   27   23    6 o   75.183   2.9823  120.107   8.9393  117.649   14.547  121.598   11.331   74.307   4.7465   76.060   3.6121 -1.753288 5.964605 
1 1 1   27   23    7 o   58.206   4.1443   76.306   9.3906   62.763   15.167   84.726   11.958   53.302   6.8989   63.109   4.5943 -9.806473 8.288688 
1 1 1   27   23    8 o   40.411   4.6208   36.266   7.1310   36.397   12.048   36.196   8.8471   39.770   7.6225   41.051   5.2253 -1.280510 9.241545 
1 1 1   27   23    9 o   61.108   3.4058   80.858   8.2882   75.157   13.305   84.474   10.595   59.019   5.4660   63.198   4.0647 -4.179455 6.811697 
1 1 1   27   23   10 o   39.296   4.9196   35.666   7.3574   31.566   12.191   38.015   9.2271   36.589   8.2728   42.002   5.3263 -5.413296 9.839121 
1 1 1   27   23   11 o   29.457   5.7011   20.242   6.8683   20.783   11.903   19.972   8.4093   29.493   8.9796   29.420   7.0269 0.7361221E-01 11.40221 
1 1 1   27   23   12 o   23.382   5.5386   12.485   6.7312   3.1304   11.960   16.822   8.1433   19.861   8.4199   26.902   7.1980 -7.040806 11.07727 
1 1 1   27   23   13 o   45.520   4.7729   51.641   7.5305   34.750   13.103   59.973   9.2020   37.969   8.5703   53.071   4.2039 -15.10226 9.545836 
1 1 1   27   23   14 o   37.767   5.3850   34.783   7.9052   27.085   12.847   39.474   10.029   33.092   9.1198   42.443   5.7290 -9.350487 10.76998 
1 1 1   27   23   15 o   65.028   4.4385  101.388   9.3670   79.842   19.608  107.759   10.662   58.657   8.1051   71.400   3.6207 -12.74291 8.877012 
1 1 1   27   23   16 o   63.064   3.3693   79.443   8.2868  105.483   14.976   67.950   9.9487   69.715   5.2083   56.414   4.2758 13.30097 6.738595 
1 1 1   27   23   17 o   67.014   3.4427   96.518   9.3352   99.819   14.787   94.331   12.037   67.680   5.2973   66.348   4.3987 1.331825 6.885480 
1 1 1   27   23   18 o   75.647   3.3186  122.815   10.249  129.190   15.801  118.185   13.466   77.125   4.9674   74.170   4.4021 2.955025 6.637239 
1 1 1   27   23   19 o   19.126   5.6029   4.4791   6.5392   6.9633   12.620   3.5672   7.6457   21.377   8.8247   16.876   6.9063 4.501381 11.20589 
1 1 1   27   23   20 o   56.756   4.0315   72.562   9.2697   63.650   13.827   79.838   12.493   53.081   6.3159   60.431   5.0122 -7.350456 8.063070 
1 1 1   27   23   21 f   29.923   6.4140   22.539   8.4769   25.870   13.394   20.313   10.949   31.441   9.5148   28.406   8.6038 3.035061 12.82796 
1 1 1   27   23   22 o   40.108   6.1671   43.347   9.9041   30.183   16.159   51.268   12.535   32.893   10.530   47.323   6.4220 -14.43016 12.33423 
1 1 1   27   23   23 o   41.468   5.7196   43.782   9.4401   31.718   13.781   54.447   12.957   34.379   9.4339   48.557   6.4699 -14.17802 11.43928 
1 1 1   27   23   24 o   31.974   7.2747   26.796   10.656   19.689   13.251   39.802   17.927   27.177   9.5454   36.772   10.981 -9.594564 14.54947 
1 1 1   27   24    0 o   29.660   5.7319   22.437   8.5732   22.437   8.5732   22.437   8.5732   29.660   8.1061   29.660   8.1061 0.000000 0.000000 
1 1 1   27   24    1 f   86.643   2.7726  159.608   9.6379  153.248   15.354  163.744   12.381   84.960   4.3817   88.327   3.3986 -3.367073 5.545215 
1 1 1   27   24    2 o   65.599   3.6930   93.376   9.7932   87.222   15.119   97.823   12.854   63.421   5.7800   67.778   4.5982 -4.356037 7.385987 
1 1 1   27   24    3 o   39.095   5.0804   34.866   7.9311   30.907   11.667   38.266   10.814   36.367   7.9963   41.822   6.2691 -5.454502 10.16080 
1 1 1   27   24    4 o   46.534   3.4659   46.844   6.5324   56.439   9.2139   37.146   9.2626   51.564   4.3324   41.503   5.4111 10.06103 6.931828 
1 1 1   27   24    5 o   17.008   5.1149   1.4306   6.2670  -3.0576   10.517   3.9019   7.8039   16.524   7.4186   17.493   7.0436 -0.9695473 10.22971 
1 1 1   27   24    6 f   43.311   4.1111   40.323   7.0671   42.462   11.812   39.130   8.8200   43.909   6.5221   42.713   5.0067 1.196091 8.222226 
1 1 1   27   24    7 o   87.853   2.7182  161.529   9.5611  169.189   15.658  156.974   12.073   89.267   4.2528   86.439   3.3865 2.827148 5.436403 
1 1 1   27   24    8 o   57.208   3.4721   67.054   7.9865   85.823   13.217   56.259   10.023   63.151   5.0744   51.266   4.7405 11.88477 6.944197 
1 1 1   27   24    9 o  123.740   2.6549  324.085   13.425  319.951   20.330  327.281   17.876  122.825   4.0131  124.654   3.4770 -1.829315 5.309866 
1 1 1   27   24   10 o   45.550   4.5916   48.962   7.6200   39.477   12.976   53.954   9.4141   40.902   7.9786   50.198   4.5470 -9.296043 9.183258 
1 1 1   27   24   11 o   63.600   3.4642   88.087   8.5940   84.321   14.543   90.108   10.653   62.065   5.6814   65.134   3.9655 -3.068871 6.928390 
1 1 1   27   24   12 o   15.919   5.1161  -3.8318   6.9915  -2.0809   11.762  -4.7885   8.6942   17.646   7.8893   14.192   6.5158 3.454110 10.23214 
1 1 1   27   24   13 o   28.254   5.8873   19.913   7.6001   12.685   12.471   24.183   9.5859   24.449   9.1590   32.059   7.3997 -7.610323 11.77468 
1 1 1   27   24   14 o   22.081   5.3021   8.7433   7.9161 -28.7326   16.578   19.811   9.0095   15.248   7.5031   28.914   7.4935 -13.66544 10.60419 
1 1 1   27   24   15 o   36.514   6.0929   32.121   7.7743   31.983   17.301   32.155   8.7023   34.712   10.871   38.315   5.5068 -3.602821 12.18576 
1 1 1   27   24   16 o   20.814   5.6214   8.5807   6.6158   2.8583   12.633   10.743   7.7657   19.822   8.5344   21.805   7.3187 -1.982735 11.24279 
1 1 1   27   24   17 f   63.740   3.7682   90.159   9.6470   84.823   15.171   93.781   12.500   61.641   5.9673   65.839   4.6031 -4.197517 7.536404 
1 1 1   27   24   18 o   70.990   3.5323  111.561   10.137  100.765   15.439  119.742   13.439   67.463   5.5487   74.516   4.3728 -7.052971 7.064661 
1 1 1   27   24   19 o   54.185   4.8206   66.088   10.540   49.886   14.000   87.279   16.011   46.221   7.3441   62.150   6.2464 -15.92877 9.641186 
1 1 1   27   24   20 o   18.277   5.6101   2.0201   7.7336   2.2119   12.130   1.8886   10.039   18.981   8.2667   17.572   7.5865 1.409233 11.22025 
1 1 1   27   24   21 o   23.757   6.2914   13.126   8.5827   7.7537   13.064   17.206   11.384   21.492   8.9340   26.021   8.8607 -4.529093 12.58283 
1 1 1   27   24   22 o   23.278   5.8319   9.9552   9.4452 -21.2395   16.797   24.381   11.422   16.006   7.8075   30.550   8.6652 -14.54418 11.66371 
1 1 1   27   24   23 o   70.687   3.8273  112.328   11.055   94.908   15.452  130.599   15.824   64.639   5.7959   76.735   4.9999 -12.09576 7.654534 
1 1 1   27   25    0 o   90.039   2.4667  169.693   12.910  169.693   12.910  169.693   12.910   90.039   3.4884   90.039   3.4884 0.000000 0.000000 
1 1 1   27   25    1 o   21.029   5.3608   8.7978   6.3434   1.5748   10.395   13.083   8.0072   18.154   7.7770   23.904   7.3805 -5.749748 10.72166 
1 1 1   27   25    2 o   58.725   3.4885   75.104   8.1260   70.337   13.189   78.022   10.317   56.842   5.6255   60.609   4.1271 -3.766720 6.977059 
1 1 1   27   25    3 o   91.634   2.7818  180.667   10.271  162.746   15.836  193.677   13.493   87.346   4.3957   95.923   3.4106 -8.576439 5.563674 
1 1 1   27   25    4 o   58.468   3.6408   74.280   8.3769   72.441   13.992   75.308   10.458   57.479   5.9021   59.457   4.2647 -1.977253 7.281691 
1 1 1   27   25    5 o   22.063   5.7156   9.8912   6.4996   10.180   11.500   9.7557   7.8787   22.849   8.7409   21.276   7.3666 1.572941 11.43116 
1 1 1   27   25    6 o   93.476   2.7890  189.276   10.268  171.305   16.778  200.036   12.983   89.415   4.5496   97.536   3.2273 -8.121223 5.578022 
1 1 1   27   25    7 o  103.039   2.6967  225.284   11.161  223.812   17.887  226.223   14.283  102.440   4.2335  103.639   3.3414 -1.198494 5.393311 
1 1 1   27   25    8 o   63.378   3.4157   87.617   8.4864   82.691   14.160   90.379   10.601   61.517   5.5810   65.240   3.9398 -3.722755 6.831498 
1 1 1   27   25    9 o   69.156   3.1801  101.822   8.6165  104.410   14.733  100.477   10.623   69.424   5.1455   68.889   3.7386 0.5340958 6.360285 
1 1 1   27   25   10 o   20.309   5.6556   5.8262   6.5097   11.392   11.842   3.4156   7.7929   23.558   8.9039   17.059   6.9758 6.499056 11.31111 
1 1 1   27   25   11 o   39.582   4.8328   34.752   7.1846   38.459   12.834   33.060   8.6706   40.221   8.0177   38.943   5.3982 1.277317 9.665634 
1 1 1   27   25   12 o   90.274   2.8566  177.189   10.138  160.556   16.629  187.029   12.790   86.346   4.6695   94.202   3.2919 -7.856361 5.713208 
1 1 1   27   25   13 o   20.336   5.7449   6.8055   7.3360   1.8182   12.368   9.5122   9.1117   19.309   8.3786   21.363   7.8621 -2.054008 11.48973 
1 1 1   27   25   14 o   39.299   6.0566   41.693   8.1527   29.979   17.794   44.805   9.1721   33.195   11.079   45.404   4.8979 -12.20844 12.11313 
1 1 1   27   25   15 f   37.641   5.2136   32.730   7.3596   35.259   13.289   31.612   8.8390   37.534   8.7461   37.749   5.6773 -0.2145042 10.42714 
1 1 1   27   25   16 o   28.025   5.9559   17.547   6.9973   26.289   12.802   13.823   8.3559   31.974   9.2077   24.076   7.5570 7.897894 11.91177 
1 1 1   27   25   17 o   73.483   3.4368  124.149   9.6174   97.412   15.916  139.525   12.070   66.005   5.8465   80.961   3.6147 -14.95618 6.873662 
1 1 1   27   25   18 o   27.731   6.2835   18.322   7.8367   25.211   13.420   14.757   9.6537   30.856   9.5593   24.606   8.1578 6.250404 12.56704 
1 1 1   27   25   19 f   35.598   6.6564   34.992   10.334   43.045   13.720   24.433   15.710   41.445   8.3153   29.751   10.397 11.69395 13.31283 
1 1 1   27   25   20 o   47.688   5.2233   54.984   9.9479   59.455   13.725   50.036   14.439   50.591   6.5777   44.786   8.1158 5.805611 10.44663 
1 1 1   27   25   21 o   30.297   6.6664   24.781   9.4179   31.030   13.526   18.901   13.121   33.868   9.3679   26.725   9.4871 7.142345 13.33276 
1 1 1   27   26    0 o   11.795   5.3077   1.4448   8.0185   1.4448   8.0185   1.4448   8.0185   11.795   7.5062   11.795   7.5062 0.000000 0.000000 
1 1 1   27   26    1 o   22.428   5.5155   11.188   6.5166   4.2983   11.304   14.617   7.9753   19.833   8.2828   25.023   7.2854 -5.190489 11.03098 
1 1 1   27   26    2 o   25.734   5.5035   16.196   6.6084   9.2893   11.112   19.976   8.2199   22.173   8.5641   29.294   6.9145 -7.121164 11.00695 
1 1 1   27   26    3 o   96.976   2.6923  197.443   10.378  206.338   17.288  192.431   12.976   98.337   4.2624   95.615   3.2904 2.721764 5.384676 
1 1 1   27   26    4 o  110.225   2.6334  258.625   11.673  250.416   18.521  264.034   15.034  108.429   4.1414  112.022   3.2540 -3.593193 5.266858 
1 1 1   27   26    5 o   72.326   3.1585  116.050   8.8172   98.975   14.709  125.628   11.016   67.487   5.2842   77.165   3.4612 -9.678078 6.316910 
1 1 1   27   26    6 o   82.246   2.8460  140.457   9.3014  156.702   15.714  131.695   11.540   85.537   4.4542   78.955   3.5438 6.581947 5.691910 
1 1 1   27   26    7 o   31.891   5.6329   23.430   7.0706   27.888   12.287   21.223   8.6456   33.688   8.7607   30.095   7.0831 3.593740 11.26585 
1 1 1   27   26    8 o   73.572   3.0931  117.258   8.8567  111.673   15.045  120.220   10.956   71.734   5.0853   75.411   3.5226 -3.676521 6.186147 
1 1 1   27   26    9 o   37.266   5.0727   30.761   7.1736   36.455   12.843   28.178   8.6484   38.829   8.2727   35.703   5.8730 3.125729 10.14545 
1 1 1   27   26   10 o   36.991   6.1193   25.704   7.8767   53.222   17.779   18.983   8.7860   45.806   9.7118   28.176   7.4476 17.62984 12.23866 
1 1 1   27   26   11 o   44.353   4.5575   41.337   7.8251   53.742   14.317   36.053   9.3445   48.306   7.1857   40.400   5.6080 7.906498 9.115101 
1 1 1   27   26   12 o   21.240   5.7712   9.0816   6.8557   5.4304   12.983   10.493   8.0731   20.889   8.8094   21.591   7.4580 -0.7021828 11.54244 
1 1 1   27   26   13 o   21.505   6.1708   8.2776   7.9468   1.3052   17.068   10.207   8.9795   21.408   9.5423   21.601   7.8267 -0.1932430 12.34154 
1 1 1   27   26   14 o   39.390   5.1006   35.816   7.3694   38.075   13.624   34.882   8.7617   39.004   8.6915   39.775   5.3408 -0.7707253 10.20128 
1 1 1   27   26   15 o   27.427   5.7901   19.310   6.9351   14.761   13.024   21.110   8.1932   25.044   9.3643   29.810   6.8126 -4.766033 11.58023 
1 1 1   27   26   16 o   78.453   3.1553  133.059   9.8750  136.024   16.194  131.303   12.460   78.649   4.9922   78.257   3.8602 0.3921814 6.310568 
1 1 1   27   26   17 o   20.674   5.8633   7.1291   7.0141   11.902   13.063   5.1951   8.3144   23.333   9.2054   18.014   7.2644 5.318394 11.72651 
1 1 1   27   26   18 o   21.043   5.9117   8.8673   7.6417   5.7005   12.738   10.648   9.5514   20.410   8.6727   21.676   8.0361 -1.266069 11.82348 
1 1 1   27   26   19 o   48.598   5.5167   58.119   10.628   59.512   14.084   56.276   16.196   50.352   6.7819   46.845   8.7030 3.507092 11.03339 
1 1 1   27   27    0 o   30.100   7.1354   25.633   11.181   25.633   11.181   25.633   11.181   30.100   10.091   30.100   10.091 0.000000 0.000000 
1 1 1   27   27    1 o   37.656   4.8205   31.556   7.0816   36.278   11.840   28.926   8.8363   39.165   7.6040   36.148   5.9268 3.017265 9.640927 
1 1 1   27   27    2 o   54.685   3.5430   62.284   7.6982   74.968   13.158   55.684   9.4921   58.490   5.4545   50.879   4.5233 7.610634 7.086023 
1 1 1   27   27    3 o   28.237   5.6641   19.212   6.6931   19.071   11.522   19.283   8.2227   27.875   8.8889   28.598   7.0226 -0.7228451 11.32823 
1 1 1   27   27    4 o   22.545   5.6552   11.383   6.5074   8.3652   11.464   12.817   7.9041   21.650   8.5977   23.439   7.3487 -1.789434 11.31034 
1 1 1   27   27    5 o   49.208   3.8210   50.597   7.4674   62.864   12.822   44.302   9.1859   53.256   5.8376   45.160   4.9318 8.096561 7.641994 
1 1 1   27   27    6 o   72.064   3.1945  113.488   9.1579  105.684   14.732  118.403   11.692   69.556   5.1352   74.571   3.8013 -5.015762 6.389040 
1 1 1   27   27    7 o   18.142   5.3151   3.8395   6.6032  -3.2189   11.732   7.1122   7.9887   17.030   7.7230   19.253   7.3045 -2.222940 10.63013 
1 1 1   27   27    8 o   84.434   2.9925  153.161   10.017  153.261   16.590  153.104   12.565   83.977   4.7897   84.891   3.5888 -0.9132919 5.985054 
1 1 1   27   27    9 o   50.683   6.0717   85.125   9.2365   29.424   19.538  101.157   10.482   32.435   11.570   68.931   3.6869 -36.49533 12.14331 
1 1 1   27   27   10 o   81.069   3.0912  147.321   9.6062  124.316   16.156  159.902   11.947   75.233   5.2068   86.905   3.3332 -11.67217 6.182362 
1 1 1   27   27   11 o   67.887   3.3457  101.924   8.7707   94.801   14.990  105.633   10.815   65.384   5.5585   70.389   3.7253 -5.005341 6.691410 
1 1 1   27   27   12 o   67.015   4.1774   99.090   10.306  104.425   19.669   97.071   12.100   67.018   7.1159   67.011   4.3778 0.6095886E-02 8.354710 
1 1 1   27   27   13 o   89.261   3.8535  186.110   12.981  149.438   21.931  205.885   16.105   80.634   6.5943   97.888   3.9889 -17.25451 7.706919 
1 1 1   27   27   14 o   39.207   5.1277   37.690   7.4791   33.665   13.021   39.671   9.1366   36.125   8.8166   42.288   5.2384 -6.163200 10.25544 
1 1 1   27   27   15 o   68.588   3.5373  110.869   9.1069   82.365   15.104  127.151   11.415   60.070   6.0964   77.107   3.5894 -17.03707 7.074612 
1 1 1   27   27   16 o   26.595   6.0557   17.234   7.1238   21.669   12.836   15.261   8.5637   28.406   9.4062   24.784   7.6294 3.622189 12.11134 
1 1 1   27   27   17 o   26.053   5.8134   17.814   6.9201   13.502   12.985   19.525   8.1782   23.880   9.2481   28.226   7.0467 -4.346241 11.62686 
1 1 1   27   28    0 o   16.704   6.8161   8.7552   10.718   8.7552   10.718   8.7552   10.718   16.704   9.6394   16.704   9.6394 0.000000 0.000000 
1 1 1   27   28    1 o   20.114   5.5326   5.5570   6.5779   13.815   10.988   0.9440   8.2122   24.306   8.6760   15.921   6.8678 8.384674 11.06526 
1 1 1   27   28    2 f   30.179   5.5446   22.420   6.7933   21.354   11.481   22.993   8.4267   29.096   8.8102   31.262   6.7343 -2.166115 11.08917 
1 1 1   27   28    3 o   20.588   5.4954   8.6505   6.4522   3.8434   11.153   11.069   7.9104   19.222   8.1387   21.955   7.3865 -2.733210 10.99090 
1 1 1   27   28    4 o   56.984   3.5881   70.845   8.0239   71.920   13.609   70.272   9.9346   56.799   5.8090   57.169   4.2133 -0.3697433 7.176121 
1 1 1   27   28    5 o   50.724   4.1166   60.019   8.0164   47.960   13.092   67.251   10.139   45.633   6.9561   55.814   4.4045 -10.18084 8.233270 
1 1 1   27   28    6 o   52.931   3.8357   62.257   7.9628   60.610   13.353   63.167   9.9198   51.805   6.2493   54.057   4.4493 -2.251774 7.671314 
1 1 1   27   28    7 o   30.214   5.7639   20.822   6.9251   29.024   12.575   17.252   8.2965   33.710   8.9098   26.718   7.3148 6.991755 11.52781 
1 1 1   27   28    8 f   21.047   5.7988   8.3329   6.7134   10.288   12.605   7.5587   7.9319   22.693   9.0142   19.400   7.2973 3.292055 11.59769 
1 1 1   27   28    9 f   29.216   5.7155   18.620   6.7880   30.912   12.408   13.370   8.1090   34.840   8.6698   23.591   7.4500 11.24921 11.43101 
1 1 1   27   28   10 o   48.820   4.0324   52.318   7.5912   56.888   13.518   50.214   9.1744   49.673   6.5982   47.967   4.6373 1.706379 8.064851 
1 1 1   27   28   11 o   13.339   4.5801 -15.0252   6.3662  -1.8574   12.274 -19.8718   7.4462   17.551   7.9347   9.1277   4.5773 8.423355 9.160295 
1 1 1   27   28   12 o   69.374   4.8931  126.611   11.592   77.577   20.279  150.410   14.128   55.353   8.8825   83.396   4.1074 -28.04284 9.786146 
1 1 1   27   28   13 o   29.546   5.8557   22.468   7.1125   21.682   13.038   22.802   8.4866   28.384   9.4832   30.708   6.8722 -2.323965 11.71144 
1 1 1   27   28   14 o   29.791   5.6565   24.099   7.2318   16.337   12.687   27.835   8.8017   25.320   9.2834   34.263   6.4655 -8.942905 11.31301 
1 1 1   27   28   15 o   20.296   5.7197   7.9620   6.8382   7.4470   12.469   8.1835   8.1775   20.940   8.7184   19.652   7.4060 1.288464 11.43939 
1 1 1   27   29    0 o   13.135   5.9593   1.9689   10.365   1.9689   10.365   1.9689   10.365   13.135   8.4277   13.135   8.4277 0.000000 0.000000 
1 1 1   27   29    1 o   53.166   4.0587   63.371   8.8548   55.744   12.347   71.449   12.706   49.651   6.0293   56.681   5.4352 -7.029797 8.117452 
1 1 1   27   29    2 o   34.965   5.2719   29.475   7.2025   28.994   12.132   29.738   8.9507   33.650   8.6830   36.281   5.9815 -2.631325 10.54388 
1 1 1   27   29    3 o   38.069   4.7425   31.378   7.0474   45.351   12.022   24.063   8.6986   44.390   6.5666   31.749   6.8444 12.64047 9.485033 
1 1 1   27   29    4 o   18.795   5.5256   4.7929   6.7964   5.3946   11.576   4.4764   8.3956   19.890   8.3495   17.701   7.2397 2.189342 11.05113 
1 1 1   27   29    5 o   60.504   3.5810   80.111   8.6115   83.653   14.301   78.096   10.786   61.025   5.6820   59.982   4.3599 1.042568 7.161975 
1 1 1   27   29    6 o   54.659   3.9974   69.769   8.2479   59.066   14.158   75.267   10.148   50.329   6.8207   58.989   4.1709 -8.659603 7.994849 
1 1 1   27   29    7 o   32.928   5.4167   29.518   7.2797   17.728   12.879   35.054   8.8248   26.247   9.3904   39.609   5.4019 -13.36176 10.83332 
1 1 1   27   29    8 o   66.773   3.2928   98.872   8.6131   93.646   14.376  101.799   10.758   64.710   5.3863   68.836   3.7892 -4.125565 6.585573 
1 1 1   27   29    9 o   35.152   5.3169   29.332   7.0960   34.150   12.529   27.057   8.6101   36.463   8.4896   33.841   6.4033 2.622154 10.63374 
1 1 1   27   29   10 o   34.742   5.3359   33.225   7.2815   19.655   12.786   39.738   8.8582   27.189   9.3861   42.294   5.0781 -15.10476 10.67175 
1 1 1   27   29   11 o   56.972   5.2391   83.313   9.8798   65.567   18.795   90.090   11.614   49.687   9.5178   64.258   4.3822 -14.57089 10.47819 
1 1 1   27   30    0 o   15.993   6.7216   7.8124   10.950   7.8124   10.950   7.8124   10.950   15.993   9.5058   15.993   9.5058 0.000000 0.000000 
1 1 1   27   30    1 o   31.710   5.4956   24.500   8.2019   9.5910   11.262   41.342   11.969   21.541   8.5318   41.879   6.9294 -20.33805 10.99128 
1 1 1   27   30    2 o   18.442   5.5108   2.3296   7.5223   9.7482   10.971  -4.2533   10.334   21.523   8.4537   15.362   7.0718 6.161303 11.02158 
1 1 1   27   30    3 o   33.931   5.4454   30.104   7.4052   22.673   12.485   34.136   9.1976   29.051   9.2518   38.812   5.7457 -9.761284 10.89078 
1 1 1   27   30    4 o   25.467   5.9584   16.002   6.9825   18.470   12.155   14.786   8.5304   26.536   9.1522   24.397   7.6318 2.138880 11.91670 
1 1 1   27   30    5 o   64.436   3.4050   90.821   8.6485   94.346   14.609   88.919   10.731   64.781   5.4676   64.091   4.0596 0.6899948 6.809917 
1 1 1   27   30    6 o   33.241   5.3445   30.190   7.1717   18.300   12.562   35.939   8.7353   26.393   9.2920   40.089   5.2831 -13.69605 10.68892 
1 1 1   27   30    7 o   68.844   3.3626  106.935   9.0017   95.544   14.960  113.400   11.270   65.075   5.5738   72.614   3.7631 -7.539589 6.725189 
1 1 1   28    0    0 o  106.619   4.9096  238.438   30.235  238.438   30.235  238.438   30.235  106.619   6.9432  106.619   6.9432 0.000000 0.000000 
1 1 1   28    0    1 o   34.290   8.3400   32.043   15.006   32.043   15.006   32.043   15.006   34.290   11.795   34.290   11.795 0.000000 0.000000 
1 1 1   28    0    2 o   23.440   8.5035   17.068   14.777   17.068   14.777   17.068   14.777   23.440   12.026   23.440   12.026 0.000000 0.000000 
1 1 1   28    0    3 o   81.979   3.0851  140.277   14.656  140.277   14.656  140.277   14.656   81.979   4.3630   81.979   4.3630 0.000000 0.000000 
1 1 1   28    0    4 o   10.932   5.1188  -2.0611   8.5625  -2.0611   8.5625  -2.0611   8.5625   10.932   7.2391   10.932   7.2391 0.000000 0.000000 
1 1 1   28    0    5 o   95.441   2.3961  189.003   13.301  189.003   13.301  189.003   13.301   95.441   3.3886   95.441   3.3886 0.000000 0.000000 
1 1 1   28    0    6 o   18.310   6.5619   10.333   8.7379   10.333   8.7379   10.333   8.7379   18.310   9.2800   18.310   9.2800 0.000000 0.000000 
1 1 1   28    0    7 o  117.502   2.2468  285.974   15.374  285.974   15.374  285.974   15.374  117.502   3.1775  117.502   3.1775 0.000000 0.000000 
1 1 1   28    0    8 o   54.110   3.2319   61.939   10.033   61.939   10.033   61.939   10.033   54.110   4.5707   54.110   4.5707 0.000000 0.000000 
1 1 1   28    0    9 o   12.808   5.6219   2.4008   8.4116   2.4008   8.4116   2.4008   8.4116   12.808   7.9506   12.808   7.9506 0.000000 0.000000 
1 1 1   28    0   10 o   82.123   2.4915  140.276   11.885  140.276   11.885  140.276   11.885   82.123   3.5235   82.123   3.5235 0.000000 0.000000 
1 1 1   28    0   11 o   96.820   2.3671  194.587   13.332  194.587   13.332  194.587   13.332   96.820   3.3475   96.820   3.3475 0.000000 0.000000 
1 1 1   28    0   12 f   20.828   6.6550   13.228   8.6936   13.228   8.6936   13.228   8.6936   20.828   9.4115   20.828   9.4115 0.000000 0.000000 
1 1 1   28    0   13 o  124.437   2.2347  320.885   16.196  320.885   16.196  320.885   16.196  124.437   3.1603  124.437   3.1603 0.000000 0.000000 
1 1 1   28    0   14 o   64.240   2.9315   86.587   10.879   86.587   10.879   86.587   10.879   64.240   4.1457   64.240   4.1457 0.000000 0.000000 
1 1 1   28    0   15 o  158.743   2.2240  521.847   20.574  521.847   20.574  521.847   20.574  158.743   3.1452  158.743   3.1452 0.000000 0.000000 
1 1 1   28    0   16 o  152.723   2.2283  483.296   19.831  483.296   19.831  483.296   19.831  152.723   3.1513  152.723   3.1513 0.000000 0.000000 
1 1 1   28    0   17 o   91.426   2.4058  173.881   12.789  173.881   12.789  173.881   12.789   91.426   3.4023   91.426   3.4023 0.000000 0.000000 
1 1 1   28    0   18 o  104.800   2.6988  228.737   16.448  228.737   16.448  228.737   16.448  104.800   3.8167  104.800   3.8167 0.000000 0.000000 
1 1 1   28    0   19 f   19.334   8.4452   7.3088   18.747   7.3088   18.747   7.3088   18.747   19.334   11.943   19.334   11.943 0.000000 0.000000 
1 1 1   28    0   20 o   92.992   2.9214  180.673   15.774  180.673   15.774  180.673   15.774   92.992   4.1314   92.992   4.1314 0.000000 0.000000 
1 1 1   28    0   21 o   15.602   6.5495   5.9810   10.375   5.9810   10.375   5.9810   10.375   15.602   9.2624   15.602   9.2624 0.000000 0.000000 
1 1 1   28    0   22 o   18.286   7.0855   10.284   10.837   10.284   10.837   10.284   10.837   18.286   10.020   18.286   10.020 0.000000 0.000000 
1 1 1   28    0   23 o   24.797   7.8257   19.213   12.021   19.213   12.021   19.213   12.021   24.797   11.067   24.797   11.067 0.000000 0.000000 
1 1 1   28    0   24 o   24.556   8.2997   19.482   13.647   19.482   13.647   19.482   13.647   24.556   11.738   24.556   11.738 0.000000 0.000000 
1 1 1   28    0   25 o   75.660   3.3531  120.984   14.664  120.984   14.664  120.984   14.664   75.660   4.7420   75.660   4.7420 0.000000 0.000000 
1 1 1   28    0   26 o   38.696   6.0965   36.198   12.022   36.198   12.022   36.198   12.022   38.696   8.6217   38.696   8.6217 0.000000 0.000000 
1 1 1   28    0   27 o   16.195   6.9123   6.3838   11.936   6.3838   11.936   6.3838   11.936   16.195   9.7755   16.195   9.7755 0.000000 0.000000 
1 1 1   28    0   28 o   10.366   5.1638 -13.0382   12.322 -13.0382   12.322 -13.0382   12.322   10.366   7.3027   10.366   7.3027 0.000000 0.000000 
1 1 1   28    0   29 o   14.965   6.7165   3.0022   12.739   3.0022   12.739   3.0022   12.739   14.965   9.4986   14.965   9.4986 0.000000 0.000000 
1 1 1   28    0   30 o   27.911   9.3474   26.961   17.269   26.961   17.269   26.961   17.269   27.911   13.219   27.911   13.219 0.000000 0.000000 
1 1 1   28    0   31 o   9.8169   5.0719 -39.8109   17.785 -39.8109   17.785 -39.8109   17.785   9.8169   7.1727   9.8169   7.1727 0.000000 0.000000 
1 1 1   28    0   32 o   55.398   7.6279   76.166   21.968   76.166   21.968   76.166   21.968   55.398   10.788   55.398   10.788 0.000000 0.000000 
1 1 1   28    0   33 o   16.848   7.9808  -1.6004   21.861  -1.6004   21.861  -1.6004   21.861   16.848   11.287   16.848   11.287 0.000000 0.000000 
1 1 1   28    1    0 o   51.538   5.6661   59.176   15.807   59.176   15.807   59.176   15.807   51.538   8.0131   51.538   8.0131 0.000000 0.000000 
1 1 1   28    1    1 o  164.936   3.2326  565.384   21.989  573.934   31.307  557.058   30.892  166.168   4.5680  163.704   4.5753 2.463242 6.465271 
1 1 1   28    1    2 o   86.298   3.7766  155.221   13.408  170.383   19.222  140.851   18.713   90.434   5.1534   82.162   5.5222 8.271629 7.553245 
1 1 1   28    1    3 o   80.414   2.8153  134.975   9.2345  140.186   12.327  128.310   13.941   82.235   3.6343   78.593   4.3007 3.641655 5.630672 
1 1 1   28    1    4 o   29.649   5.5081   19.587   6.9162   23.286   9.2309   14.853   10.443   32.671   7.0567   26.627   8.4592 6.043673 11.01613 
1 1 1   28    1    5 o   70.598   2.7426  103.382   7.9571  115.565   11.438   91.954   11.077   74.645   3.7151   66.550   4.0356 8.094818 5.485256 
1 1 1   28    1    6 o   19.079   5.2990   4.6151   6.0956   4.7970   8.7138   4.4409   8.5302   19.253   7.5426   18.904   7.4450 0.3485832 10.59807 
1 1 1   28    1    7 f  158.726   2.1961  521.717   14.376  527.939   20.415  515.596   20.248  159.666   3.1000  157.786   3.1114 1.879868 4.392138 
1 1 1   28    1    8 o  138.206   2.4318  398.530   13.668  412.577   18.079  379.789   20.883  141.135   3.1058  135.278   3.7428 5.857513 4.863575 
1 1 1   28    1    9 o   93.061   2.3797  179.564   9.1339  179.990   12.893  179.135   12.942   93.173   3.3550   92.948   3.3758 0.2247620 4.759474 
1 1 1   28    1   10 o   76.044   2.5895  120.054   8.1214  119.347   11.426  120.777   11.546   75.819   3.6538   76.269   3.6704 -0.4505234 5.178988 
1 1 1   28    1   11 o  124.901   2.2186  323.083   11.422  338.916   16.434  308.289   15.886  127.863   3.1163  121.940   3.1587 5.922821 4.437244 
1 1 1   28    1   12 o  108.289   2.2796  243.002   10.175  232.085   14.143  254.716   14.650  105.767   3.2422  110.811   3.2054 -5.044380 4.559160 
1 1 1   28    1   13 o   28.490   5.0909   17.907   5.9845   17.873   8.4915   17.941   8.4356   28.463   7.2217   28.518   7.1773 -0.5536079E-01 10.18172 
1 1 1   28    1   14 o   95.951   2.3597  191.110   9.3382  189.819   13.203  192.402   13.209   95.624   3.3477   96.277   3.3265 -0.6524048 4.719414 
1 1 1   28    1   15 o   69.454   2.7145  100.333   7.7739   97.545   10.864  103.259   11.129   68.464   3.8473   70.444   3.8304 -1.979630 5.428971 
1 1 1   28    1   16 o   29.482   4.6097   19.362   6.0037   31.784   8.4360   6.6136   8.5460   38.877   5.2611   20.087   7.5708 18.78992 9.219341 
1 1 1   28    1   17 o   41.231   3.8413   36.381   6.3917   28.017   9.0596   44.671   9.0190   36.333   6.0457   46.130   4.7403 -9.797485 7.682558 
1 1 1   28    1   18 o   83.356   2.9871  145.355   10.266  150.545   14.618  140.304   14.421   84.837   4.1778   81.875   4.2705 2.962067 5.974202 
1 1 1   28    1   19 o   84.884   4.0660  139.984   11.398  175.158   26.668  132.122   12.608   90.222   7.1667   79.547   3.8429 10.67492 8.131948 
1 1 1   28    1   20 o  102.302   2.9585  217.935   12.376  227.426   18.938  210.859   16.351  104.153   4.4085  100.451   3.9467 3.702263 5.917039 
1 1 1   28    1   21 o   23.663   6.0398   10.672   7.5883   8.8466   10.796   12.453   10.668   22.611   8.5118   24.714   8.5711 -2.102942 12.07953 
1 1 1   28    1   22 o  158.202   2.7162  523.205   17.713  509.674   24.541  537.920   25.591  156.086   3.8121  160.318   3.8703 -4.231796 5.432468 
1 1 1   28    1   23 o   40.915   5.2260   37.051   8.5821   31.646   11.985   42.739   12.295   37.327   8.0233   44.503   6.6985 -7.175827 10.45196 
1 1 1   28    1   24 o   59.308   4.7258   75.499   11.515   84.653   17.133   67.959   15.550   62.580   6.6380   56.036   6.7282 6.544147 9.451529 
1 1 1   28    1   25 o   83.709   3.6324  149.915   12.459  163.910   17.293  134.811   17.966   87.972   4.7661   79.445   5.4829 8.527405 7.264888 
1 1 1   28    1   26 o   53.180   4.4311   62.026   9.5534   54.941   14.317   67.713   12.826   50.128   6.9249   56.232   5.5304 -6.104256 8.862276 
1 1 1   28    1   27 o  108.157   2.8904  247.125   12.883  258.658   18.240  235.643   18.200  110.734   3.9938  105.580   4.1794 5.153641 5.780794 
1 1 1   28    1   28 o   20.822   5.4479   2.4100   7.6669   17.891   10.897 -12.7632   10.789   27.697   8.6197   13.946   6.6649 13.75082 10.89587 
1 1 1   28    1   29 o   61.339   3.9005   81.772   9.8165   90.604   13.849   72.854   13.916   64.855   5.1775   57.824   5.8351 7.031086 7.801006 
1 1 1   28    1   30 o   82.737   4.7828  152.894   16.212  149.138   21.621  157.717   24.501   81.926   6.3986   83.547   7.1104 -1.621109 9.565559 
1 1 1   28    1   31 o   30.117   8.1504   21.824   14.159   20.321   20.459   23.207   19.616   29.587   11.567   30.648   11.486 -1.060213 16.30078 
1 1 1   28    1   32 o   33.337   9.5648   30.644   20.250   9.2395   45.620   35.896   22.598   31.122   14.509   35.551   12.467 -4.428381 19.12959 
1 1 1   28    1   33 o   31.565   8.6456   23.271   17.065   5.4030   22.788   46.087   25.751   24.753   11.030   38.377   13.316 -13.62416 17.29127 
1 1 1   28    2    0 o  118.634   3.3623  292.898   23.182  292.898   23.182  292.898   23.182  118.634   4.7550  118.634   4.7550 0.000000 0.000000 
1 1 1   28    2    1 o   64.615   4.1641   89.809   10.586   97.253   13.466   77.766   17.127   68.370   4.7753   60.860   6.8232 7.510242 8.328207 
1 1 1   28    2    2 o   88.022   2.9481  160.943   10.697  155.742   15.169  166.088   15.088   86.596   4.2472   89.449   4.0896 -2.853165 5.896101 
1 1 1   28    2    3 f   85.299   2.9393  150.954   10.331  160.362   14.833  142.089   14.398   87.888   4.0921   82.711   4.2206 5.176254 5.878641 
1 1 1   28    2    4 o  143.792   2.3795  428.942   13.942  432.129   18.387  424.631   21.385  144.474   3.0858  143.109   3.6230 1.364563 4.758977 
1 1 1   28    2    5 o  224.609   2.5375  1040.84   23.134  1017.75   30.001  1074.69   36.334  221.651   3.2817  227.566   3.8712 -5.914673 5.075026 
1 1 1   28    2    6 o   40.808   3.9264   35.012   6.5116   42.431   9.3083   27.902   9.1123   45.118   5.0021   36.497   6.0535 8.621040 7.852782 
1 1 1   28    2    7 o  162.278   2.2016  545.307   14.735  537.190   20.683  553.672   20.996  161.052   3.1137  163.504   3.1135 -2.452057 4.403285 
1 1 1   28    2    8 o   46.176   3.4868   44.476   6.6385   43.378   9.4144   45.563   9.3624   45.601   5.0055   46.751   4.8554 -1.150036 6.973536 
1 1 1   28    2    9 o   36.292   4.4479   28.504   6.4094   22.869   9.1554   33.920   8.9757   32.312   7.0666   40.272   5.4038 -7.959949 8.895898 
1 1 1   28    2   10 o   20.434   5.2844   7.1238   5.8628   5.0543   8.2512   9.2341   8.3319   19.017   7.3700   21.851   7.5750 -2.833815 10.56871 
1 1 1   28    2   11 o   84.698   2.4528  148.897   8.5657  143.716   12.046  154.196   12.182   83.201   3.5104   86.195   3.4268 -2.993736 4.905695 
1 1 1   28    2   12 o  132.464   2.2218  363.865   12.138  371.184   17.272  356.723   17.060  133.783   3.1302  131.145   3.1541 2.637665 4.443668 
1 1 1   28    2   13 o  110.993   2.2805  255.641   10.439  253.231   14.781  258.040   14.745  110.467   3.2443  111.520   3.2057 -1.052116 4.560904 
1 1 1   28    2   14 o   81.751   2.5210  138.865   8.4989  141.783   12.032  135.961   12.006   82.613   3.5313   80.888   3.5987 1.725273 5.041938 
1 1 1   28    2   15 o   42.713   3.6451   38.277   6.4155   39.936   9.0415   36.595   9.1047   43.663   5.0206   41.762   5.2859 1.901665 7.290246 
1 1 1   28    2   16 o   81.708   2.4835  138.779   8.3614  147.623   12.011  130.463   11.647   84.243   3.4568   79.173   3.5668 5.069336 4.967027 
1 1 1   28    2   17 o   70.526   2.6631  103.743   7.7462  104.858   10.963  102.632   10.946   70.908   3.7487   70.144   3.7836 0.7640381 5.326203 
1 1 1   28    2   18 o   80.055   3.1904  134.387   10.483  134.504   14.155  134.246   15.601   80.159   4.2815   79.951   4.7310 0.2079620 6.380732 
1 1 1   28    2   19 o   49.318   5.1703   51.619   8.7151   56.009   17.954   50.266   9.9682   49.771   9.0810   48.866   4.9459 0.9047318 10.34053 
1 1 1   28    2   20 o  108.557   3.1705  247.640   14.155  254.175   19.464  240.303   20.623  110.160   4.2839  106.954   4.6752 3.205612 6.341090 
1 1 1   28    2   21 o   33.176   5.8311   25.010   8.0552   30.753   11.387   19.256   11.397   37.052   7.7024   29.299   8.7567 7.752590 11.66216 
1 1 1   28    2   22 o   41.994   5.2162   38.084   8.7454   47.847   13.393   30.826   11.547   47.055   6.9008   36.932   7.8239 10.12362 10.43242 
1 1 1   28    2   23 f   54.426   4.4828   63.937   9.9196   61.578   15.185   65.693   13.102   53.345   6.9015   55.508   5.7228 -2.162224 8.965542 
1 1 1   28    2   24 o   61.824   4.1028   79.952   10.208   89.959   16.705   73.989   12.895   64.659   6.2642   58.989   5.3001 5.669987 8.205553 
1 1 1   28    2   25 o   77.964   3.5686  129.974   11.298  134.417   14.902  123.968   17.326   79.764   4.5298   76.163   5.5154 3.600616 7.137157 
1 1 1   28    2   26 o   17.219   5.3364  -4.3526   7.7956   5.1315   10.932 -14.1638   11.119   20.436   8.2986   14.001   6.7112 6.434668 10.67270 
1 1 1   28    2   27 o   57.068   3.9719   69.900   9.1935   54.264   12.537   88.089   13.522   49.978   6.0820   64.158   5.1101 -14.17955 7.943751 
1 1 1   28    2   28 o   26.528   5.8646   15.051   8.0001   3.9461   11.412   25.782   11.218   19.997   8.3344   33.060   8.2530 -13.06298 11.72916 
1 1 1   28    2   29 o   25.247   6.7071   6.4131   9.4233  -2.3475   11.184   27.855   17.497   17.252   7.7047   33.241   10.981 -15.98865 13.41419 
1 1 1   28    2   30 o   39.644   7.8922   41.605   13.408   41.704   17.956   41.480   20.158   40.071   10.673   39.217   11.629 0.8541222 15.78446 
1 1 1   28    2   31 o   31.792   8.3770   21.742   15.075   41.962   24.133   8.8050   19.304   38.398   12.902   25.186   10.688 13.21201 16.75393 
1 1 1   28    2   32 o   27.590   7.9652   13.686   15.063   0.6043   21.257   26.881   21.349   23.350   10.510   31.830   11.972 -8.479578 15.93049 
1 1 1   28    2   33 o   33.606   9.4917   34.316   22.925 -19.3364   49.444   49.009   25.875   27.703   13.487   39.508   13.359 -11.80512 18.98342 
1 1 1   28    3    0 f   82.059   3.0990  140.573   14.736  140.573   14.736  140.573   14.736   82.059   4.3827   82.059   4.3827 0.000000 0.000000 
1 1 1   28    3    1 o   43.488   4.6930   39.703   8.4136   38.314   11.902   41.091   11.895   42.714   6.7559   44.263   6.5158 -1.548473 9.386047 
1 1 1   28    3    2 o   57.953   3.7130   70.027   8.8738   68.580   12.484   71.505   12.616   57.344   5.2785   58.561   5.2232 -1.216988 7.425925 
1 1 1   28    3    3 o  149.707   2.5677  464.222   15.846  485.208   22.808  444.643   22.030  152.978   3.6149  146.437   3.6475 6.541473 5.135398 
1 1 1   28    3    4 o   25.255   5.4290   13.454   6.7409   20.072   8.8328   4.2232   10.432   30.281   7.1812   20.230   8.1443 10.05092 10.85809 
1 1 1   28    3    5 f  119.787   2.4314  297.630   11.871  298.914   15.656  295.892   18.209  120.138   3.1596  119.436   3.6964 0.7022018 4.862777 
1 1 1   28    3    6 o   62.943   2.8864   82.364   7.4870   85.242   10.515   79.406   10.663   64.071   3.9792   61.816   4.1821 2.254467 5.772701 
1 1 1   28    3    7 o   51.763   3.2673   55.829   6.9659   52.360   9.8353   59.321   9.8673   50.134   4.7566   53.393   4.4808 -3.259113 6.534691 
1 1 1   28    3    8 o  113.585   2.2589  267.297   10.581  261.976   14.872  272.753   15.058  112.438   3.2069  114.731   3.1822 -2.293510 4.517781 
1 1 1   28    3    9 o  104.014   2.3010  224.240   9.8705  220.875   13.851  227.711   14.070  103.221   3.2534  104.806   3.2549 -1.584908 4.602052 
1 1 1   28    3   10 o   35.042   4.5640   26.638   6.3466   26.789   9.2061   26.502   8.7613   35.103   6.6009   34.980   6.3046 0.1227455 9.127982 
1 1 1   28    3   11 o  104.613   2.5622  229.848   10.865  211.947   16.605  243.253   14.369  100.931   3.9888  108.295   3.2170 -7.364433 5.124385 
1 1 1   28    3   12 o   65.174   2.7974   88.566   7.5018   94.981   10.567   82.047   10.652   67.582   3.7911   62.765   4.1146 4.816589 5.594864 
1 1 1   28    3   13 o  147.147   2.2030  449.081   13.369  440.898   18.843  457.374   18.970  145.793   3.1336  148.502   3.0973 -2.709015 4.405991 
1 1 1   28    3   14 o   67.823   2.7131   95.691   7.5893   96.076   10.731   95.305   10.735   67.961   3.8285   67.685   3.8453 0.2758865 5.426170 
1 1 1   28    3   15 o   55.910   3.1044   65.260   7.1506   61.194   10.030   69.464   10.197   54.123   4.4930   57.698   4.2851 -3.575230 6.208849 
1 1 1   28    3   16 o   58.144   3.2424   71.641   7.6474   76.397   10.162   65.432   11.613   60.490   4.0732   55.799   5.0459 4.691845 6.484733 
1 1 1   28    3   17 o   59.818   3.0120   74.798   7.4262   71.169   10.340   78.664   10.672   58.312   4.2994   61.323   4.2195 -3.010242 6.024017 
1 1 1   28    3   18 o   56.599   3.6377   68.120   8.3246   71.001   10.899   64.086   12.897   58.183   4.5419   55.016   5.6836 3.166157 7.275471 
1 1 1   28    3   19 o  100.298   3.1449  208.773   11.469  215.631   22.439  206.347   13.344  101.014   5.3858   99.583   3.2489 1.430824 6.289891 
1 1 1   28    3   20 o   22.412   5.9202   7.6724   7.9197  -0.9142   11.929   14.440   10.591   18.835   8.2005   25.990   8.5410 -7.155260 11.84048 
1 1 1   28    3   21 o   68.149   3.4912   98.288   9.7551   86.745   13.855  109.636   13.737   64.071   5.2430   72.228   4.6114 -8.156525 6.982407 
1 1 1   28    3   22 o  115.672   2.7323  279.736   13.020  272.522   17.899  287.841   18.973  114.118   3.8029  117.227   3.9242 -3.108284 5.464544 
1 1 1   28    3   23 o   88.371   3.5452  168.715   12.593  145.354   19.228  186.262   16.664   82.600   5.6440   94.141   4.2917 -11.54144 7.090368 
1 1 1   28    3   24 o   60.310   3.8577   77.983   9.5328   71.513   13.883   83.755   13.113   57.793   5.8243   62.828   5.0603 -5.035698 7.715493 
1 1 1   28    3   25 o   37.447   6.1590   32.123   9.2245   29.506   12.003   35.898   14.417   35.746   8.3008   39.148   9.1012 -3.402275 12.31806 
1 1 1   28    3   26 f   41.322   5.2197   38.413   8.5547   28.441   11.845   49.283   12.368   34.966   8.3321   47.677   6.2895 -12.71093 10.43945 
1 1 1   28    3   27 o   22.819   5.8775   8.5313   8.0178  -2.0120   11.701   17.862   11.008   17.884   7.9405   27.753   8.6677 -9.868618 11.75504 
1 1 1   28    3   28 f   18.446   5.9059  -3.4705   9.1979  -8.4696   16.454  -1.1982   11.093   19.225   8.8763   17.667   7.7930 1.558064 11.81184 
1 1 1   28    3   29 o   26.048   6.9576   14.193   9.8848   14.446   12.104   13.687   17.128   25.535   9.1070   26.561   10.521 -1.025824 13.91523 
1 1 1   28    3   30 o   67.726   10.749  115.478   30.024  115.478   30.024   0.0000   0.0000   67.726   10.749  ?   ?       ?      ? 
1 1 1   28    3   31 o   27.712   7.5861   15.809   12.680   7.6286   17.409   25.051   18.505   24.061   10.177   31.363   11.253 -7.301739 15.17213 
1 1 1   28    3   32 o   37.359   8.6013   39.753   15.243   42.536   21.496   36.938   21.617   38.675   12.118   36.043   12.210 2.632252 17.20259 
1 1 1   28    3   33 o   27.642   8.7885   9.0526   21.856 -48.5832   49.845   22.772   24.319   25.323   12.561   29.960   12.295 -4.636856 17.57699 
1 1 1   28    3   34 o   62.321   11.110  105.755   27.509   0.0000   0.0000  105.755   27.509  ?   ?    62.321   11.110      ?      ? 
1 1 1   28    4    0 o   85.584   2.9865  152.701   14.826  152.701   14.826  152.701   14.826   85.584   4.2236   85.584   4.2236 0.000000 0.000000 
1 1 1   28    4    1 o   70.193   3.2561  102.513   9.4246  101.876   13.445  103.128   13.214   69.971   4.6590   70.414   4.5501 -0.4433136 6.512256 
1 1 1   28    4    2 o   34.703   5.6369   26.470   7.8982   26.489   11.126   26.450   11.214   34.720   7.9419   34.686   8.0016 0.3404999E-01 11.27388 
1 1 1   28    4    3 o   72.721   3.1761  109.962   9.5235  113.662   13.574  106.374   13.365   73.931   4.4516   71.511   4.5314 2.420265 6.352199 
1 1 1   28    4    4 o   41.634   4.1776   35.697   7.1155   31.327   9.3879   41.598   10.908   38.689   5.8831   44.578   5.9329 -5.888626 8.355265 
1 1 1   28    4    5 o   80.273   2.7669  135.010   9.0357  142.655   12.045  125.171   13.664   82.947   3.5208   77.600   4.2694 5.347458 5.533857 
1 1 1   28    4    6 o   81.560   2.7064  137.082   9.0216  131.093   11.875  145.255   13.873   79.497   3.6219   83.624   4.0224 -4.127045 5.412749 
1 1 1   28    4    7 f  244.147   2.4150  1235.92   24.318  1237.90   34.429  1233.95   34.352  244.341   3.4164  243.952   3.4141 0.3889923 4.829912 
1 1 1   28    4    8 o   39.642   4.4441   35.225   6.6355   19.452   9.3618   51.148   9.4064   29.737   7.6034   49.547   4.6030 -19.81040 8.888119 
1 1 1   28    4    9 o  138.012   2.1966  394.730   12.503  395.959   17.767  393.525   17.598  138.223   3.1164  137.801   3.0963 0.4211731 4.393122 
1 1 1   28    4   10 o   35.991   4.4382   28.049   6.3499   22.543   9.0371   33.419   8.9241   32.042   7.0314   39.939   5.4175 -7.897598 8.876329 
1 1 1   28    4   11 o  114.327   2.2774  271.126   10.738  268.501   15.105  273.807   15.269  113.768   3.2191  114.885   3.2223 -1.117966 4.554798 
1 1 1   28    4   12 o   92.470   2.5774  176.852   9.7708  170.246   13.021  185.365   14.782   90.534   3.4871   94.405   3.7964 -3.871788 5.154863 
1 1 1   28    4   13 o  137.156   2.3418  390.203   13.155  392.611   19.834  388.312   17.577  137.482   3.4979  136.829   3.1145 0.6527100 4.683517 
1 1 1   28    4   14 o  158.662   2.3402  522.723   15.229  521.133   22.746  524.016   20.504  158.387   3.4819  158.936   3.1278 -0.5490723 4.680457 
1 1 1   28    4   15 o  117.676   2.2644  287.344   10.984  274.504   15.317  300.935   15.760  114.965   3.2304  120.387   3.1740 -5.422272 4.528739 
1 1 1   28    4   16 o  105.090   2.3158  229.561   10.035  224.746   14.030  234.605   14.361  103.963   3.2719  106.217   3.2781 -2.254234 4.631546 
1 1 1   28    4   17 o  162.841   2.6556  553.857   17.109  555.816   21.398  550.385   28.489  163.505   3.1730  162.178   4.2592 1.327103 5.311191 
1 1 1   28    4   18 o   79.918   3.1970  133.849   10.533  137.870   15.169  130.104   14.638   81.071   4.5366   78.764   4.5059 2.307335 6.393988 
1 1 1   28    4   19 o   23.415   6.1581   4.3238   6.9475   21.469   15.464  -0.0122   7.7766   31.182   10.324   15.647   6.7155 15.53558 12.31610 
1 1 1   28    4   20 o   29.262   6.2463   19.301   8.3457   14.147   12.570   23.364   11.160   26.397   9.2950   32.127   8.3469 -5.730421 12.49267 
1 1 1   28    4   21 f   87.472   3.1790  159.773   11.406  169.884   17.237  151.898   15.213   89.862   4.6508   85.082   4.3351 4.779861 6.357934 
1 1 1   28    4   22 o   83.312   3.1274  146.433   10.714  138.503   15.471  153.740   14.851   81.061   4.6274   85.563   4.2082 -4.502945 6.254744 
1 1 1   28    4   23 o   30.429   6.2477   22.008   8.8235   11.140   14.233   28.792   11.245   25.247   9.7087   35.611   7.8661 -10.36401 12.49535 
1 1 1   28    4   24 o   41.728   6.1193   37.865   9.5254   46.708   17.489   34.136   11.358   44.495   9.7952   38.960   7.3374 5.535316 12.23860 
1 1 1   28    4   25 o   53.488   4.5435   61.695   9.9770   59.515   13.389   64.418   14.961   52.525   6.1803   54.452   6.6617 -1.926662 9.087049 
1 1 1   28    4   26 o   39.732   5.7485   35.700   9.0385   30.397   11.870   43.017   13.944   36.204   8.1463   43.261   8.1127 -7.057758 11.49692 
1 1 1   28    4   27 o   25.658   5.8275   12.531   8.1678   25.785   11.602  -0.4935   11.501   33.038   8.4735   18.278   8.0024 14.76035 11.65496 
1 1 1   28    4   28 o   54.574   4.1573   65.111   9.1837   50.693   12.811   80.352   13.172   48.025   6.4679   61.123   5.2248 -13.09776 8.314572 
1 1 1   28    4   29 o   35.950   6.9403   34.454   10.800   40.074   13.071   22.362   19.172   41.335   7.9555   30.564   11.375 10.77131 13.88060 
1 1 1   28    4   30 o   71.374   5.4029  118.937   15.463  131.573   20.529  102.367   23.509   76.852   6.4767   65.897   8.6496 10.95479 10.80574 
1 1 1   28    4   31 o   18.276   6.1293 -14.2535   12.331 -14.4874   16.580 -13.9640   18.445   17.664   8.3909   18.889   8.9368 -1.224228 12.25861 
1 1 1   28    4   32 o   35.218   8.6999   34.685   15.747   26.071   21.331   45.001   23.343   31.333   11.924   39.104   12.671 -7.770893 17.39978 
1 1 1   28    4   33 o   35.338   10.617   16.058   20.684  106.211   51.497  -1.2835   22.586   47.606   18.423   23.070   10.559 24.53664 21.23402 
1 1 1   28    4   34 o   34.157   12.714   36.118   23.957   0.0000   0.0000   36.118   23.957  ?   ?    34.157   12.714      ?      ? 
1 1 1   28    5    0 o   53.864   3.9920   62.167   12.227   62.167   12.227   62.167   12.227   53.864   5.6455   53.864   5.6455 0.000000 0.000000 
1 1 1   28    5    1 o   60.827   3.6235   77.381   9.0464   86.258   12.812   68.554   12.775   64.355   4.8269   57.300   5.4057 7.054974 7.247071 
1 1 1   28    5    2 o  196.459   2.6386  800.709   21.380  796.264   30.216  805.166   30.255  195.911   3.7394  197.008   3.7235 -1.097046 5.277123 
1 1 1   28    5    3 o   87.309   2.9360  158.385   10.568  152.657   14.886  164.207   15.007   85.708   4.2110   88.910   4.0923 -3.202133 5.871919 
1 1 1   28    5    4 o  143.503   2.3857  426.468   13.957  424.573   18.374  429.054   21.459  143.180   3.1114  143.826   3.6174 -0.6459198 4.771438 
1 1 1   28    5    5 o   52.371   3.5322   56.022   7.5347   50.050   9.7607   64.828   11.853   49.007   4.8290   55.734   5.1562 -6.727051 7.064371 
1 1 1   28    5    6 o  127.041   2.4201  333.551   12.526  327.774   16.415  341.607   19.382  125.779   3.1642  128.304   3.6627 -2.525352 4.840200 
1 1 1   28    5    7 o  123.533   2.4285  317.532   12.248  324.214   16.303  308.873   18.557  125.083   3.1600  121.982   3.6886 3.101578 4.857089 
1 1 1   28    5    8 o  187.875   2.5906  731.580   20.056  771.939   29.043  694.787   27.730  192.824   3.6518  182.926   3.6754 9.897507 5.181175 
1 1 1   28    5    9 o   73.649   2.8098  113.245   8.4842  108.126   12.533  117.574   11.527   72.068   4.2165   75.230   3.7149 -3.161942 5.619587 
1 1 1   28    5   10 o   46.276   3.5565   44.779   6.7638   49.962   9.7136   39.901   9.4239   48.902   4.8160   43.651   5.2345 5.251637 7.112918 
1 1 1   28    5   11 o  117.650   2.2431  286.971   10.881  296.313   15.589  278.095   15.195  119.519   3.1623  115.782   3.1820 3.736534 4.486119 
1 1 1   28    5   12 o   63.510   2.8580   83.964   7.4851   85.394   10.702   82.595   10.473   64.037   4.0520   62.982   4.0316 1.055328 5.715995 
1 1 1   28    5   13 o   63.578   2.8268   84.144   7.4043   89.518   10.556   78.940   10.388   65.590   3.9023   61.566   4.0910 4.024139 5.653637 
1 1 1   28    5   14 o   65.914   2.7864   90.559   7.5640   96.204   10.701   84.923   10.693   67.989   3.8161   63.840   4.0611 4.148937 5.572750 
1 1 1   28    5   15 o   55.584   3.1300   64.685   7.1684   62.806   10.269   66.471   10.011   54.774   4.5456   56.394   4.3041 -1.619099 6.260009 
1 1 1   28    5   16 o   73.891   2.6516  113.861   8.0807  113.309   11.374  114.424   11.482   73.712   3.7412   74.070   3.7586 -0.3579254 5.303114 
1 1 1   28    5   17 o  130.393   2.6509  354.372   13.714  353.596   17.188  355.731   22.749  130.400   3.1959  130.386   4.2302 0.1333618E-01 5.301740 
1 1 1   28    5   18 o   34.551   4.9998   29.558   7.8181   3.6018   11.853   49.543   10.401   20.639   8.5389   48.463   5.2037 -27.82332 9.999606 
1 1 1   28    5   19 o   71.884   3.5573  105.331   9.4300  116.908   18.340  101.170   10.995   74.161   5.9959   69.606   3.8298 4.554710 7.114606 
1 1 1   28    5   20 o   61.338   4.1169   79.641   8.9116   80.257   18.078   79.444   10.243   61.040   7.1806   61.637   4.0291 -0.5967979 8.233755 
1 1 1   28    5   21 o  131.548   2.9358  363.621   15.547  359.335   24.751  366.415   19.982  130.663   4.5928  132.434   3.6582 -1.770615 5.871611 
1 1 1   28    5   22 o   75.968   3.8451  126.483   11.596  104.421   17.996  142.148   15.164   69.759   6.2548   82.176   4.4741 -12.41742 7.690268 
1 1 1   28    5   23 o   44.380   5.0365   44.055   8.5890   62.525   12.493   27.497   11.828   54.163   5.5923   34.597   8.3781 19.56545 10.07307 
1 1 1   28    5   24 o   91.980   3.0529  179.159   11.521  163.573   16.614  193.596   15.991   87.984   4.5784   95.975   4.0396 -7.990509 6.105729 
1 1 1   28    5   25 o   60.450   3.9110   78.512   9.7057   72.161   13.978   84.424   13.487   57.951   5.8481   62.950   5.1947 -4.998749 7.822063 
1 1 1   28    5   26 o   18.145   5.6429  -2.5388   8.5524   4.1373   11.158 -12.0460   13.315   20.029   8.2854   16.262   7.6631 3.766445 11.28588 
1 1 1   28    5   27 o   45.411   4.6885   45.263   8.7725   47.041   12.764   43.671   12.077   46.228   6.6944   44.595   6.5661 1.633362 9.377026 
1 1 1   28    5   28 o   29.750   6.2055   20.869   8.3885   14.520   11.800   27.356   11.928   25.618   9.0070   33.881   8.5387 -8.262995 12.41105 
1 1 1   28    5   29 o   27.593   6.7821   18.452   10.210   24.740   12.000   1.9718   19.429   31.865   8.8271   23.321   10.299 8.543764 13.56411 
1 1 1   28    5   30 o   57.878   5.6605   81.540   11.478   87.136   13.740   68.617   20.879   63.354   5.2583   52.403   10.026 10.95130 11.32102 
1 1 1   28    5   31 o   52.691   7.0704   71.301   14.571   80.148   19.075   58.910   22.576   58.796   7.8662   46.585   11.751 12.21025 14.14074 
1 1 1   28    5   32 o   23.079   7.9565 -18.3570   19.710 -28.7770   44.491 -15.8126   21.985   26.025   12.698   20.132   9.5915 5.892691 15.91306 
1 1 1   28    5   33 o   27.532   9.0522   5.5307   21.143   11.277   45.886   3.9818   23.822   30.395   14.293   24.668   11.112 5.727303 18.10444 
1 1 1   28    5   34 o   32.208   12.708   31.537   24.898   0.0000   0.0000   31.537   24.898  ?   ?    32.208   12.708      ?      ? 
1 1 1   28    6    0 o   15.172   6.5275   4.4910   10.821   4.4910   10.821   4.4910   10.821   15.172   9.2313   15.172   9.2313 0.000000 0.000000 
1 1 1   28    6    1 o  216.452   2.7030  971.695   24.121  944.442   33.548  1000.86   34.706  213.316   3.8130  219.588   3.8321 -6.272415 5.405922 
1 1 1   28    6    2 o   78.363   3.0763  127.729   9.9341  134.600   14.120  120.994   13.979   80.465   4.2547   76.262   4.4442 4.202995 6.152564 
1 1 1   28    6    3 o  131.103   2.4278  357.093   12.991  361.712   17.237  351.021   19.764  132.139   3.1628  130.067   3.6842 2.072067 4.855541 
1 1 1   28    6    4 o   42.144   4.2704   36.479   7.3440   30.746   9.6515   44.364   11.319   38.283   6.1125   46.005   5.9652 -7.721897 8.540883 
1 1 1   28    6    5 o   64.646   3.2171   86.829   8.5676   82.623   11.781   91.550   12.482   62.990   4.5348   66.301   4.5645 -3.311356 6.434166 
1 1 1   28    6    6 o   59.772   3.2363   74.134   7.8811   72.570   10.320   76.323   12.207   59.062   4.2365   60.482   4.8936 -1.419823 6.472657 
1 1 1   28    6    7 o  176.299   2.4196  641.934   17.348  628.139   22.606  661.694   27.057  174.086   3.1485  178.513   3.6749 -4.426636 4.839160 
1 1 1   28    6    8 o   16.903   4.9800   1.2324   5.8330   3.6490   8.1554  -1.2986   8.3460   18.088   7.2295   15.717   6.8509 2.370395 9.959924 
1 1 1   28    6    9 o  113.613   2.2595  267.688   10.586  260.737   14.893  274.785   15.049  112.118   3.2207  115.108   3.1698 -2.991074 4.518918 
1 1 1   28    6   10 o  107.746   2.2972  240.872   10.207  240.110   14.324  241.659   14.549  107.577   3.2284  107.915   3.2688 -0.3381271 4.594309 
1 1 1   28    6   11 o   59.228   3.0051   73.026   7.3271   79.525   10.555   66.982   10.179   61.784   4.1420   56.672   4.3550 5.111576 6.010173 
1 1 1   28    6   12 o   24.974   5.3935   13.352   6.2085   9.5163   9.0266   16.795   8.5529   22.333   7.8752   27.615   7.3715 -5.282000 10.78697 
1 1 1   28    6   13 o   41.044   3.9164   35.746   6.5582   30.849   9.4856   40.230   9.0773   38.257   6.0116   43.831   5.0212 -5.574291 7.832705 
1 1 1   28    6   14 o   85.815   2.4642  153.158   8.7202  154.329   12.240  151.951   12.427   86.156   3.4445   85.474   3.5250 0.6825714 4.928492 
1 1 1   28    6   15 o  115.961   2.2743  279.541   10.877  277.211   15.379  281.872   15.386  115.474   3.2291  116.448   3.2035 -0.9742050 4.548554 
1 1 1   28    6   16 o  108.177   2.5772  243.783   11.489  247.355   16.633  240.524   15.889  108.916   3.7027  107.438   3.5858 1.477798 5.154384 
1 1 1   28    6   17 o   46.236   6.3642   48.286   10.813   48.975   12.866   46.630   19.954   47.895   6.5131   44.576   10.936 3.319042 12.72835 
1 1 1   28    6   18 o   97.863   2.6560  197.517   10.414  209.727   17.085  190.298   13.137  100.117   4.1375   95.609   3.3314 4.507446 5.311982 
1 1 1   28    6   19 o   38.706   5.7577   30.740   7.7409   38.314   16.578   28.628   8.7538   40.672   9.9616   36.741   5.7767 3.931072 11.51538 
1 1 1   28    6   20 o   59.152   3.4089   72.619   8.0672   77.931   13.308   69.533   10.143   60.707   5.3150   57.597   4.2699 3.110966 6.817733 
1 1 1   28    6   21 o   61.638   3.9206   81.941   9.7925   72.752   14.741   89.200   13.101   58.292   6.1313   64.983   4.8880 -6.691292 7.841267 
1 1 1   28    6   22 o   37.354   6.2126   31.603   9.2609   35.331   14.726   29.164   11.911   38.983   9.2909   35.725   8.2503 3.257908 12.42525 
1 1 1   28    6   23 o   61.819   3.6027   81.222   9.1663   78.272   13.236   83.941   12.706   60.671   5.2896   62.967   4.8925 -2.296181 7.205355 
1 1 1   28    6   24 o   30.954   6.1051   22.381   8.1377   19.295   12.122   24.913   10.980   29.036   9.1001   32.871   8.1410 -3.835175 12.21019 
1 1 1   28    6   25 o   57.304   4.0514   71.720   9.3934   60.891   13.924   80.765   12.725   52.996   6.3701   61.612   5.0077 -8.616039 8.102792 
1 1 1   28    6   26 o   45.000   5.5376   47.651   9.6419   54.920   12.684   37.700   14.840   50.272   6.1173   39.728   9.2325 10.54387 11.07521 
1 1 1   28    6   27 o   48.330   4.4605   51.275   8.8531   48.389   12.862   53.874   12.204   46.877   6.6526   49.782   5.9438 -2.905426 8.921035 
1 1 1   28    6   28 o   43.584   6.6139   41.571   10.789   34.101   12.795   59.954   20.072   37.918   8.4024   49.250   10.217 -11.33228 13.22788 
1 1 1   28    6   29 o   41.362   6.8951   44.323   10.769   46.766   12.490   37.244   21.261   45.774   6.6160   36.950   12.100 8.823658 13.79029 
1 1 1   28    6   30 o   53.826   5.5759   58.196   11.341   46.425   13.192   91.523   22.197   45.335   7.0554   62.317   8.6363 -16.98214 11.15188 
1 1 1   28    6   31 o   32.480   7.9551   28.241   13.604   35.473   17.676   17.732   21.308   36.449   10.908   28.510   11.583 7.939205 15.91026 
1 1 1   28    6   32 o   47.650   10.312   79.644   22.343   70.327   49.854   81.985   24.993   40.459   17.173   54.841   11.421 -14.38237 20.62420 
1 1 1   28    6   33 o   33.890   10.451   25.668   21.076   74.482   52.244   16.180   23.034   40.163   17.323   27.617   11.695 12.54571 20.90152 
1 1 1   28    6   34 o   66.438   10.081  116.326   27.625   0.0000   0.0000  116.326   27.625  ?   ?    66.438   10.081      ?      ? 
1 1 1   28    6   35 o   13.865   6.9941 -48.8034   18.777   0.0000   0.0000 -48.8034   18.777  ?   ?    13.865   6.9941      ?      ? 
1 1 1   28    7    0 o   40.206   6.5508   38.695   13.373   38.695   13.373   38.695   13.373   40.206   9.2642   40.206   9.2642 0.000000 0.000000 
1 1 1   28    7    1 o   24.995   6.0730   12.119   7.6595   15.284   10.855   8.9813   10.810   26.969   8.6305   23.021   8.5463 3.948219 12.14597 
1 1 1   28    7    2 o  109.099   2.7128  247.123   12.205  249.477   17.449  244.868   17.077  109.603   3.8599  108.595   3.8128 1.007896 5.425567 
1 1 1   28    7    3 o   37.383   4.8651   29.203   7.2765   24.189   9.5017   36.313   11.315   33.237   7.1439   41.529   6.6060 -8.292271 9.730138 
1 1 1   28    7    4 o   35.594   4.9482   27.412   6.9226   26.347   9.0309   28.930   10.780   34.848   6.5231   36.341   7.4424 -1.493343 9.896415 
1 1 1   28    7    5 o   50.530   3.6121   52.938   7.4473   50.702   9.7550   56.061   11.530   49.299   4.7975   51.760   5.4012 -2.460648 7.224189 
1 1 1   28    7    6 o   91.882   2.6292  174.596   9.8396  170.686   12.870  180.096   15.265   90.697   3.4406   93.068   3.9767 -2.370598 5.258469 
1 1 1   28    7    7 o   40.023   4.2824   32.966   6.9747   29.455   9.0100   38.216   11.018   37.449   5.8333   42.596   6.2712 -5.147385 8.564776 
1 1 1   28    7    8 o   36.094   4.3660   27.795   6.3647   26.333   8.8360   29.371   9.1755   34.821   6.3878   37.367   5.9536 -2.545448 8.732086 
1 1 1   28    7    9 o  102.867   2.3389  219.586   9.9215  225.459   14.107  213.838   13.956  104.233   3.2815  101.501   3.3338 2.731903 4.677857 
1 1 1   28    7   10 o   51.913   3.3220   57.093   6.9880   45.651   9.9928   68.044   9.7758   46.677   5.1906   57.150   4.1473 -10.47261 6.644005 
1 1 1   28    7   11 o   55.042   3.1157   63.161   7.0708   64.444   10.169   61.959   9.8388   55.579   4.4359   54.506   4.3766 1.073830 6.231483 
1 1 1   28    7   12 o   18.310   5.2786   2.8589   6.2263   4.4979   9.5908   1.6649   8.1858   19.637   7.8430   16.984   7.0670 2.652662 10.55723 
1 1 1   28    7   13 o   32.321   5.3866   23.360   6.9945   24.308   9.1244   22.010   10.892   33.243   6.8814   31.398   8.2890 1.845770 10.77321 
1 1 1   28    7   14 o   24.500   5.4277   12.838   6.1180   11.269   8.5131   14.513   8.7983   23.250   7.6585   25.750   7.6934 -2.500013 10.85546 
1 1 1   28    7   15 o   45.899   3.5757   44.592   6.7262   49.116   9.3760   39.796   9.6546   48.374   4.6994   43.423   5.3907 4.950596 7.151487 
1 1 1   28    7   16 f  139.285   2.4794  404.107   14.243  408.417   20.195  399.842   20.091  140.027   3.4968  138.542   3.5160 1.485306 4.958787 
1 1 1   28    7   17 o   72.967   3.2019  112.214   9.5866  104.749   13.967  118.864   13.182   70.585   4.7977   75.348   4.2417 -4.762909 6.403884 
1 1 1   28    7   18 o   91.853   2.7367  175.544   10.032  178.896   16.470  173.567   12.649   92.404   4.3215   91.302   3.3591 1.101845 5.473492 
1 1 1   28    7   19 o   54.092   4.4920   64.499   8.3786   58.467   17.049   66.420   9.6204   51.846   7.9732   56.338   4.1403 -4.491924 8.984078 
1 1 1   28    7   20 o   33.850   5.1574   29.157   6.9966   13.205   11.903   37.578   8.6484   25.512   9.0383   42.188   4.9703 -16.67579 10.31482 
1 1 1   28    7   21 o   40.568   6.2579   36.847   9.6460   40.830   17.079   34.982   11.689   41.620   10.061   39.515   7.4451 2.104992 12.51575 
1 1 1   28    7   22 o   42.166   5.8372   37.030   9.3648   53.042   16.561   29.504   11.354   48.279   8.6339   36.052   7.8580 12.22767 11.67438 
1 1 1   28    7   23 o   29.739   5.6679   20.469   7.9805   6.8857   11.861   31.703   10.787   21.926   8.7333   37.552   7.2271 -15.62567 11.33588 
1 1 1   28    7   24 o   22.585   5.9952   9.2177   7.6580   6.2084   11.187   11.872   10.506   21.165   8.4644   24.005   8.4926 -2.840464 11.99043 
1 1 1   28    7   25 o   27.672   5.7210   16.737   8.1999   1.5444   12.187   29.304   11.084   19.643   8.4180   35.702   7.7496 -16.05891 11.44202 
1 1 1   28    7   26 f   83.000   3.5462  149.624   11.838  160.014   15.499  135.072   18.341   86.895   4.3245   79.105   5.6214 7.789307 7.092405 
1 1 1   28    7   27 o   54.343   4.1823   64.234   9.3719   66.031   13.306   62.466   13.202   55.127   5.8523   53.560   5.9764 1.567123 8.364608 
1 1 1   28    7   28 o   59.789   5.9498   88.202   12.271   95.546   14.644   70.888   22.486   66.448   5.3435   53.130   10.632 13.31787 11.89963 
1 1 1   28    7   29 o   35.147   7.3347   31.209   10.586   30.900   12.292   32.094   20.828   35.732   8.4701   34.561   11.977 1.170971 14.66934 
1 1 1   28    7   30 o   22.616   6.6307   7.1605   10.262   12.097   12.196  -4.8039   18.988   24.027   9.0466   21.205   9.6966 2.822037 13.26140 
1 1 1   28    7   31 o   35.968   7.9886   35.053   17.074  -5.6562   27.313   61.166   21.875   24.293   11.292   47.643   11.303 -23.35021 15.97727 
1 1 1   28    7   32 o   33.515   9.0899   33.267   18.195   22.812   27.958   40.948   23.964   30.354   12.871   36.675   12.839 -6.321365 18.17980 
1 1 1   28    7   33 o   33.681   9.5986   36.731   22.121   2.5826   48.242   45.823   24.893   29.321   14.034   38.040   13.099 -8.719248 19.19727 
1 1 1   28    7   34 o   40.196   13.297   54.045   25.652   0.0000   0.0000   54.045   25.652  ?   ?    40.196   13.297      ?      ? 
1 1 1   28    7   35 o   20.498   9.7864 -12.0716   23.143   0.0000   0.0000 -12.0716   23.143  ?   ?    20.498   9.7864      ?      ? 
1 1 1   28    8    0 o   17.429   6.8507   8.8264   10.297   8.8264   10.297   8.8264   10.297   17.429   9.6884   17.429   9.6884 0.000000 0.000000 
1 1 1   28    8    1 o   90.413   2.9093  170.036   10.847  167.372   15.384  172.670   15.297   89.701   4.1583   91.126   4.0700 -1.425102 5.818594 
1 1 1   28    8    2 o  108.066   2.6938  242.497   12.004  249.408   17.172  235.893   16.786  109.573   3.7998  106.559   3.8193 3.014252 5.387543 
1 1 1   28    8    3 o   81.219   2.8009  137.718   9.2362  140.630   12.117  133.679   14.269   82.310   3.5694   80.129   4.3175 2.180717 5.601890 
1 1 1   28    8    4 o  161.843   2.7351  547.437   17.203  553.631   21.129  535.255   29.631  163.426   3.1347  160.260   4.4829 3.165710 5.470186 
1 1 1   28    8    5 o  107.094   2.8088  235.890   11.648  230.995   14.142  246.213   20.537  105.535   3.2491  108.652   4.5827 -3.116447 5.617667 
1 1 1   28    8    6 o   75.045   3.1398  117.387   9.7143  112.713   13.626  122.219   13.853   73.516   4.4939   76.574   4.3862 -3.057610 6.279644 
1 1 1   28    8    7 o   36.412   5.9082   29.809   8.5645   27.443   13.573   31.375   11.040   34.997   9.2596   37.827   7.3409 -2.829552 11.81647 
1 1 1   28    8    8 o   43.309   5.0595   36.681   8.4468   26.208   10.345   57.633   14.631   34.458   7.4924   52.159   6.8013 -17.70055 10.11901 
1 1 1   28    8    9 o   74.220   2.9544  114.261   8.8965  111.963   11.532  117.639   13.982   73.367   3.8110   75.073   4.5157 -1.706558 5.908885 
1 1 1   28    8   10 o  141.876   2.2027  417.409   12.888  410.719   18.093  424.301   18.363  140.722   3.1173  143.031   3.1128 -2.308899 4.405371 
1 1 1   28    8   11 o   36.126   4.4491   28.192   6.4042   22.790   9.0084   33.712   9.1063   32.186   6.9865   40.067   5.5105 -7.880932 8.898144 
1 1 1   28    8   12 o  149.060   2.2096  460.887   13.581  449.165   18.957  473.247   19.465  147.114   3.1243  151.006   3.1254 -3.891953 4.419158 
1 1 1   28    8   13 o   55.286   3.0948   64.188   7.0250   69.920   9.8281   58.200   10.045   57.864   4.1181   52.708   4.6208 5.156551 6.189539 
1 1 1   28    8   14 o   45.594   3.5932   43.838   6.7283   39.032   9.4669   48.744   9.5643   43.017   5.3359   48.172   4.8138 -5.155228 7.186416 
1 1 1   28    8   15 o   65.868   2.9056   90.011   7.8488   77.724   10.640  104.677   11.625   60.947   4.2328   70.789   3.9816 -9.841278 5.811174 
1 1 1   28    8   16 o   65.316   3.1936   88.660   8.3187   86.322   10.444   92.720   13.759   64.281   3.9392   66.352   5.0277 -2.071655 6.387120 
1 1 1   28    8   17 o   58.056   3.7140   71.528   8.7894   68.369   13.311   73.970   11.704   56.799   5.6822   59.313   4.7841 -2.513664 7.428006 
1 1 1   28    8   18 o   27.540   5.3300   18.209   6.6531   7.2520   11.394   23.876   8.1952   22.095   8.6336   32.984   6.2529 -10.88863 10.66007 
1 1 1   28    8   19 o   35.581   6.0036   25.126   7.4015   36.290   16.417   22.278   8.2921   39.443   10.060   31.719   6.5552 7.724274 12.00721 
1 1 1   28    8   20 o   22.275   5.4061   10.079   6.5033   0.3936   11.266   14.919   7.9643   18.730   8.0616   25.820   7.2050 -7.090010 10.81212 
1 1 1   28    8   21 o   21.434   6.1082   5.6018   8.4369   0.1222   13.423   9.1801   10.847   20.176   8.7415   22.692   8.5340 -2.516613 12.21645 
1 1 1   28    8   22 o   22.254   5.9190   7.4115   7.9957  -1.4449   11.812   14.903   10.863   18.386   8.0781   26.123   8.6535 -7.737429 11.83801 
1 1 1   28    8   23 o   63.399   3.6723   86.708   9.4364   70.126   13.537  102.381   13.161   57.204   5.7377   69.595   4.5850 -12.39045 7.344627 
1 1 1   28    8   24 o   85.722   3.0453  155.144   10.756  152.526   15.488  157.584   14.948   84.971   4.4193   86.472   4.1912 -1.500885 6.090674 
1 1 1   28    8   25 f   19.983   5.7758   4.2495   7.7103   0.0455   11.180   8.0628   10.648   18.287   7.9503   21.679   8.3804 -3.392370 11.55160 
1 1 1   28    8   26 o   75.320   3.3514  120.784   10.400  128.874   15.011  113.316   14.422   77.773   4.6796   72.867   4.7987 4.905418 6.702730 
1 1 1   28    8   27 o  110.242   3.1707  258.294   14.233  255.890   18.670  261.630   21.991  109.901   4.1188  110.583   4.8217 -0.6821747 6.341368 
1 1 1   28    8   28 o   57.489   5.9743   84.772   11.586   95.162   13.852   60.578   21.138   66.387   5.0591   48.591   10.825 17.79623 11.94863 
1 1 1   28    8   29 o  125.033   3.7673  347.106   18.258  364.146   22.682  315.746   30.772  130.695   4.2079  119.371   6.2501 11.32391 7.534599 
1 1 1   28    8   30 o   43.459   6.8201   50.524   11.330   55.920   13.509   37.724   20.806   49.966   6.5552   36.952   11.962 13.01382 13.64029 
1 1 1   28    8   31 o   36.891   9.0649   41.523   17.464   31.070   28.503   47.805   22.097   33.080   13.411   40.702   12.200 -7.621437 18.12987 
1 1 1   28    8   32 o   35.625   9.3525   39.718   18.432   35.136   29.825   42.549   23.445   33.834   13.718   37.417   12.716 -3.583389 18.70508 
1 1 1   28    8   33 f   50.971   11.432   86.356   23.426  135.032   53.165   74.629   26.095   52.196   19.024   49.745   12.681 2.451237 22.86312 
1 1 1   28    8   34 o   33.665   12.877   37.572   24.955   0.0000   0.0000   37.572   24.955  ?   ?    33.665   12.877      ?      ? 
1 1 1   28    8   35 o   19.744   9.5134 -16.4146   23.021   0.0000   0.0000 -16.4146   23.021  ?   ?    19.744   9.5134      ?      ? 
1 1 1   28    9    0 o  148.996   2.5641  460.248   22.254  460.248   22.254  460.248   22.254  148.996   3.6262  148.996   3.6262 0.000000 0.000000 
1 1 1   28    9    1 o  145.036   2.6057  437.060   15.585  431.034   22.115  443.005   21.966  144.032   3.7228  146.040   3.6468 -2.008438 5.211360 
1 1 1   28    9    2 o   96.210   2.8541  192.824   11.298  176.835   15.928  209.013   16.028   92.158   4.1905  100.262   3.8759 -8.103615 5.708108 
1 1 1   28    9    3 o   30.466   5.5654   19.480   7.3447   11.097   9.7666   30.393   11.143   23.746   8.2030   37.187   7.5236 -13.44093 11.13075 
1 1 1   28    9    4 o  142.486   2.8111  424.818   15.359  429.053   18.627  415.823   27.147  143.839   3.1398  141.132   4.6637 2.707428 5.622116 
1 1 1   28    9    5 o   31.165   5.2621   22.318   6.9547   28.472   8.9995   13.193   10.958   36.785   5.9317   25.544   8.6933 11.24096 10.52419 
1 1 1   28    9    6 o   79.112   2.8055  129.577   8.9897  126.738   11.604  133.840   14.216   78.097   3.6026   80.126   4.3018 -2.029137 5.611095 
1 1 1   28    9    7 o   50.048   3.7791   54.696   7.4616   63.663   9.8138   42.410   11.487   55.258   4.3061   44.837   6.2117 10.42034 7.558224 
1 1 1   28    9    8 f  117.001   2.4454  284.023   11.649  282.532   15.279  286.093   18.000  116.700   3.1745  117.302   3.7205 -0.6028519 4.890743 
1 1 1   28    9    9 o   79.260   2.5819  130.633   8.4362  133.362   11.834  127.814   12.029   80.114   3.5815   78.406   3.7198 1.707291 5.163785 
1 1 1   28    9   10 o  125.700   2.4151  327.254   12.384  322.132   16.293  334.262   19.057  124.600   3.1704  126.800   3.6440 -2.199783 4.830156 
1 1 1   28    9   11 o   23.192   5.4031   6.9384   6.6796   21.090   10.871  -1.6460   8.4666   30.751   8.3539   15.633   6.8547 15.11855 10.80619 
1 1 1   28    9   12 o   36.264   4.9468   28.861   7.0653   27.378   11.234   29.831   9.0876   34.973   7.9663   37.554   5.8671 -2.581684 9.893685 
1 1 1   28    9   13 o   50.178   3.3049   52.844   6.8331   49.935   9.6183   55.809   9.7092   48.763   4.7824   51.593   4.5628 -2.830284 6.609827 
1 1 1   28    9   14 o  133.706   2.2355  371.138   12.319  354.684   17.062  389.056   17.805  130.613   3.1672  136.799   3.1557 -6.186447 4.470931 
1 1 1   28    9   15 o   70.658   2.7827  104.100   8.0977  100.946   11.097  107.693   11.844   69.531   3.8695   71.786   4.0001 -2.255638 5.565438 
1 1 1   28    9   16 o  193.164   2.6903  778.780   21.426  786.120   30.789  771.889   29.834  194.020   3.8476  192.309   3.7614 1.710922 5.380682 
1 1 1   28    9   17 o   37.845   4.8974   31.673   6.9602   30.055   12.153   32.463   8.4906   36.471   8.2696   39.219   5.2490 -2.747551 9.794857 
1 1 1   28    9   18 f  109.710   2.5684  252.582   11.215  245.279   18.304  256.971   14.191  108.260   4.0993  111.160   3.0953 -2.899796 5.136704 
1 1 1   28    9   19 o   70.836   3.9647  117.496   9.5576   86.435   18.611  128.622   11.139   63.158   7.1445   78.515   3.4396 -15.35680 7.929401 
1 1 1   28    9   20 o   49.379   5.1498   57.353   8.2827   46.900   16.815   60.701   9.5174   45.014   9.3620   53.744   4.2937 -8.729702 10.29961 
1 1 1   28    9   21 o   28.549   6.4492   18.617   8.9145   10.701   14.370   23.569   11.366   25.078   9.7241   32.020   8.4743 -6.941652 12.89850 
1 1 1   28    9   22 o   40.804   5.4057   37.273   8.6517   39.803   13.526   35.521   11.255   41.764   8.1450   39.845   7.1097 1.919743 10.81150 
1 1 1   28    9   23 o   43.465   4.8081   41.274   8.3486   49.593   12.361   34.296   11.321   47.917   6.2544   39.013   7.3045 8.904175 9.616259 
1 1 1   28    9   24 o   67.230   3.5602   96.003   9.8514  104.586   14.419   88.489   13.492   70.056   4.9901   64.403   5.0792 5.653740 7.120308 
1 1 1   28    9   25 o   40.819   5.4333   38.152   8.7858   39.770   13.025   36.801   11.901   41.518   7.8948   40.120   7.4670 1.398510 10.86663 
1 1 1   28    9   26 o   40.553   5.3183   37.471   8.6357   29.909   11.985   45.634   12.453   35.601   8.3133   45.505   6.6353 -9.904446 10.63666 
1 1 1   28    9   27 f   76.855   3.9581  127.127   12.066  124.007   15.064  132.713   20.155   76.066   4.8015   77.644   6.2938 -1.578369 7.916201 
1 1 1   28    9   28 o   33.715   7.2847   29.581   10.756   31.291   12.694   25.231   20.250   35.847   8.6787   31.583   11.703 4.264610 14.56948 
1 1 1   28    9   29 o   56.792   5.5410   69.514   11.892   62.647   13.985   87.445   22.599   53.069   6.3894   60.514   9.0545 -7.445225 11.08192 
1 1 1   28    9   30 f   64.612   5.3300   98.816   12.467  102.532   14.771   89.613   23.246   68.575   5.2225   60.649   9.2931 7.926228 10.65999 
1 1 1   28    9   31 f   46.814   7.8884   65.499   19.239   13.850   28.845  106.886   25.821   28.334   12.529   65.294   9.5880 -36.95994 15.77670 
1 1 1   28    9   32 o   39.379   9.2125   50.196   19.011   30.068   29.444   64.587   24.896   32.216   13.404   46.542   12.642 -14.32652 18.42495 
1 1 1   28    9   33 o   46.693   11.564   73.999   23.439  133.049   52.567   59.345   26.187   50.949   18.860   42.438   13.387 8.510796 23.12765 
1 1 1   28    9   34 o   34.006   9.9300   43.572   22.811   31.126   52.172   46.513   25.363   31.264   14.861   36.747   13.175 -5.482969 19.86003 
1 1 1   28   10    0 o   93.879   3.7676  184.979   20.478  184.979   20.478  184.979   20.478   93.879   5.3281   93.879   5.3281 0.000000 0.000000 
1 1 1   28   10    1 o   91.700   3.3484  171.834   12.320  191.986   20.324  160.126   15.491   95.750   5.1463   87.650   4.2852 8.100433 6.696802 
1 1 1   28   10    2 o   99.869   3.0636  207.976   12.507  208.184   16.628  207.706   18.980  100.000   4.0317   99.739   4.6140 0.2604828 6.127268 
1 1 1   28   10    3 o   37.885   4.8919   32.553   7.1698   38.692   9.3859   23.953   11.110   42.961   5.2970   32.809   8.2258 10.15269 9.783756 
1 1 1   28   10    4 o   26.784   5.4647   15.990   6.7304   21.423   8.8218   8.4235   10.411   31.189   7.0264   22.378   8.3713 8.811148 10.92932 
1 1 1   28   10    5 o   91.198   2.6311  172.922   9.7607  172.870   12.790  172.994   15.104   91.244   3.3987   91.153   4.0174 0.9092712E-01 5.262180 
1 1 1   28   10    6 o  123.627   2.4268  314.884   12.195  303.333   15.826  331.775   19.136  120.920   3.1732  126.335   3.6726 -5.414787 4.853546 
1 1 1   28   10    7 o   51.704   3.5889   57.320   7.4295   63.355   9.7609   49.008   11.455   55.128   4.2929   48.280   5.7526 6.848164 7.177862 
1 1 1   28   10    8 o   92.296   2.5785  177.454   9.7006  179.667   12.824  174.495   14.831   93.028   3.3423   91.563   3.9273 1.464783 5.156999 
1 1 1   28   10    9 o   40.688   3.8511   34.765   6.4603   33.437   9.0363   36.153   9.2396   39.887   5.4927   41.489   5.3995 -1.601521 7.702247 
1 1 1   28   10   10 o  195.869   2.2756  796.887   18.383  794.351   25.972  799.434   26.024  195.556   3.2201  196.182   3.2163 -0.6263580 4.551203 
1 1 1   28   10   11 o   29.382   4.9896   19.180   5.9702   19.438   8.5168   18.931   8.3714   29.574   7.0769   29.191   7.0358 0.3836956 9.979250 
1 1 1   28   10   12 o  124.490   2.2420  322.159   11.511  320.485   16.159  323.883   16.401  124.166   3.1553  124.813   3.1861 -0.6466827 4.484100 
1 1 1   28   10   13 o  101.330   2.3346  213.641   9.7565  212.363   13.842  214.902   13.753  101.024   3.3222  101.637   3.2809 -0.6132965 4.669188 
1 1 1   28   10   14 o   51.520   3.3408   55.356   7.0354   45.818   9.5546   66.652   10.398   46.658   4.9650   56.382   4.4713 -9.724575 6.681649 
1 1 1   28   10   15 o   83.787   2.8485  144.801   9.5498  138.947   12.012  154.853   15.743   81.641   3.5674   85.934   4.4417 -4.292358 5.696952 
1 1 1   28   10   16 o   56.187   4.6521   70.484   10.266   83.877   13.595   52.715   15.659   63.045   5.2282   49.329   7.6965 13.71605 9.304293 
1 1 1   28   10   17 o   22.014   5.6879   7.6909   6.5010   13.590   11.214   4.7049   7.9786   25.605   8.7930   18.423   7.2174 7.181732 11.37571 
1 1 1   28   10   18 f   70.613   3.1485  108.969   8.6400   90.641   14.143  119.883   10.913   65.429   5.2408   75.797   3.4909 -10.36786 6.297022 
1 1 1   28   10   19 o   23.439   6.1373   10.034   6.8940   9.4584   15.052   10.186   7.7552   24.866   9.8588   22.012   7.3125 2.853806 12.27468 
1 1 1   28   10   20 o   84.173   3.4343  152.322   10.452  144.089   20.132  155.360   12.229   82.081   5.9468   86.264   3.4371 -4.182770 6.868582 
1 1 1   28   10   21 o   59.524   3.7816   75.454   9.1834   90.414   13.287   61.774   12.707   65.315   4.9324   53.734   5.7334 11.58096 7.563138 
1 1 1   28   10   22 o   38.581   5.7630   35.847   8.9151   23.773   13.900   44.284   11.620   31.859   9.7044   45.304   6.2187 -13.44527 11.52594 
1 1 1   28   10   23 o   45.882   4.8271   44.348   8.9571   55.091   14.507   37.728   11.387   50.141   7.0148   41.624   6.6328 8.516895 9.654138 
1 1 1   28   10   24 f   23.389   5.6477   9.1786   7.9657  -6.5833   12.149   21.064   10.550   16.773   7.7015   30.004   8.2626 -13.23143 11.29531 
1 1 1   28   10   25 o   65.530   3.7017   92.395   9.9803   89.714   14.489   94.815   13.767   64.517   5.4450   66.543   5.0163 -2.026360 7.403404 
1 1 1   28   10   26 o   24.092   6.1178   10.911   8.0912   19.101   12.058   4.2040   10.913   28.435   9.0961   19.748   8.1835 8.687145 12.23556 
1 1 1   28   10   27 o   53.625   9.5988   69.645   13.385   67.004   13.936  101.116   48.100   55.129   6.1289   52.121   18.193 3.007660 19.19766 
1 1 1   28   10   28 o   23.963   6.9789   9.3582   10.378   10.498   12.103   6.1916   20.172   23.193   8.9436   24.733   10.716 -1.539772 13.95780 
1 1 1   28   10   29 o   99.461   4.1150  222.236   15.268  229.490   18.323  205.759   27.616  103.610   4.2878   95.312   7.0249 8.297867 8.230097 
1 1 1   28   10   30 o   31.845   7.3770   27.270   12.782   39.498   16.238   7.3517   20.725   38.897   10.050   24.794   10.802 14.10293 14.75392 
1 1 1   28   10   31 o   40.673   9.4056   52.090   18.221   49.666   27.878   53.898   24.075   39.069   13.833   42.277   12.748 -3.207336 18.81128 
1 1 1   28   10   32 o   38.532   8.9361   47.947   18.001   28.004   28.091   61.841   23.448   31.289   13.061   45.774   12.199 -14.48493 17.87211 
1 1 1   28   10   33 o   47.442   10.773   87.795   23.822   95.522   52.014   85.744   26.798   41.634   17.599   53.250   12.428 -11.61588 21.54524 
1 1 1   28   10   34 o   27.702   9.1392   12.917   21.301   24.299   50.273   10.427   23.516   30.267   14.443   25.136   11.203 5.130285 18.27837 
1 1 1   28   11    0 o   63.665   3.4975   85.682   12.808   85.682   12.808   85.682   12.808   63.665   4.9462   63.665   4.9462 0.000000 0.000000 
1 1 1   28   11    1 o   98.907   2.7816  203.601   11.346  207.167   16.066  200.053   16.025   99.778   3.9039   98.036   3.9633 1.741493 5.563107 
1 1 1   28   11    2 o   74.561   2.9108  117.317   8.7651  124.575   11.515  107.321   13.515   77.424   3.6060   71.697   4.5704 5.727875 5.821671 
1 1 1   28   11    3 o   56.634   3.4757   68.781   7.8571   75.614   10.249   59.042   12.236   60.251   4.1244   53.018   5.5957 7.232098 6.951439 
1 1 1   28   11    4 o   93.004   2.5976  178.644   9.8336  172.964   12.817  186.771   15.332   91.270   3.4049   94.737   3.9238 -3.467407 5.195106 
1 1 1   28   11    5 o   22.624   5.7783   9.0586   7.0549   5.4282   10.025   12.620   9.9297   20.454   8.0661   24.794   8.2761 -4.340078 11.55667 
1 1 1   28   11    6 o  116.797   2.6618  283.745   12.822  284.682   18.079  282.797   18.187  116.996   3.7467  116.598   3.7819 0.3974457 5.323586 
1 1 1   28   11    7 o   96.417   2.7889  196.805   10.603  205.440   13.354  182.073   17.442   99.477   3.2548   93.357   4.5297 6.119370 5.577843 
1 1 1   28   11    8 o   37.377   4.6441   28.959   6.8094   18.961   8.8233   43.684   10.708   29.233   7.3311   45.521   5.7033 -16.28837 9.288293 
1 1 1   28   11    9 o   86.344   2.4407  155.086   8.6879  154.427   12.096  155.789   12.486   86.165   3.4037   86.523   3.4989 -0.3580627 4.881344 
1 1 1   28   11   10 o   32.821   4.7974   23.946   6.2757   26.778   8.7286   20.915   9.0294   35.010   6.2755   30.633   7.2580 4.376877 9.594818 
1 1 1   28   11   11 o  121.626   2.2478  307.531   11.275  304.914   15.859  310.206   16.034  121.104   3.1751  122.148   3.1826 -1.043991 4.495601 
1 1 1   28   11   12 o   47.236   3.4781   47.116   6.6902   56.599   9.5914   38.131   9.3365   51.963   4.4753   42.508   5.3253 9.454662 6.956117 
1 1 1   28   11   13 o   81.759   2.4936  139.294   8.4066  143.194   11.924  135.440   11.854   82.906   3.4870   80.612   3.5654 2.294472 4.987122 
1 1 1   28   11   14 o   64.760   3.3893   90.557   8.7805   75.293   13.410  102.011   11.617   59.671   5.4489   69.848   4.0324 -10.17711 6.778679 
1 1 1   28   11   15 o   39.369   4.9663   35.285   7.6029   25.886   11.458   42.679   10.163   33.818   8.2807   44.921   5.4853 -11.10228 9.932688 
1 1 1   28   11   16 o  109.994   2.9535  251.877   13.362  231.985   18.131  275.522   19.767  105.268   4.1759  114.720   4.1777 -9.452621 5.906929 
1 1 1   28   11   17 o   81.246   2.8817  136.700   9.2840  144.114   15.594  132.629   11.555   82.768   4.5680   79.723   3.5141 3.045380 5.763346 
1 1 1   28   11   18 f  109.679   2.6282  253.738   11.583  241.673   18.348  261.731   14.935  107.305   4.1458  112.054   3.2315 -4.749115 5.256454 
1 1 1   28   11   19 f   35.475   7.5803   26.489   8.3344   29.966   28.169   26.155   8.7250   36.549   13.751   34.402   6.3842 2.146366 15.16063 
1 1 1   28   11   20 f  115.544   3.0808  286.119   13.343  268.766   24.232  293.671   15.985  112.460   5.2242  118.629   3.2670 -6.168137 6.161574 
1 1 1   28   11   21 o   47.655   5.6077   52.231   10.108   55.392   12.642   46.625   16.833   50.737   6.0411   44.574   9.4494 6.163631 11.21548 
1 1 1   28   11   22 o   80.293   3.7618  139.915   12.095  149.134   15.696  126.441   18.975   83.977   4.5318   76.609   6.0055 7.368416 7.523504 
1 1 1   28   11   23 o   46.129   4.8426   46.573   9.1511   48.207   13.852   45.308   12.190   46.700   7.1916   45.559   6.4873 1.140179 9.685287 
1 1 1   28   11   24 o   21.715   6.0502   7.5445   8.0225   5.2878   11.638   9.5879   11.074   20.775   8.5135   22.654   8.5988 -1.878365 12.10040 
1 1 1   28   11   25 o   32.070   5.8720   25.066   8.5817   11.142   12.702   36.758   11.640   24.061   9.1909   40.079   7.3110 -16.01754 11.74409 
1 1 1   28   11   26 o   19.407   5.8641   2.3028   8.3420   0.2199   12.348   4.0516   11.314   18.970   8.2990   19.845   8.2872 -0.8751698 11.72818 
1 1 1   28   11   27 o   38.543   7.4268   48.311   13.197   55.214   13.817 -23.4180   44.540   49.626   6.7505   27.459   13.231 22.16728 14.85361 
1 1 1   28   11   28 o  110.236   3.8738  262.085   16.154  257.462   19.297  272.911   29.532  109.825   4.2600  110.647   6.4712 -0.8217010 7.747543 
1 1 1   28   11   29 o   50.764   6.6165   63.876   12.096   64.541   14.340   62.235   22.522   53.614   6.4849   47.913   11.535 5.701099 13.23309 
1 1 1   28   11   30 f   73.097   5.4191  119.101   15.398  107.185   18.554  145.471   27.601   68.719   6.5462   77.475   8.6378 -8.755615 10.83813 
1 1 1   28   11   31 o   46.994   8.9148   69.024   18.593   49.261   28.554   83.571   24.498   38.516   13.957   55.471   11.095 -16.95497 17.82953 
1 1 1   28   11   32 o   50.890   8.5098   81.910   19.497   47.112   29.069  110.366   26.287   36.641   13.926   65.139   9.7843 -28.49760 17.01955 
1 1 1   28   11   33 o   53.545   8.7674   89.915   19.834   68.110   28.840  109.485   27.321   43.749   14.075   63.341   10.458 -19.59235 17.53478 
1 1 1   28   12    0 o   24.258   7.3146   17.646   10.540   17.646   10.540   17.646   10.540   24.258   10.344   24.258   10.344 0.000000 0.000000 
1 1 1   28   12    1 o   22.672   5.8623   8.8783   7.2527   12.261   10.358   5.6243   10.159   24.701   8.4516   20.642   8.1263 4.058670 11.72456 
1 1 1   28   12    2 o   75.805   2.8392  120.713   8.7152  125.750   11.438  113.740   13.458   77.786   3.5651   73.825   4.4198 3.960754 5.678425 
1 1 1   28   12    3 o   53.584   3.4371   59.841   7.5065   58.540   9.8403   61.653   11.609   52.945   4.5063   54.223   5.1911 -1.278709 6.874175 
1 1 1   28   12    4 o   23.233   5.0703   10.157   6.5581   20.009   8.5241  -4.1319   10.266   30.104   6.9980   16.362   7.3390 13.74248 10.14064 
1 1 1   28   12    5 o   94.951   2.5858  187.200   9.9656  185.422   12.961  189.771   15.586   94.473   3.3263   95.428   3.9600 -0.9550552 5.171684 
1 1 1   28   12    6 o   84.970   2.6996  150.500   9.3153  150.822   12.166  150.044   14.483   85.157   3.4638   84.783   4.1416 0.3741302 5.399192 
1 1 1   28   12    7 o   30.292   5.3103   20.999   6.6315   24.279   8.6752   16.387   10.286   33.244   6.5599   27.339   8.3524 5.905075 10.62053 
1 1 1   28   12    8 f   30.989   5.0052   22.347   6.5591   30.084   8.6651   11.967   10.037   37.736   5.5675   24.242   8.3193 13.49389 10.01033 
1 1 1   28   12    9 o   86.125   2.6365  154.938   9.2543  156.397   12.219  152.975   14.172   86.678   3.4180   85.573   4.0153 1.105309 5.273093 
1 1 1   28   12   10 o   45.074   4.1729   45.798   7.1137   34.148   11.055   54.031   9.2934   39.367   7.0683   50.780   4.4373 -11.41293 8.345700 
1 1 1   28   12   11 o  110.430   2.4809  253.997   11.169  254.412   17.148  253.692   14.720  110.424   3.7651  110.436   3.2317 -0.1265717E-01 4.961864 
1 1 1   28   12   12 o   33.412   4.7159   24.253   6.3649   17.991   8.7211   31.390   9.3105   28.367   7.3827   38.457   5.8699 -10.09024 9.431893 
1 1 1   28   12   13 o   80.618   2.6216  136.052   8.6764  141.217   11.859  130.102   12.728   82.323   3.4926   78.913   3.9106 3.409477 5.243169 
1 1 1   28   12   14 o   86.253   2.8088  155.724   9.8522  153.957   15.208  157.002   12.933   85.732   4.3010   86.773   3.6136 -1.041718 5.617558 
1 1 1   28   12   15 o   55.155   3.8324   64.407   8.6358   63.913   13.107   64.786   11.479   54.869   5.7919   55.440   5.0203 -0.5705757 7.664871 
1 1 1   28   12   16 o   67.614   3.2914   95.755   9.1207  100.621   13.824   92.004   12.137   69.067   4.8529   66.161   4.4478 2.905083 6.582812 
1 1 1   28   12   17 o   17.857   5.3054   1.2024   6.3286   4.9586   10.847  -0.7364   7.7925   20.463   8.2813   15.250   6.6339 5.213018 10.61078 
1 1 1   28   12   18 o  114.242   2.5234  270.965   11.535  279.904   18.872  265.633   14.575  115.564   3.9594  112.920   3.1295 2.643906 5.046889 
1 1 1   28   12   19 o   61.272   5.6494   66.629   9.0260  107.150   29.423   62.419   9.4832   68.063   10.481   54.482   4.2202 13.58081 11.29886 
1 1 1   28   12   20 o   30.066   5.7017   18.496   6.8737   28.690   12.427   14.003   8.2506   35.134   8.6368   24.998   7.4459 10.13623 11.40331 
1 1 1   28   12   21 o   90.207   2.9697  171.428   11.037  161.084   15.488  182.101   15.732   87.398   4.2966   93.017   4.1007 -5.618385 5.939387 
1 1 1   28   12   22 o   59.622   3.7696   76.213   9.2542   74.558   13.385   77.728   12.809   58.927   5.5072   60.317   5.1489 -1.389751 7.539236 
1 1 1   28   12   23 f   64.020   3.7712   86.696   9.8470   97.300   15.379   79.328   12.819   67.179   5.5504   60.861   5.1070 6.317585 7.542448 
1 1 1   28   12   24 o   37.855   5.4805   35.104   8.4834   17.702   12.469   50.104   11.576   27.677   9.2738   48.034   5.8430 -20.35690 10.96103 
1 1 1   28   12   25 o   25.737   6.3678   14.619   8.5513   9.7288   12.392   19.064   11.815   23.132   9.0132   28.341   8.9975 -5.209648 12.73551 
1 1 1   28   12   26 o   33.101   6.3857   27.088   9.2990   35.508   13.066   18.445   13.238   38.400   8.4764   27.801   9.5531 10.59896 12.77149 
1 1 1   28   12   27 o   63.663   6.3192  110.228   13.124  131.546   15.896   64.587   23.259   78.071   4.9366   49.255   11.634 28.81552 12.63849 
1 1 1   28   12   28 o   20.177   6.8944  -7.3591   11.774  -2.0632   12.244 -72.2948   42.875   17.920   8.0280   22.435   11.211 -4.514481 13.78883 
1 1 1   28   12   29 o   31.510   7.1532   26.378   12.551   40.603   15.894   2.8145   20.456   39.619   9.7844   23.401   10.437 16.21830 14.30639 
1 1 1   28   12   30 o   22.716   7.0723   4.0453   12.243   2.1308   15.070   7.7610   20.995   20.687   9.1062   24.744   10.823 -4.057283 14.14457 
1 1 1   28   12   31 o   23.936   7.7069   2.1737   16.769  -5.6723   26.802   7.2207   21.496   23.412   10.982   24.461   10.816 -1.049551 15.41372 
1 1 1   28   12   32 o   21.975   7.3386  -7.2413   17.026  -4.3139   27.026  -9.1675   21.923   23.295   10.959   20.654   9.7632 2.640942 14.67716 
1 1 1   28   12   33 f   42.899   9.5945   63.136   18.885   69.359   28.739   58.406   25.055   44.071   14.037   41.726   13.084 2.345329 19.18897 
1 1 1   28   13    0 o  128.906   2.5910  345.152   19.446  345.152   19.446  345.152   19.446  128.906   3.6643  128.906   3.6643 0.000000 0.000000 
1 1 1   28   13    1 f   74.634   2.8687  116.809   8.6973  119.779   11.441  112.741   13.387   75.846   3.6572   73.423   4.4207 2.423798 5.737375 
1 1 1   28   13    2 o  126.746   2.4211  334.471   12.488  336.270   16.406  331.993   19.255  127.241   3.1261  126.250   3.6979 0.9906845 4.842166 
1 1 1   28   13    3 o   58.107   3.4151   74.622   7.7410   91.694   10.310   52.560   11.720   66.330   3.7686   49.884   5.6964 16.44633 6.830215 
1 1 1   28   13    4 o   42.266   4.1982   36.944   6.9849   27.792   9.0582   50.370   10.971   35.662   6.3933   48.869   5.4429 -13.20725 8.396359 
1 1 1   28   13    5 o   97.372   2.5529  198.611   10.104  204.416   13.324  190.755   15.499   99.147   3.2583   95.597   3.9309 3.550720 5.105709 
1 1 1   28   13    6 o   32.079   5.1280   23.104   6.5523   24.140   8.5405   21.622   10.216   33.134   6.4816   31.023   7.9482 2.111067 10.25597 
1 1 1   28   13    7 o   80.323   2.7372  134.533   8.9609  133.810   11.790  135.522   13.789   80.140   3.5669   80.505   4.1528 -0.3652649 5.474362 
1 1 1   28   13    8 o   20.617   5.4686   7.2170   6.2960   8.4439   8.3241   5.5768   9.6247   21.113   7.5499   20.120   7.9132 0.9930801 10.93712 
1 1 1   28   13    9 o   30.921   5.2089   21.721   6.4859   23.481   8.3788   19.088   10.245   32.663   6.4484   29.178   8.1823 3.485003 10.41789 
1 1 1   28   13   10 o   56.926   3.0287   67.808   7.1080   65.252   9.9037   70.524   10.208   55.817   4.3020   58.036   4.2645 -2.219021 6.057467 
1 1 1   28   13   11 o  100.234   2.3250  209.126   9.6109  206.655   13.630  211.570   13.554   99.637   3.3166  100.832   3.2592 -1.194199 4.650004 
1 1 1   28   13   12 o   79.051   2.6492  130.009   8.6153  125.099   11.691  135.844   12.745   77.444   3.6602   80.658   3.8311 -3.213730 5.298497 
1 1 1   28   13   13 o   86.375   2.5327  155.479   9.0017  154.651   12.304  156.432   13.204   86.158   3.4625   86.591   3.6973 -0.4332199 5.065401 
1 1 1   28   13   14 o   42.551   4.5800   40.136   7.3330   36.466   12.390   42.115   9.0972   40.399   7.7176   44.703   4.9341 -4.304008 9.160001 
1 1 1   28   13   15 o   46.036   4.5426   43.801   7.8931   70.987   12.610   26.286   10.121   57.875   5.2825   34.197   7.3916 23.67847 9.085183 
1 1 1   28   13   16 o   34.381   5.9122   24.327   7.3126   33.126   15.256   21.703   8.3323   37.575   9.7573   31.186   6.6792 6.388510 11.82438 
1 1 1   28   13   17 f   55.756   3.6257   65.680   8.0141   66.548   13.332   65.189   10.028   55.839   5.7888   55.672   4.3674 0.1664314 7.251477 
1 1 1   28   13   18 f   57.056   4.2023   68.414   8.8088   72.815   17.025   66.805   10.294   57.807   7.1408   56.305   4.4326 1.501293 8.404675 
1 1 1   28   13   19 o   23.683   6.9736   7.8623   7.4824  -2.0349   26.701   8.7058   7.7947   26.526   11.871   20.840   7.3209 5.686316 13.94715 
1 1 1   28   13   20 o   30.366   5.7820   18.946   7.0256   29.236   12.773   14.481   8.4126   35.372   8.7930   25.361   7.5106 10.01033 11.56397 
1 1 1   28   13   21 o   27.888   6.1068   17.204   7.8611   23.584   11.863   12.209   10.497   31.674   8.7772   24.102   8.4931 7.572136 12.21363 
1 1 1   28   13   22 o   69.843   3.4634  104.525   9.9218   99.368   14.579  108.975   13.542   68.085   5.1916   71.600   4.5856 -3.514717 6.926736 
1 1 1   28   13   23 o   26.907   6.3230   15.207   8.2417   23.530   13.153   9.8271   10.575   31.274   9.4210   22.539   8.4360 8.734459 12.64599 
1 1 1   28   13   24 f   62.885   3.7269   85.212   9.5974   85.666   14.460   84.855   12.831   62.871   5.5763   62.898   4.9461 -0.2729416E-01 7.453775 
1 1 1   28   13   25 o   22.495   6.1574   9.1210   8.3856   3.6850   12.610   13.431   11.228   20.382   8.6435   24.607   8.7718 -4.225138 12.31479 
1 1 1   28   13   26 o   51.659   5.5425   58.645   11.182   52.980   13.539   70.803   19.834   48.616   6.7520   54.701   8.7913 -6.085079 11.08497 
1 1 1   28   13   27 o   23.946   6.9905   7.2622   10.554   2.8033   12.759   16.925   18.782   20.025   8.5984   27.867   11.024 -7.842258 13.98100 
1 1 1   28   13   28 o   33.050   8.1023   31.040   12.493   34.011   13.079   0.0954   42.206   37.069   8.7033   29.031   13.669 8.037523 16.20459 
1 1 1   28   13   29 o   24.602   7.2842   9.5861   12.061   5.2293   15.216   16.951   19.783   21.817   9.3795   27.388   11.147 -5.570412 14.56838 
1 1 1   28   13   30 o   22.743   7.0451   5.5278   12.125   7.1204   14.651   2.0658   21.601   22.152   9.3509   23.335   10.540 -1.183262 14.09012 
1 1 1   28   13   31 o   22.358   7.3182  -4.2458   16.592 -23.7166   26.962   7.6230   21.050   20.541   9.9912   24.175   10.696 -3.633944 14.63638 
1 1 1   28   13   32 o   23.498   7.5817 -15.3612   16.873   31.964   27.440 -44.1345   21.396   31.346   12.982   15.651   7.8355 15.69498 15.16346 
1 1 1   28   14    0 o   65.004   3.3536   89.295   12.560   89.295   12.560   89.295   12.560   65.004   4.7426   65.004   4.7426 0.000000 0.000000 
1 1 1   28   14    1 o   59.161   3.3066   75.629   7.8094   86.129   10.346   61.722   11.906   64.232   3.9053   54.090   5.3369 10.14174 6.613133 
1 1 1   28   14    2 o  110.470   2.4714  253.978   11.116  253.072   14.590  255.232   17.162  110.321   3.2066  110.619   3.7615 -0.2985535 4.942770 
1 1 1   28   14    3 o   53.630   3.3894   59.549   7.3875   55.648   9.5398   65.392   11.676   51.528   4.4888   55.732   5.0796 -4.203953 6.778779 
1 1 1   28   14    4 o   54.084   3.4210   61.675   7.4839   62.573   9.7249   60.371   11.720   54.672   4.3128   53.496   5.3116 1.176334 6.842036 
1 1 1   28   14    5 o   77.405   2.8091  122.983   8.8351  113.366   11.385  137.544   14.009   73.722   3.7443   81.088   4.1886 -7.366302 5.618235 
1 1 1   28   14    6 o   33.363   5.1202   24.500   6.7624   23.036   8.8046   26.606   10.560   32.244   6.8329   34.482   7.6274 -2.238018 10.24044 
1 1 1   28   14    7 o   91.073   2.5923  169.434   9.6057  152.650   12.404  194.582   15.183   85.595   3.5135   96.551   3.8126 -10.95626 5.184657 
1 1 1   28   14    8 o   87.877   2.6371  160.086   9.4423  154.711   12.337  167.688   14.671   86.176   3.4710   89.577   3.9710 -3.401505 5.274189 
1 1 1   28   14    9 o   82.302   2.7083  140.867   9.0557  138.191   11.779  144.736   14.160   81.433   3.5071   83.172   4.1279 -1.739326 5.416616 
1 1 1   28   14   10 o   77.087   2.5475  123.827   8.0967  120.789   11.276  127.059   11.633   76.114   3.5920   78.059   3.6133 -1.945282 5.094904 
1 1 1   28   14   11 o   75.205   2.5588  117.939   7.9361  115.805   11.207  120.086   11.240   74.517   3.6463   75.894   3.5909 -1.377625 5.117592 
1 1 1   28   14   12 o  122.107   2.3591  310.413   11.843  309.715   16.114  311.234   17.465  122.004   3.2024  122.210   3.4650 -0.2060699 4.718206 
1 1 1   28   14   13 o   51.270   3.7033   56.869   7.3998   51.472   12.368   59.878   9.2350   49.098   6.1077   53.441   4.1898 -4.343430 7.406680 
1 1 1   28   14   14 o   75.482   3.1525  120.660   9.7034  113.877   14.618  126.002   12.974   73.444   4.8257   77.519   4.0579 -4.074646 6.305087 
1 1 1   28   14   15 f   53.761   3.8283   60.550   8.3986   67.272   13.077   55.831   10.957   56.197   5.6422   51.325   5.1759 4.871361 7.656631 
1 1 1   28   14   16 o   72.355   3.0076  110.861   8.6040  106.935   14.225  113.126   10.805   71.135   4.8484   73.576   3.5605 -2.440842 6.015295 
1 1 1   28   14   17 o   56.562   3.5197   67.361   7.8043   69.325   13.354   66.342   9.6178   56.950   5.6852   56.175   4.1512 0.7748566 7.039473 
1 1 1   28   14   18 o   50.616   4.9413   57.537   8.1770   54.439   17.186   58.444   9.2968   48.567   8.9077   52.665   4.2800 -4.098160 9.882590 
1 1 1   28   14   19 o   74.573   3.6764  121.472   9.9581  111.783   18.870  125.212   11.723   71.862   6.3667   77.283   3.6779 -5.421646 7.352703 
1 1 1   28   14   20 o   60.850   3.5644   80.232   8.3984   74.991   14.340   82.968   10.361   58.942   5.8987   62.758   4.0030 -3.815884 7.128706 
1 1 1   28   14   21 o   57.774   3.8699   72.202   9.1502   68.271   13.564   75.484   12.395   56.148   5.8572   59.401   5.0594 -3.252453 7.739802 
1 1 1   28   14   22 o   72.053   3.9436  114.360   11.200  103.664   18.236  120.838   14.192   68.753   6.4309   75.353   4.5663 -6.599899 7.887182 
1 1 1   28   14   23 o   91.975   3.3890  181.962   12.774  163.552   18.394  199.111   17.752   87.228   5.1127   96.722   4.4501 -9.493813 6.778076 
1 1 1   28   14   24 o   55.016   4.4288   64.999   9.9062   81.427   15.522   53.710   12.868   60.758   6.1941   49.274   6.3316 11.48452 8.857508 
1 1 1   28   14   25 o   70.786   3.7067  108.758   10.787  108.750   15.889  108.765   14.691   70.638   5.4537   70.934   5.0214 -0.2958069 7.413353 
1 1 1   28   14   26 o   49.572   6.1807   58.163   11.375   57.191   13.719   60.303   20.348   50.576   6.5769   48.569   10.466 2.006535 12.36134 
1 1 1   28   14   27 o   26.311   7.1748   14.955   10.523   13.805   12.821   17.329   18.422   24.917   9.2961   27.705   10.931 -2.787895 14.34961 
1 1 1   28   14   28 o   38.023   8.9487   44.465   15.504   46.154   16.732   34.209   41.230   42.190   9.8022   33.856   14.974 8.334835 17.89737 
1 1 1   28   14   29 o   30.633   7.7306   26.102   12.979   31.907   15.697   13.552   23.080   34.393   10.276   26.872   11.552 7.520517 15.46125 
1 1 1   28   14   30 o   18.121   6.2181 -18.7604   12.234 -24.0722   14.444  -5.2709   23.017   14.210   6.9945   22.031   10.283 -7.820292 12.43612 
1 1 1   28   14   31 o   28.249   8.4025   20.518   17.448   6.1672   27.501   30.186   22.573   25.247   11.591   31.251   12.168 -6.004251 16.80497 
1 1 1   28   14   32 o   27.179   8.3195   15.470   18.338  -4.1524   27.637   30.906   24.512   23.267   10.987   31.090   12.495 -7.822464 16.63901 
1 1 1   28   15    0 o   26.962   7.2451   20.890   10.711   20.890   10.711   20.890   10.711   26.962   10.246   26.962   10.246 0.000000 0.000000 
1 1 1   28   15    1 o   70.408   2.9692  104.675   8.4690  109.405   11.139   98.197   13.037   72.418   3.7295   68.399   4.6213 4.019363 5.938491 
1 1 1   28   15    2 o   44.157   4.1250   42.522   7.2264   46.828   9.3613   36.172   11.368   47.198   4.8089   41.116   6.7034 6.082024 8.249949 
1 1 1   28   15    3 o  101.579   2.5341  214.954   10.480  214.280   13.753  215.887   16.182  101.476   3.2861  101.682   3.8586 -0.2067490 5.068211 
1 1 1   28   15    4 o   20.589   5.4840   6.9574   6.2676   5.9064   8.1825   8.4494   9.7494   19.331   7.3785   21.847   8.1151 -2.515944 10.96800 
1 1 1   28   15    5 f   59.738   3.2587   75.693   7.8356   78.849   10.168   71.078   12.296   61.415   4.0140   58.060   5.1346 3.354328 6.517382 
1 1 1   28   15    6 o   28.850   5.3966   18.622   6.4388   18.652   8.3184   18.576   10.170   28.915   7.0409   28.785   8.1804 0.1292706 10.79318 
1 1 1   28   15    7 f   17.352   5.0996   0.3367   6.1134  -3.8560   7.9255   6.4961   9.6061   14.100   6.3753   20.603   7.9612 -6.502086 10.19927 
1 1 1   28   15    8 o   82.382   2.7470  144.249   9.1308  157.220   12.094  127.051   13.925   86.894   3.3744   77.870   4.3357 9.023811 5.494078 
1 1 1   28   15    9 o   31.404   5.1525   22.538   6.5025   25.083   8.4614   18.867   10.162   33.812   6.2992   28.996   8.1556 4.816011 10.30502 
1 1 1   28   15   10 o  158.415   2.2273  521.855   14.549  514.411   20.318  529.688   20.843  157.264   3.1325  159.567   3.1671 -2.303070 4.454530 
1 1 1   28   15   11 o   59.699   3.0028   75.299   7.3348   81.687   10.071   68.082   10.704   62.492   3.9072   56.906   4.5607 5.586193 6.005534 
1 1 1   28   15   12 o   92.559   2.4731  179.361   9.4015  185.648   12.866  172.157   13.772   94.364   3.3057   90.753   3.6794 3.610962 4.946229 
1 1 1   28   15   13 o  103.961   2.5604  228.535   10.672  213.907   16.919  238.202   13.753  100.986   4.0620  106.937   3.1183 -5.950684 5.120891 
1 1 1   28   15   14 o   20.648   5.5525   3.4333   6.9385   14.886   11.239  -3.6193   8.8198   26.264   8.8047   15.033   6.7675 11.23097 11.10507 
1 1 1   28   15   15 o   23.356   5.6956   11.408   6.5817   8.7723   11.176   12.808   8.1435   22.597   8.6237   24.115   7.4426 -1.518087 11.39124 
1 1 1   28   15   16 o   41.949   4.2614   36.878   7.1220   41.436   11.967   34.378   8.8625   43.728   6.6352   40.171   5.3490 3.556538 8.522799 
1 1 1   28   15   17 o   83.181   3.3378  145.609   10.076  148.336   19.671  144.639   11.732   83.193   5.7329   83.169   3.4200 0.2449036E-01 6.675501 
1 1 1   28   15   18 o   63.241   4.1534   88.988   8.9739   80.300   18.437   91.686   10.273   60.383   7.4030   66.099   3.7682 -5.715775 8.306824 
1 1 1   28   15   19 o   58.755   4.2052   75.655   8.8107   72.349   17.297   76.814   10.238   57.171   7.3354   60.339   4.1141 -3.167843 8.410365 
1 1 1   28   15   20 o   74.264   3.1419  116.650   9.0829  118.177   15.700  115.882   11.136   74.282   5.1246   74.245   3.6365 0.3775787E-01 6.283730 
1 1 1   28   15   21 o   43.059   4.8127   40.745   8.4985   42.928   12.834   39.040   11.341   43.964   7.0781   42.153   6.5231 1.810791 9.625492 
1 1 1   28   15   22 o  104.438   2.8721  230.817   12.357  233.399   17.956  228.494   17.031  104.934   4.1488  103.943   3.9727 0.9913864 5.744109 
1 1 1   28   15   23 o   75.292   3.4239  121.918   10.605  120.739   15.508  122.953   14.536   74.833   5.0246   75.751   4.6524 -0.9183044 6.847733 
1 1 1   28   15   24 o   40.224   6.0142   38.796   9.6321   41.104   14.356   36.907   12.989   41.189   8.7224   39.258   8.2827 1.930729 12.02840 
1 1 1   28   15   25 o   87.558   3.4188  165.390   12.326  154.808   17.421  175.997   17.442   84.626   4.9912   90.489   4.6734 -5.862968 6.837545 
1 1 1   28   15   26 o   28.344   6.5217   5.2596   10.198 -11.4979   12.118   45.930   18.878   15.139   7.1861   41.550   10.885 -26.41114 13.04347 
1 1 1   28   15   27 o   20.207   6.4547  -5.1783   10.596 -11.9931   12.724   10.238   19.139   15.383   7.3200   25.032   10.633 -9.648603 12.90940 
1 1 1   28   15   28 o   31.212   9.3752   21.217   15.448   18.526   16.439   41.550   45.186   27.462   10.464   34.961   15.559 -7.499487 18.75046 
1 1 1   28   15   29 o   44.760   7.8707   56.009   13.993   55.275   17.189   57.451   24.093   46.348   9.3150   43.172   12.690 3.175289 15.74147 
1 1 1   28   15   30 o   26.493   7.5978   14.852   12.550   7.7376   15.590   27.955   21.157   22.349   9.5477   30.637   11.822 -8.288914 15.19565 
1 1 1   28   15   31 o   23.935   7.6527   5.2094   16.605 -10.2307   27.719   13.851   20.737   22.364   10.686   25.505   10.957 -3.141516 15.30531 
1 1 1   28   16    0 o   11.183   5.1341  -0.2687   7.9993  -0.2687   7.9993  -0.2687   7.9993   11.183   7.2608   11.183   7.2608 0.000000 0.000000 
1 1 1   28   16    1 o   57.681   3.2839   68.909   7.6950   64.612   9.9305   75.365   12.174   55.529   4.3359   59.833   4.9330 -4.303593 6.567727 
1 1 1   28   16    2 o   33.027   5.1604   24.280   6.7133   24.115   8.5915   24.540   10.758   33.071   6.5305   32.984   7.9920 0.8721161E-01 10.32081 
1 1 1   28   16    3 o   76.900   3.1593  125.200   9.8530   99.000   13.885  151.777   13.984   68.584   4.9085   85.215   3.9789 -16.63092 6.318596 
1 1 1   28   16    4 f   39.939   4.2448   33.507   6.9006   31.576   8.9575   36.325   10.823   38.613   5.6245   41.264   6.3591 -2.651516 8.489656 
1 1 1   28   16    5 o   77.406   2.8440  125.803   8.9080  128.212   11.597  122.336   13.913   78.422   3.5854   76.390   4.4158 2.031227 5.688086 
1 1 1   28   16    6 o   81.525   2.7820  140.368   9.1890  148.195   12.131  129.832   14.075   84.334   3.4877   78.716   4.3352 5.618202 5.563999 
1 1 1   28   16    7 o   60.371   3.1282   75.568   7.7101   70.696   10.085   82.420   11.960   58.104   4.2084   62.638   4.6295 -4.533401 6.256469 
1 1 1   28   16    8 o  110.546   2.4800  253.059   11.139  244.992   14.455  264.854   17.479  108.484   3.2307  112.608   3.7634 -4.123810 4.959932 
1 1 1   28   16    9 o   82.314   2.6906  138.538   8.9833  125.524   11.509  158.828   14.371   77.537   3.5989   87.092   4.0007 -9.555389 5.381219 
1 1 1   28   16   10 o   94.037   2.7745  184.951   10.341  184.297   12.943  186.105   17.198   94.006   3.3381   94.067   4.4327 -0.6053925E-01 5.549026 
1 1 1   28   16   11 o   31.178   4.8210   22.156   6.2980   31.446   8.7593   12.213   9.0619   38.446   5.5240   23.909   7.9027 14.53669 9.641947 
1 1 1   28   16   12 o   27.225   5.5954   16.762   6.5085   15.435   11.041   17.468   8.0575   26.573   8.7200   27.877   7.0139 -1.303858 11.19081 
1 1 1   28   16   13 o   74.191   2.9009  114.112   8.6160  121.434   14.168  109.814   10.854   75.915   4.5248   72.467   3.6314 3.448357 5.801850 
1 1 1   28   16   14 o   22.108   5.6782   6.3964   7.0157   17.286   11.400  -0.2417   8.9008   27.744   8.8412   16.472   7.1275 11.27208 11.35639 
1 1 1   28   16   15 o  133.456   2.4883  375.149   13.460  358.190   20.798  387.370   17.655  130.648   3.8597  136.264   3.1414 -5.615479 4.976565 
1 1 1   28   16   16 o   74.367   3.0743  119.972   9.0158  103.632   14.478  130.322   11.523   69.833   5.0266   78.901   3.5409 -9.068016 6.148506 
1 1 1   28   16   17 o   91.810   3.2532  181.202   10.743  172.735   20.892  184.245   12.525   89.721   5.6457   93.899   3.2341 -4.178024 6.506397 
1 1 1   28   16   18 o   58.712   4.1047   75.372   8.6654   72.300   16.823   76.482   10.110   57.217   7.1287   60.207   4.0713 -2.989910 8.209344 
1 1 1   28   16   19 o   76.887   3.6130  126.448   10.020  126.925   19.628  126.280   11.653   76.281   6.2386   77.492   3.6460 -1.211098 7.225907 
1 1 1   28   16   20 f   42.234   5.1377   46.791   7.5559   25.573   13.167   57.209   9.2262   32.538   9.3288   51.930   4.3077 -19.39165 10.27535 
1 1 1   28   16   21 o   19.293   5.6627   3.6977   7.4767   0.6965   11.159   6.1421   10.071   18.400   7.9713   20.185   8.0450 -1.784517 11.32540 
1 1 1   28   16   22 o   22.040   5.6233   7.0803   7.7811  -6.5338   11.445   18.781   10.610   16.041   7.4050   28.039   8.4648 -11.99809 11.24664 
1 1 1   28   16   23 o   71.204   3.8909  108.641   11.269   99.338   14.557  122.554   17.802   67.666   5.2160   74.742   5.7749 -7.075867 7.781809 
1 1 1   28   16   24 o   29.560   6.6310   21.333   9.0809   24.385   13.380   18.726   12.365   31.260   9.5209   27.860   9.2323 3.399452 13.26209 
1 1 1   28   16   25 o   14.228   4.9600 -23.2831   9.7811 -17.2062   11.662 -37.6968   17.961   13.550   6.5861   14.907   7.4181 -1.357094 9.919966 
1 1 1   28   16   26 o   27.826   7.0940   19.557   10.661   23.433   13.095   11.937   18.361   30.247   9.4548   25.406   10.579 4.841152 14.18810 
1 1 1   28   16   27 o   98.006   4.2702  214.181   17.090  206.670   22.498  224.427   26.277   96.474   5.6542   99.539   6.4006 -3.065422 8.540383 
1 1 1   28   16   28 o   37.441   7.4000   42.982   14.274   59.769   17.738   12.133   24.045   48.421   9.2185   26.461   11.578 21.95955 14.80007 
1 1 1   28   16   29 o   61.531   7.5672   90.728   19.204   90.728   19.204   0.0000   0.0000   61.531   7.5672  ?   ?       ?      ? 
1 1 1   28   16   30 o   64.033   6.0273  102.295   15.317  100.787   19.322  104.845   25.127   65.038   7.2029   63.027   9.6660 2.011261 12.05461 
1 1 1   28   17    0 o   11.244   5.1449  -0.0372   7.9429  -0.0372   7.9429  -0.0372   7.9429   11.244   7.2760   11.244   7.2760 0.000000 0.000000 
1 1 1   28   17    1 o  103.336   2.5469  223.098   10.679  224.943   13.945  220.482   16.608  103.960   3.2522  102.711   3.9204 1.249420 5.093786 
1 1 1   28   17    2 o   59.913   3.2249   75.287   7.8452   74.832   10.224   75.938   12.234   59.787   4.1462   60.040   4.9405 -0.2525558 6.449772 
1 1 1   28   17    3 o  101.017   2.5683  211.074   10.537  202.856   13.638  223.243   16.595   98.687   3.3507  103.347   3.8933 -4.660774 5.136643 
1 1 1   28   17    4 o   59.060   3.1865   71.758   7.6523   64.803   9.8655   82.263   12.125   55.589   4.3029   62.531   4.7012 -6.942070 6.373076 
1 1 1   28   17    5 o   55.702   3.3451   65.064   7.5617   63.825   9.8133   66.875   11.864   55.149   4.3143   56.255   5.1133 -1.105537 6.690239 
1 1 1   28   17    6 o   58.301   3.2935   72.242   7.7667   75.390   10.181   67.861   12.012   59.967   4.1165   56.636   5.1422 3.331673 6.586920 
1 1 1   28   17    7 o   40.960   4.3482   34.357   6.8449   22.459   8.7151   53.513   11.058   31.698   6.8649   50.222   5.3386 -18.52369 8.696369 
1 1 1   28   17    8 o   60.062   3.1866   77.793   7.6777   87.152   10.183   65.463   11.688   64.522   3.8265   55.601   5.0966 8.921921 6.373170 
1 1 1   28   17    9 o   60.149   3.2040   74.705   7.8445   67.470   10.144   85.467   12.373   56.649   4.3416   63.650   4.7130 -7.000690 6.407999 
1 1 1   28   17   10 o   91.648   2.8005  177.623   10.216  182.474   12.968  169.686   16.588   93.518   3.3620   89.778   4.4797 3.739853 5.600952 
1 1 1   28   17   11 o   86.999   2.7464  159.552   9.5703  154.432   15.356  162.803   12.238   85.677   4.3456   88.320   3.3595 -2.643265 5.492746 
1 1 1   28   17   12 o   48.520   3.8379   50.437   7.3229   49.163   12.267   51.142   9.1279   47.797   6.2224   49.243   4.4943 -1.446205 7.675706 
1 1 1   28   17   13 o   61.836   3.5035   83.106   8.6913   69.206   13.154   93.877   11.579   56.891   5.6060   66.782   4.2038 -9.890892 7.007052 
1 1 1   28   17   14 o  103.514   2.7569  226.354   11.694  207.077   17.017  243.602   16.097   99.184   4.1598  107.843   3.6190 -8.658653 5.513741 
1 1 1   28   17   15 o   54.791   3.6122   64.694   7.7303   61.296   13.030   66.540   9.6031   53.373   5.9189   56.209   4.1423 -2.835785 7.224366 
1 1 1   28   17   16 o   85.291   3.3359  157.669   10.361  147.342   19.654  161.643   12.193   82.710   5.7615   87.871   3.3642 -5.161179 6.671760 
1 1 1   28   17   17 o   21.693   5.6695   9.2211   6.5876   5.1596   11.969   10.986   7.8900   20.952   8.6155   22.434   7.3720 -1.482290 11.33903 
1 1 1   28   17   18 o   22.522   6.1966   4.6684   6.8908   19.363   15.785   1.2087   7.6591   29.126   10.399   15.917   6.7423 13.20902 12.39314 
1 1 1   28   17   19 o   23.677   6.3378   10.254   7.2599   12.134   16.224   9.7828   8.1180   25.818   10.236   21.535   7.4765 4.282875 12.67558 
1 1 1   28   17   20 o   47.785   4.8448   54.841   8.4950   38.372   13.541   65.529   10.909   40.245   8.4281   55.325   4.7806 -15.08014 9.689560 
1 1 1   28   17   21 o   60.793   4.0052   78.398   9.8958   97.903   15.581   65.212   12.811   66.960   5.6418   54.625   5.6864 12.33522 8.010365 
1 1 1   28   17   22 o   33.759   6.0113   27.664   8.3242   27.511   12.590   27.784   11.095   33.431   8.9523   34.087   8.0249 -0.6564369 12.02260 
1 1 1   28   17   23 o   26.842   6.2679   17.123   8.3309   11.534   12.349   21.791   11.286   23.786   9.0680   29.898   8.6555 -6.112709 12.53579 
1 1 1   28   17   24 o   18.586   5.5938  -0.4877   8.4218 -15.3912   13.370   9.3148   10.843   15.231   7.3163   21.940   8.4638 -6.708361 11.18769 
1 1 1   28   17   25 o   37.654   7.1560   38.514   11.242   41.363   13.790   32.870   19.411   41.070   8.4236   34.237   11.570 6.833450 14.31194 
1 1 1   28   17   26 o   27.440   7.2717   17.804   10.534   15.965   12.719   21.819   18.796   25.769   9.3184   29.111   11.166 -3.342106 14.54334 
1 1 1   28   17   27 o   64.854   5.3499   98.034   14.165   90.056   18.511  109.305   22.002   62.074   7.2302   67.635   7.8874 -5.560905 10.69988 
1 1 1   28   17   28 o   19.028   6.3399  -8.8994   12.734  -7.3803   16.581 -11.0835   19.882   18.583   8.6912   19.474   9.2326 -0.8914013 12.67983 
1 1 1   28   17   29 f   30.230   12.885   28.050   28.278   28.050   28.278   0.0000   0.0000   30.230   12.885  ?   ?       ?      ? 
1 1 1   28   18    0 o  103.568   2.2876  223.022   13.788  223.022   13.788  223.022   13.788  103.568   3.2351  103.568   3.2351 0.000000 0.000000 
1 1 1   28   18    1 o   87.306   2.4109  158.982   8.6769  151.925   12.140  166.350   12.406   85.314   3.4502   89.298   3.3685 -3.983589 4.821837 
1 1 1   28   18    2 o   72.280   2.8683  107.438   8.3953   99.141   10.732  120.522   13.477   68.833   3.7802   75.728   4.3149 -6.894669 5.736573 
1 1 1   28   18    3 f   82.121   2.7580  142.458   9.1631  148.123   11.999  134.531   14.193   84.234   3.4537   80.009   4.3010 4.225052 5.516051 
1 1 1   28   18    4 o   29.900   5.3761   19.381   6.5458   15.793   8.3281   25.179   10.588   26.515   7.3566   33.284   7.8417 -6.768686 10.75226 
1 1 1   28   18    5 o   42.022   4.0156   36.646   6.8567   32.026   8.8197   43.703   10.901   38.803   5.5110   45.242   5.8422 -6.439396 8.031292 
1 1 1   28   18    6 o   28.210   5.4538   18.140   6.4999   19.304   8.4777   16.479   10.125   29.288   7.0934   27.132   8.2861 2.155436 10.90765 
1 1 1   28   18    7 o   70.271   2.8911  103.015   8.2327  100.509   10.636  106.761   13.004   69.315   3.7202   71.228   4.4265 -1.913109 5.782196 
1 1 1   28   18    8 o   38.366   4.4272   31.982   6.6926   31.776   8.6320   32.293   10.597   38.657   5.4140   38.075   7.0063 0.5826530 8.854301 
1 1 1   28   18    9 o   87.660   2.8226  160.172   9.8667  157.117   12.406  165.431   16.276   86.715   3.4688   88.605   4.4538 -1.890526 5.645205 
1 1 1   28   18   10 o   25.854   5.9905   14.603   7.5133   10.705   10.916   18.112   10.357   23.510   8.6124   28.197   8.3291 -4.686914 11.98106 
1 1 1   28   18   11 o  114.024   2.5306  273.430   11.557  266.708   18.588  277.666   14.756  112.664   4.0002  115.383   3.1006 -2.719032 5.061177 
1 1 1   28   18   12 o   82.686   2.9016  149.244   9.3906  123.778   15.120  165.235   11.982   76.426   4.7968   88.945   3.2661 -12.51875 5.803124 
1 1 1   28   18   13 o   35.146   5.3004   27.712   7.3695   30.870   11.473   25.493   9.6155   36.739   7.8119   33.553   7.1659 3.185062 10.60080 
1 1 1   28   18   14 o   47.436   4.2897   52.225   7.4822   39.178   12.276   59.936   9.4377   41.604   7.4266   53.269   4.2957 -11.66463 8.579466 
1 1 1   28   18   15 o   71.843   3.6044  107.369   9.4008  116.811   18.612  104.136   10.892   73.322   6.1546   70.363   3.7532 2.958817 7.208742 
1 1 1   28   18   16 o   87.015   3.5071  161.769   11.590  161.932   20.888  161.696   13.932   86.441   5.8588   87.588   3.8564 -1.147331 7.014145 
1 1 1   28   18   17 o   50.600   4.7128   55.982   9.5030   58.085   15.664   54.758   11.954   50.940   7.4557   50.261   5.7667 0.6793633 9.425572 
1 1 1   28   18   18 o   63.352   3.9760   80.990   8.9019   99.130   18.804   75.750   10.106   66.894   6.8155   59.810   4.0968 7.083488 7.952044 
1 1 1   28   18   19 o   55.430   4.2917   62.329   8.4379   77.949   17.781   57.789   9.5861   58.812   7.3303   52.048   4.4655 6.764431 8.583341 
1 1 1   28   18   20 o   37.924   5.2099   32.187   7.2747   35.687   13.636   30.794   8.6011   38.281   8.8180   37.567   5.5512 0.7140198 10.41986 
1 1 1   28   18   21 o   15.846   5.1366  -5.2178   7.5177  -3.7776   11.446  -6.3104   9.9695   16.847   7.6353   14.845   6.8733 2.002500 10.27326 
1 1 1   28   18   22 o   34.169   5.4275   26.832   8.3229   46.577   12.304   10.177   11.301   45.655   6.5342   22.683   8.6680 22.97154 10.85496 
1 1 1   28   18   23 o   34.666   6.0891   29.647   8.7544   24.173   12.282   35.301   12.482   31.095   9.0373   38.238   8.1631 -7.142303 12.17820 
1 1 1   28   18   24 o   20.734   6.1920   1.8642   10.229   13.162   12.974 -16.6956   16.629   24.425   9.2985   17.043   8.1793 7.381302 12.38396 
1 1 1   28   18   25 o   25.823   6.9130   14.774   11.089   23.615   14.149   0.6989   17.854   30.063   9.8720   21.584   9.6800 8.478344 13.82600 
1 1 1   28   18   26 o   30.104   8.3858   25.034   15.599   15.021   27.628   29.720   18.899   27.914   12.306   32.295   11.394 -4.380804 16.77153 
1 1 1   28   18   27 o   27.726   7.3738   20.100   12.048   27.397   16.011   10.574   18.292   31.219   10.509   24.233   10.347 6.986151 14.74761 
1 1 1   28   18   28 o   43.775   7.7571   54.265   13.743   50.373   17.635   60.285   21.931   42.725   10.157   44.825   11.727 -2.100124 15.51419 
1 1 1   28   19    0 o   8.7083   4.2823  -6.6840   7.7162  -6.6840   7.7162  -6.6840   7.7162   8.7083   6.0560   8.7083   6.0560 0.000000 0.000000 
1 1 1   28   19    1 f   48.111   3.3925   49.340   6.6362   40.146   9.4083   58.443   9.3618   43.498   5.2442   52.724   4.3051 -9.226490 6.784986 
1 1 1   28   19    2 o   59.495   3.2734   75.661   7.8069   79.551   10.093   69.868   12.317   61.598   3.9727   57.392   5.2036 4.205936 6.546780 
1 1 1   28   19    3 o   73.182   2.9035  110.657   8.5959  103.882   10.989  121.335   13.797   70.440   3.7826   75.924   4.4060 -5.484428 5.806960 
1 1 1   28   19    4 o   24.392   5.1754   13.230   6.2859   19.907   8.1389   3.3594   9.8956   29.793   6.7764   18.992   7.8243 10.80156 10.35082 
1 1 1   28   19    5 o   37.805   4.4876   30.054   6.6997   22.721   8.6594   40.989   10.575   31.847   6.7993   43.763   5.8586 -11.91613 8.975201 
1 1 1   28   19    6 o   92.245   2.6451  177.534   9.9170  174.104   12.913  182.466   15.484   91.278   3.4301   93.212   4.0275 -1.934830 5.290218 
1 1 1   28   19    7 o   52.819   3.4331   58.192   7.3703   54.071   9.5139   64.376   11.656   50.600   4.5587   55.038   5.1345 -4.437962 6.866238 
1 1 1   28   19    8 o   51.372   3.8138   58.585   7.6328   65.279   9.7267   47.857   12.314   55.676   4.2358   47.068   6.3433 8.608017 7.627562 
1 1 1   28   19    9 o   55.241   3.5485   64.551   7.8424   63.699   9.9285   65.963   12.788   54.951   4.3807   55.531   5.5835 -0.5803795 7.096956 
1 1 1   28   19   10 o   19.629   5.3955   4.7189   6.8373  -4.1559   10.670   10.903   8.9063   16.442   7.4189   22.816   7.8362 -6.374157 10.79100 
1 1 1   28   19   11 f   65.711   3.2180   92.889   8.3509   85.577   13.646   97.267   10.559   63.345   5.2232   68.077   3.7605 -4.732056 6.436097 
1 1 1   28   19   12 o   34.064   5.4536   27.892   7.6451   18.356   12.045   34.326   9.8933   28.281   9.0957   39.848   6.0197 -11.56710 10.90726 
1 1 1   28   19   13 o   61.225   3.6590   81.301   8.9980   74.847   14.086   85.750   11.695   58.856   5.8026   63.593   4.4589 -4.737198 7.317911 
1 1 1   28   19   14 o   85.326   3.1387  152.082   10.246  161.111   18.503  148.089   12.305   86.690   5.1751   83.961   3.5532 2.728432 6.277488 
1 1 1   28   19   15 o   23.225   6.1478   10.687   7.1265   6.0737   16.040   11.822   7.9548   23.407   9.8272   23.043   7.3897 0.3637104 12.29557 
1 1 1   28   19   16 o   30.685   5.6911   20.548   6.8128   27.016   12.582   17.865   8.1036   33.527   8.9363   27.844   7.0495 5.683096 11.38218 
1 1 1   28   19   17 o   33.236   5.4900   24.725   6.9254   29.233   12.664   22.802   8.2718   34.830   8.8097   31.643   6.5537 3.187155 10.98004 
1 1 1   28   19   18 f   25.186   6.0822   14.933   7.3035   7.3641   15.691   17.026   8.2519   23.390   9.7626   26.983   7.2569 -3.593258 12.16438 
1 1 1   28   19   19 o   17.938   5.6360   0.1946   6.7144   0.5208   15.490   0.1191   7.4508   20.835   9.1987   15.041   6.5148 5.793692 11.27206 
1 1 1   28   19   20 o   73.497   3.1186  114.147   9.0018  120.199   15.415  111.017   11.089   74.573   5.0120   72.422   3.7123 2.150993 6.237112 
1 1 1   28   19   21 o   39.200   5.5486   35.834   8.6019   42.262   13.186   31.073   11.349   42.279   7.8507   36.120   7.8431 6.159378 11.09716 
1 1 1   28   19   22 o   32.294   6.1699   28.592   9.5982   8.7240   16.299   39.140   11.876   23.750   9.9346   40.839   7.3195 -17.08900 12.33980 
1 1 1   28   19   23 o   39.321   5.6906   37.314   8.8955   41.416   13.223   33.922   12.023   41.334   8.0460   37.308   8.0494 4.025772 11.38118 
1 1 1   28   19   24 o   23.320   6.6389   10.349   10.025   14.594   12.550   2.8646   16.665   24.980   9.2214   21.660   9.5532 3.320038 13.27772 
1 1 1   28   19   25 o   47.091   6.3045   56.597   11.755   63.342   15.744   48.099   17.670   51.916   7.3525   42.266   10.243 9.649727 12.60896 
1 1 1   28   19   26 o   17.463   5.7875  -8.7984   10.628  -2.8332   14.716 -15.3030   15.367   18.690   8.5424   16.237   7.8107 2.452229 11.57500 
1 1 1   28   19   27 o   48.630   7.0996   64.895   13.520   67.863   17.099   59.947   22.081   52.719   7.8642   44.541   11.823 8.177025 14.19929 
1 1 1   28   20    0 o  120.163   2.2370  300.131   15.654  300.131   15.654  300.131   15.654  120.163   3.1636  120.163   3.1636 0.000000 0.000000 
1 1 1   28   20    1 o   65.650   2.7375   90.445   7.4099   93.645   10.533   87.308   10.426   66.815   3.8221   64.486   3.9202 2.328621 5.475050 
1 1 1   28   20    2 o   60.536   3.2014   77.595   7.8042   78.341   10.044   76.460   12.398   61.064   3.9879   60.008   5.0093 1.056339 6.402845 
1 1 1   28   20    3 o   56.168   3.3443   65.538   7.6159   60.417   9.7634   73.495   12.171   53.509   4.4239   58.826   5.0165 -5.317211 6.688524 
1 1 1   28   20    4 o  113.938   2.4828  273.392   11.514  283.726   15.279  259.814   17.515  116.595   3.1773  111.281   3.8160 5.314034 4.965583 
1 1 1   28   20    5 o   82.018   2.7349  140.651   9.1315  137.813   11.936  144.657   14.179   81.132   3.5670   82.904   4.1468 -1.771889 5.469896 
1 1 1   28   20    6 o   20.389   5.4652   7.2050   6.2718   7.8711   8.1372   6.2302   9.8437   20.405   7.4418   20.372   8.0058 0.3236008E-01 10.93043 
1 1 1   28   20    7 o   59.662   3.4279   74.592   8.1801   71.815   10.295   79.348   13.473   58.360   4.2771   60.964   5.3581 -2.604313 6.855843 
1 1 1   28   20    8 o   50.737   3.7151   53.801   7.6243   49.498   9.7214   60.679   12.289   48.272   4.8828   53.202   5.6006 -4.930305 7.430209 
1 1 1   28   20    9 o   64.927   3.6837   87.327   9.5365  100.703   16.065   80.049   11.850   68.432   5.6920   61.422   4.6777 7.009254 7.367481 
1 1 1   28   20   10 o   68.789   3.4748  103.940   9.5173   84.456   14.550  118.508   12.582   62.629   5.6329   74.948   4.0703 -12.31918 6.949599 
1 1 1   28   20   11 o   41.493   4.9064   38.580   7.9840   37.769   12.656   39.116   10.290   40.480   7.8640   42.505   5.8694 -2.024918 9.812835 
1 1 1   28   20   12 o   51.646   3.9342   56.849   8.2336   61.251   13.094   53.970   10.589   53.103   5.9786   50.188   5.1154 2.914791 7.868339 
1 1 1   28   20   13 o   36.525   5.4092   29.755   7.6921   36.039   12.702   26.115   9.6664   39.307   8.1040   33.744   7.1668 5.562859 10.81845 
1 1 1   28   20   14 o   37.983   5.7740   41.406   7.9909   17.346   16.653   48.603   9.1080   28.218   10.581   47.748   4.6249 -19.53041 11.54799 
1 1 1   28   20   15 o   40.640   4.9787   39.306   7.3173   32.269   12.994   42.574   8.8548   36.690   8.7159   44.590   4.8148 -7.899685 9.957327 
1 1 1   28   20   16 o   43.858   4.3341   40.474   7.2946   47.565   13.356   37.460   8.7081   46.038   7.0339   41.677   5.0659 4.360924 8.668276 
1 1 1   28   20   17 o   27.392   5.8926   17.473   6.8356   18.618   12.666   17.003   8.1197   27.847   9.3467   26.937   7.1785 0.9093266 11.78521 
1 1 1   28   20   18 o   46.924   5.4019   54.176   8.3533   44.469   16.723   57.403   9.6425   42.086   9.8143   51.762   4.5166 -9.675934 10.80371 
1 1 1   28   20   19 o   51.742   5.4630   65.238   10.001   53.713   17.881   70.485   12.064   46.460   9.6469   57.023   5.1297 -10.56282 10.92594 
1 1 1   28   20   20 o   93.875   2.8389  187.481   10.500  188.742   17.670  186.793   13.055   93.669   4.5737   94.081   3.3644 -0.4122314 5.677843 
1 1 1   28   20   21 o   40.401   5.6022   39.803   9.0376   30.523   13.220   47.947   12.384   34.727   9.1145   46.076   6.5164 -11.34862 11.20434 
1 1 1   28   20   22 o   49.689   4.7270   56.544   9.6336   51.955   13.893   60.793   13.370   47.432   7.1017   51.945   6.2404 -4.513103 9.453941 
1 1 1   28   20   23 o   59.788   4.0727   79.727   10.036   76.897   14.238   82.521   14.148   58.632   5.8878   60.943   5.6286 -2.311497 8.145420 
1 1 1   28   20   24 o   30.918   7.1628   24.517   10.259   19.671   12.847   33.046   17.042   27.609   9.4126   34.227   10.799 -6.618841 14.32557 
1 1 1   28   20   25 o   44.281   7.6520   55.491   13.790   54.383   21.046   56.325   18.255   42.834   11.619   45.727   9.9610 -2.892731 15.30409 
1 1 1   28   20   26 o   25.092   6.9738   13.891   11.401   24.196   15.547   1.9034   16.769   29.333   10.336   20.852   9.3645 8.480360 13.94753 
1 1 1   28   21    0 o   37.140   4.4844   31.416   8.8640   31.416   8.8640   31.416   8.8640   37.140   6.3418   37.140   6.3418 0.000000 0.000000 
1 1 1   28   21    1 o   53.690   3.0555   60.865   6.7637   62.525   9.5416   59.188   9.5892   54.447   4.2490   52.933   4.3922 1.513386 6.111084 
1 1 1   28   21    2 o   20.874   5.3898   6.4615   6.1774   1.6737   7.8625   14.184   9.9853   16.427   6.8878   25.321   8.2921 -8.893381 10.77960 
1 1 1   28   21    3 o   50.703   3.6366   55.391   7.4681   58.447   9.8622   51.282   11.434   52.541   4.5510   48.865   5.6734 3.676460 7.273196 
1 1 1   28   21    4 o   23.003   5.3904   11.269   6.3422   16.023   8.3716   4.8660   9.7163   26.510   7.3831   19.495   7.8560 7.015114 10.78084 
1 1 1   28   21    5 o   74.265   3.0806  117.645   9.3156  137.956   13.128   97.043   13.221   80.950   3.9319   67.580   4.7434 13.37016 6.161172 
1 1 1   28   21    6 o  105.750   2.9942  234.488   12.989  219.297   17.307  254.075   19.653  101.930   4.1168  109.569   4.3488 -7.639282 5.988391 
1 1 1   28   21    7 o   28.138   5.5912   16.801   6.9136   10.260   8.8555   27.011   11.063   22.215   7.8033   34.062   8.0097 -11.84616 11.18243 
1 1 1   28   21    8 o   98.242   2.8724  203.997   11.628  197.668   16.610  210.082   16.285   96.687   4.1651   99.797   3.9565 -3.110405 5.744748 
1 1 1   28   21    9 o   81.011   3.0566  138.186   10.146  146.926   15.425  131.521   13.469   83.164   4.4969   78.859   4.1413 4.305092 6.113293 
1 1 1   28   21   10 o   46.167   4.6129   48.805   8.2095   37.783   12.323   57.602   11.008   40.520   7.6540   51.815   5.1510 -11.29515 9.225865 
1 1 1   28   21   11 o   51.668   4.0326   56.947   8.5257   65.860   13.071   50.346   11.248   55.112   5.7504   48.224   5.6550 6.887428 8.065106 
1 1 1   28   21   12 o   41.813   5.0686   41.975   8.0259   29.130   12.460   51.083   10.492   34.906   8.6890   48.720   5.2216 -13.81356 10.13721 
1 1 1   28   21   13 f   41.625   5.8686   51.049   8.2844   21.986   17.424   59.539   9.4169   30.339   10.915   52.911   4.3152 -22.57181 11.73724 
1 1 1   28   21   14 o   90.093   3.5697  182.187   11.420  159.871   22.021  190.397   13.357   85.086   6.2750   95.100   3.4053 -10.01357 7.139459 
1 1 1   28   21   15 o   75.534   3.8251  125.295   11.152  120.646   19.267  127.638   13.677   73.733   6.3356   77.336   4.2878 -3.603027 7.650124 
1 1 1   28   21   16 o   68.217   3.4677  107.352   8.8369   80.565   14.935  121.782   10.962   60.469   5.9884   75.965   3.4986 -15.49503 6.935478 
1 1 1   28   21   17 o   35.924   5.4665   31.126   7.4094   27.480   13.476   32.707   8.8707   33.161   9.4141   38.688   5.5592 -5.527710 10.93296 
1 1 1   28   21   18 o   24.456   6.0440   14.092   7.1886   5.0314   16.344   16.265   8.0045   22.628   9.7243   26.283   7.1804 -3.655357 12.08797 
1 1 1   28   21   19 o   23.308   6.2881   7.1629   7.1807   22.203   15.786   3.2388   8.0632   29.559   10.415   17.057   7.0487 12.50173 12.57628 
1 1 1   28   21   20 o   21.067   5.9701   7.3535   8.1042   2.3192   12.185   11.347   10.852   19.252   8.3350   22.881   8.5495 -3.629244 11.94012 
1 1 1   28   21   21 o   37.059   6.0290   34.065   9.0148   36.912   13.205   31.580   12.337   38.541   8.5323   35.577   8.5202 2.964092 12.05797 
1 1 1   28   21   22 o   42.675   5.6445   44.787   9.5661   34.956   13.834   53.793   13.242   36.870   9.1426   48.481   6.6225 -11.61123 11.28909 
1 1 1   28   21   23 o   21.387   6.2493   5.2713   10.069   15.423   12.681 -12.0527   16.566   25.131   9.2710   17.642   8.3825 7.488531 12.49869 
1 1 1   28   21   24 o   55.503   5.3868   73.202   11.731   70.905   14.503   77.546   19.949   55.494   6.3364   55.512   8.7132 -0.1803207E-01 10.77355 
1 1 1   28   21   25 o   32.722   8.0946   32.552   13.427   34.635   19.923   30.818   18.175   33.379   11.705   32.064   11.184 1.314606 16.18924 
1 1 1   28   22    0 o   55.147   3.6024   65.452   11.360   65.452   11.360   65.452   11.360   55.147   5.0945   55.147   5.0945 0.000000 0.000000 
1 1 1   28   22    1 o  109.515   2.4454  249.641   10.953  236.907   14.439  266.902   16.811  106.340   3.2922  112.689   3.6169 -6.348976 4.890889 
1 1 1   28   22    2 o   47.154   3.8935   46.989   7.3846   52.013   12.067   43.981   9.3371   48.950   5.9770   45.357   4.9912 3.593197 7.786973 
1 1 1   28   22    3 o   40.016   4.9591   35.987   7.9714   34.195   11.609   37.585   10.965   38.586   7.5648   41.447   6.4145 -2.861408 9.918236 
1 1 1   28   22    4 o   73.371   2.9038  112.595   8.6611  106.990   11.219  120.864   13.627   71.258   3.8172   75.485   4.3769 -4.227257 5.807600 
1 1 1   28   22    5 o   48.466   3.8835   48.257   7.5635   40.216   9.4845   62.304   12.536   43.248   5.3172   53.684   5.6616 -10.43575 7.766963 
1 1 1   28   22    6 o   77.248   3.1470  130.561   9.4903  140.573   11.959  113.535   15.596   81.782   3.5455   72.714   5.2003 9.067963 6.293920 
1 1 1   28   22    7 o   76.641   3.3253  125.366   10.498  132.355   14.845  118.375   14.848   78.852   4.5647   74.429   4.8368 4.422989 6.650609 
1 1 1   28   22    8 o   48.190   4.2496   50.860   8.3446   48.714   12.639   52.519   11.110   47.059   6.5121   49.322   5.4615 -2.262825 8.499125 
1 1 1   28   22    9 o   43.679   5.0371   45.437   8.3345   31.399   12.669   56.149   11.066   36.299   8.5950   51.059   5.2549 -14.76007 10.07413 
1 1 1   28   22   10 o   43.728   4.8811   43.603   8.3840   39.437   12.851   46.690   11.063   41.152   7.8578   46.304   5.7928 -5.152157 9.762243 
1 1 1   28   22   11 o   58.833   7.2303   96.150   14.590  112.498   17.532   59.323   26.313   71.679   5.9301   45.987   13.189 25.69153 14.46054 
1 1 1   28   22   12 o   58.858   3.8580   77.111   9.0667   66.459   14.050   84.713   11.869   54.836   6.2122   62.880   4.5764 -8.044113 7.715909 
1 1 1   28   22   13 o  100.638   3.2520  221.029   11.721  209.202   22.835  225.260   13.657   97.768   5.6628  103.507   3.1991 -5.738205 6.503958 
1 1 1   28   22   14 o   46.723   4.5712   51.551   7.6669   42.217   13.435   56.058   9.3364   42.254   8.0019   51.192   4.4219 -8.937771 9.142430 
1 1 1   28   22   15 o   71.673   3.1997  111.711   8.8482  105.274   15.238  114.986   10.868   69.579   5.3097   73.768   3.5721 -4.189270 6.399491 
1 1 1   28   22   16 o   47.315   4.7750   56.058   7.8708   36.925   13.378   66.186   9.7336   38.975   8.5570   55.654   4.2404 -16.67937 9.550016 
1 1 1   28   22   17 o   53.549   4.4019   60.337   8.3226   71.622   17.407   56.993   9.4758   55.611   7.5892   51.487   4.4622 4.123627 8.803874 
1 1 1   28   22   18 o   29.853   6.3779   20.363   7.3699   26.805   16.189   18.679   8.2773   31.717   10.567   27.989   7.1456 3.727316 12.75589 
1 1 1   28   22   19 o   36.411   5.5575   41.872   7.9350   10.710   16.934   50.640   8.9822   24.423   10.163   48.399   4.4997 -23.97599 11.11502 
1 1 1   28   22   20 o   40.409   5.6859   39.852   9.0666   39.548   13.790   40.083   12.033   39.782   8.6512   41.036   7.3809 -1.253136 11.37190 
1 1 1   28   22   21 o   26.210   6.3539   15.710   8.7022   25.955   13.128   7.6787   11.623   31.394   9.4015   21.027   8.5498 10.36641 12.70778 
1 1 1   28   22   22 o   16.925   5.4690  -3.5482   8.4534  -1.3512   12.776  -5.2589   11.274   18.018   8.1253   15.831   7.3227 2.186839 10.93810 
1 1 1   28   22   23 o   65.618   4.7895   94.724   12.393   81.011   15.085  123.204   21.739   59.443   6.1527   71.793   7.3417 -12.35000 9.579010 
1 1 1   28   22   24 o   39.840   6.4610   40.758   12.650   10.422   17.038   78.024   18.884   23.558   10.021   56.121   8.1586 -32.56240 12.92207 
1 1 1   28   23    0 o   74.977   2.6202  118.022   11.395  118.022   11.395  118.022   11.395   74.977   3.7055   74.977   3.7055 0.000000 0.000000 
1 1 1   28   23    1 o   86.358   2.4834  156.788   8.8445  159.789   12.556  153.831   12.461   87.187   3.4916   85.528   3.5324 1.659851 4.966803 
1 1 1   28   23    2 o   69.693   2.6780  102.518   7.6911  106.850   10.843   98.131   10.911   71.215   3.6916   68.171   3.8806 3.043190 5.356030 
1 1 1   28   23    3 o   66.409   2.8141   93.354   7.6856  101.991   10.922   84.882   10.817   69.524   3.8089   63.294   4.1437 6.230278 5.628281 
1 1 1   28   23    4 o   42.447   4.4634   40.692   7.2531   42.819   9.1793   37.157   11.834   44.680   4.9812   40.213   7.4079 4.466160 8.926858 
1 1 1   28   23    5 o   53.177   3.7434   61.065   7.8830   61.241   9.8863   60.757   13.062   53.619   4.4705   52.734   6.0056 0.8845444 7.486795 
1 1 1   28   23    6 o   66.014   5.8244   95.015   15.858   95.015   15.858   0.0000   0.0000   66.014   5.8244  ?   ?       ?      ? 
1 1 1   28   23    7 f   36.755   6.2580   41.984   11.206   54.540   12.556  -7.1755   24.845   49.832   6.1092   23.678   10.924 26.15390 12.51596 
1 1 1   28   23    8 o   21.031   5.8258   7.2770   7.3060   10.196   11.225   5.1320   9.6234   22.784   8.6551   19.278   7.8007 3.506948 11.65166 
1 1 1   28   23    9 o   46.440   4.9183   51.350   8.6141   34.846   12.810   64.972   11.638   38.098   8.3801   54.783   5.1509 -16.68416 9.836577 
1 1 1   28   23   10 o   63.393   3.6737   88.855   9.3875   74.216   13.968  100.914   12.677   58.135   5.8256   68.650   4.4774 -10.51583 7.347395 
1 1 1   28   23   11 o   63.602   4.0323   89.655   10.413  103.431   14.440   74.731   15.030   69.149   5.0632   58.056   6.2771 11.09384 8.064623 
1 1 1   28   23   12 o   43.654   6.0031   46.274   9.5270   42.769   17.670   47.711   11.312   40.731   10.463   46.577   5.8886 -5.845913 12.00617 
1 1 1   28   23   13 f   52.114   5.2336   66.982   8.8032   53.451   17.690   71.437   10.149   46.389   9.5637   57.840   4.2544 -11.45161 10.46729 
1 1 1   28   23   14 o   23.859   5.8278   9.8810   6.8673   22.108   12.307   4.3526   8.2754   29.843   9.1394   17.874   7.2334 11.96951 11.65552 
1 1 1   28   23   15 o   33.412   5.3853   29.300   7.2098   17.548   12.752   34.821   8.7408   26.929   9.3694   39.895   5.3122 -12.96539 10.77057 
1 1 1   28   23   16 o   34.967   5.4298   28.907   7.2667   29.538   13.044   28.623   8.7505   34.093   9.1045   35.841   5.9195 -1.747414 10.85966 
1 1 1   28   23   17 o   61.548   4.2128   86.401   8.9748   80.932   18.132   88.176   10.329   58.858   7.4694   64.237   3.8984 -5.379223 8.425533 
1 1 1   28   23   18 f   29.100   6.2779   20.926   7.3411   20.723   16.401   20.977   8.2094   28.445   10.533   29.755   6.8334 -1.310135 12.55582 
1 1 1   28   23   19 o   54.630   5.5359   81.370   9.0861   52.937   18.621   90.256   10.409   44.345   10.367   64.914   3.8880 -20.56908 11.07188 
1 1 1   28   23   20 o   94.248   3.1354  191.756   12.103  162.911   16.470  225.616   17.845   86.384   4.6228  102.112   4.2371 -15.72766 6.270833 
1 1 1   28   23   21 o   48.246   5.3257   58.100   9.7560   39.185   14.148   75.249   13.471   38.704   9.0282   57.787   5.6521 -19.08232 10.65147 
1 1 1   28   23   22 o   59.859   4.9850   79.700   11.919   63.170   14.820  109.973   20.055   51.727   6.9465   67.992   7.1516 -16.26561 9.969927 
1 1 1   28   24    0 o   11.895   5.3315   1.6527   7.9980   1.6527   7.9980   1.6527   7.9980   11.895   7.5399   11.895   7.5399 0.000000 0.000000 
1 1 1   28   24    1 o   42.131   4.1826   39.210   7.1673   40.662   9.5146   37.306   10.898   43.280   5.3302   40.983   6.4471 2.296513 8.365128 
1 1 1   28   24    2 f   18.218   5.0061   3.1360   6.2930   11.078   8.1355  -8.6946   9.9295   22.314   7.4910   14.121   6.6431 8.192624 10.01225 
1 1 1   28   24    3 o   14.046   4.4667  -2.7320   5.4483  -1.0443   7.6099  -4.5068   7.8038   14.655   6.4599   13.436   6.1706 1.218226 8.933487 
1 1 1   28   24    4 f   52.171   3.7818   58.088   7.8548   55.150   9.7988   63.370   13.138   50.670   4.6888   53.673   5.9349 -3.003101 7.563553 
1 1 1   28   24    5 o   50.885   4.5150   58.850   8.8276   40.398   12.336   78.213   12.637   41.657   7.4538   60.112   5.0970 -18.45498 9.029926 
1 1 1   28   24    6 o   23.927   5.6780   11.538   7.6982  -0.9732   11.517   21.643   10.350   17.857   7.9054   29.997   8.1526 -12.14021 11.35606 
1 1 1   28   24    7 o   65.460   3.4750   92.411   9.3562   92.784   13.751   92.089   12.767   65.477   5.0920   65.442   4.7300 0.3400421E-01 6.949908 
1 1 1   28   24    8 o   62.090   3.6916   85.022   9.2716   72.383   13.755   95.546   12.551   57.424   5.8077   66.755   4.5587 -9.331310 7.383152 
1 1 1   28   24    9 o   77.065   3.1946  126.400   10.085  134.812   15.352  120.013   13.376   79.184   4.7007   74.945   4.3273 4.238647 6.389225 
1 1 1   28   24   10 f   24.670   6.0078   13.812   7.7395   7.7178   11.721   18.522   10.305   21.598   8.6548   27.742   8.3348 -6.144957 12.01557 
1 1 1   28   24   11 o   73.961   6.2926  140.750   16.522  167.602   20.928   96.326   26.918   87.198   5.8190   60.724   11.159 26.47439 12.58518 
1 1 1   28   24   12 o   27.146   6.7891   16.685   8.8214   21.253   16.485   14.852   10.442   29.176   10.599   25.115   8.4865 4.060696 13.57829 
1 1 1   28   24   13 o   22.684   5.9044   11.083   7.0109   10.644   12.299   11.294   8.5331   23.039   8.9788   22.329   7.6701 0.7098560 11.80884 
1 1 1   28   24   14 o   16.488   5.2209  -4.3728   7.0316   5.1807   12.073  -9.2766   8.6500   20.334   8.5309   12.643   6.0213 7.690992 10.44182 
1 1 1   28   24   15 o   95.501   3.0856  198.719   11.996  168.268   17.297  226.942   16.652   87.972   4.7672  103.029   3.9187 -15.05736 6.171101 
1 1 1   28   24   16 o   57.926   3.8173   76.019   8.4271   68.265   14.556   79.927   10.335   54.836   6.4359   61.015   4.1069 -6.179375 7.634628 
1 1 1   28   24   17 o   59.921   4.9216   92.335   9.1578   66.159   18.514  100.814   10.537   51.126   9.1140   68.715   3.7180 -17.58850 9.843222 
1 1 1   28   24   18 o   21.416   6.1025   8.6405   7.3551   6.8313   16.095   9.1180   8.2691   22.369   9.6318   20.464   7.4960 1.904961 12.20500 
1 1 1   28   24   19 o   41.301   4.9429   38.325   7.8227   47.863   13.784   33.793   9.5012   44.053   7.8751   38.549   5.9758 5.504498 9.885736 
1 1 1   28   24   20 o   41.302   5.5613   42.327   9.0986   42.963   13.458   41.791   12.348   41.301   8.1897   41.303   7.5260 -0.1689911E-02 11.12262 
1 1 1   28   24   21 o   47.793   4.8720   53.521   9.5438   62.081   14.039   46.165   13.013   51.572   6.6000   44.015   7.1684 7.557674 9.744087 
1 1 1   28   25    0 o   23.612   6.5538   16.664   8.6499   16.664   8.6499   16.664   8.6499   23.612   9.2685   23.612   9.2685 0.000000 0.000000 
1 1 1   28   25    1 o   56.335   3.1497   68.213   7.1940   53.345   9.9981   84.174   10.359   49.737   4.8738   62.932   3.9911 -13.19479 6.299435 
1 1 1   28   25    2 o   31.536   4.8368   22.971   6.1145   20.102   8.4305   26.155   8.8817   29.319   7.0568   33.752   6.6167 -4.432327 9.673605 
1 1 1   28   25    3 o   23.968   5.4899   13.123   6.1959   11.605   8.4320   14.906   9.1347   22.721   7.6263   25.214   7.8992 -2.492527 10.97988 
1 1 1   28   25    4 o   30.535   6.9059   21.627   9.3231   29.554   16.547   17.940   11.285   33.738   10.641   27.331   8.8054 6.407166 13.81188 
1 1 1   28   25    5 o   28.340   6.8124   16.999   9.0703   28.643   16.270   11.748   10.926   33.250   10.558   23.430   8.6113 9.820007 13.62473 
1 1 1   28   25    6 o   55.711   4.0210   69.356   9.0379   59.059   13.508   77.704   12.161   51.472   6.3627   59.951   4.9184 -8.478920 8.042009 
1 1 1   28   25    7 o   53.715   4.0615   63.752   8.8858   61.767   13.522   65.261   11.788   52.681   6.2234   54.750   5.2203 -2.068268 8.122995 
1 1 1   28   25    8 o   26.356   6.1863   16.185   7.7280   19.773   12.282   13.834   9.9427   28.309   9.1929   24.403   8.2808 3.906050 12.37264 
1 1 1   28   25    9 o   23.962   6.1566   11.840   7.7523   17.971   12.593   8.0994   9.8373   27.144   9.3182   20.779   8.0489 6.364857 12.31313 
1 1 1   28   25   10 o   21.952   6.1797   8.6817   8.3620   10.470   12.490   7.2286   11.257   22.990   9.0232   20.915   8.4462 2.075489 12.35945 
1 1 1   28   25   11 o   45.801   6.2189   52.634   10.856   47.884   18.282   55.221   13.492   42.331   10.518   49.272   6.6391 -6.941097 12.43777 
1 1 1   28   25   12 o   17.029   5.3773  -0.8472   7.3596  -2.2259   12.753  -0.1588   9.0117   17.988   8.1143   16.069   7.0583 1.919090 10.75457 
1 1 1   28   25   13 o   31.817   5.8905   26.507   7.9984   18.530   13.083   31.268   10.107   27.213   9.4888   36.422   6.9824 -9.209158 11.78097 
1 1 1   28   25   14 o   24.544   6.0006   14.117   7.0510   15.056   12.641   13.693   8.4953   25.169   9.2609   23.919   7.6331 1.250166 12.00118 
1 1 1   28   25   15 o   18.688   5.5594   2.6209   6.8146   9.6259   12.306  -0.4775   8.1841   22.205   8.8786   15.172   6.6930 7.032723 11.11870 
1 1 1   28   25   16 o   43.063   5.1451   48.962   7.7701   31.987   13.530   57.316   9.4914   34.811   9.2615   51.315   4.4846 -16.50441 10.29014 
1 1 1   28   25   17 o   52.277   5.1811   70.144   8.6276   55.011   17.328   75.131   9.9484   45.604   9.5203   58.951   4.0916 -13.34765 10.36228 
1 1 1   28   25   18 o   25.465   6.3266   16.607   7.8492   13.266   16.077   17.653   8.9939   24.426   10.008   26.503   7.7426 -2.076271 12.65315 
1 1 1   28   25   19 o   59.967   4.2541   82.889   10.404   72.166   15.007   92.814   14.437   55.668   6.5361   64.265   5.4468 -8.597168 8.508151 
1 1 1   28   26    0 o   17.156   6.3319   9.7080   8.2908   9.7080   8.2908   9.7080   8.2908   17.156   8.9546   17.156   8.9546 0.000000 0.000000 
1 1 1   28   26    1 o   16.882   4.7151   1.2533   5.5539  -7.2039   7.7755   10.063   7.9358   12.422   5.8541   21.342   7.3931 -8.920625 9.430203 
1 1 1   28   26    2 o   23.429   5.2973   12.148   6.0302   7.0416   8.2099   18.130   8.8863   19.377   7.3920   27.481   7.5896 -8.104031 10.59456 
1 1 1   28   26    3 o   63.467   3.3627   85.164   8.6562   98.595   13.856   76.568   11.086   67.322   4.9902   59.612   4.5088 7.709538 6.725386 
1 1 1   28   26    4 o   45.707   4.5503   46.945   8.5069   48.112   12.927   46.053   11.298   45.969   6.8180   45.444   6.0279 0.5247612 9.100597 
1 1 1   28   26    5 o   24.651   6.1460   14.295   7.8672   10.934   12.310   16.616   10.229   23.150   8.9937   26.151   8.3788 -3.001551 12.29195 
1 1 1   28   26    6 o   40.727   5.2455   40.028   8.3572   33.213   12.811   45.078   11.027   36.508   8.6417   44.946   5.9483 -8.437569 10.49105 
1 1 1   28   26    7 o   46.657   4.5177   49.494   8.4960   47.520   13.289   50.859   11.049   45.385   7.0990   47.929   5.5894 -2.543610 9.035386 
1 1 1   28   26    8 o   27.955   6.0179   20.182   7.8908   12.679   13.051   24.505   9.9067   24.128   9.2917   31.781   7.6500 -7.652977 12.03571 
1 1 1   28   26    9 o   18.257   5.4647   2.3107   7.4726  -6.3796   12.197   7.5327   9.4549   16.370   7.5878   20.143   7.8663 -3.772448 10.92944 
1 1 1   28   26   10 o   38.342   6.5969   40.844   10.716   25.907   18.430   48.474   13.171   30.830   11.206   45.855   6.9640 -15.02542 13.19388 
1 1 1   28   26   11 o   24.422   6.7065   9.5953   8.6266   24.078   17.435   4.9006   9.9268   29.906   10.895   18.938   7.8231 10.96794 13.41298 
1 1 1   28   26   12 o   17.437   5.5081  -1.2371   8.2182 -16.8127   15.945   4.3978   9.5902   16.432   7.9176   18.442   7.6595 -2.009907 11.01612 
1 1 1   28   26   13 o   59.809   3.9540   80.541   9.6636   74.804   14.286   85.380   13.121   57.451   6.0291   62.166   5.1173 -4.714779 7.908009 
1 1 1   28   26   14 f   46.881   4.6693   51.141   8.9090   49.104   13.509   52.709   11.851   45.575   7.1869   48.187   5.9631 -2.611324 9.338591 
1 1 1   28   26   15 o   31.672   5.9059   24.267   7.5101   31.768   12.996   20.506   9.2021   34.707   9.0024   28.637   7.6470 6.069565 11.81186 
1 1 1   28   26   16 o   21.154   6.0166   8.7196   7.3122   7.7295   15.039   9.0261   8.3679   22.026   9.3930   20.282   7.5213 1.743917 12.03320 
1 1 1   28   26   17 o   44.630   5.0585   40.074   8.2988   66.393   17.197   32.083   9.4751   51.896   8.0341   37.363   6.1486 14.53332 10.11692 
1 1 1   28   27    0 f   60.205   3.2735   77.935   11.339   77.935   11.339   77.935   11.339   60.205   4.6294   60.205   4.6294 0.000000 0.000000 
1 1 1   28   27    1 o   30.060   5.1182   21.660   6.2656   21.297   8.6822   22.055   9.0512   29.839   7.1486   30.281   7.3267 -0.4413433 10.23630 
1 1 1   28   27    2 o   31.013   5.6730   23.643   7.1467   23.616   11.838   23.659   8.9648   30.498   8.8750   31.528   7.0687 -1.030302 11.34602 
1 1 1   28   27    3 o   75.291   3.0474  119.891   9.1483  130.988   15.258  113.663   11.431   77.600   4.7672   72.982   3.7975 4.617241 6.094847 
1 1 1   28   27    4 o   67.208   3.4956   97.838   9.6485  109.570   14.427   88.344   12.978   70.826   4.9388   63.590   4.9481 7.235870 6.991104 
1 1 1   28   27    5 o   51.845   4.2012   60.291   8.8932   59.635   13.485   60.797   11.831   51.283   6.3752   52.408   5.4734 -1.124546 8.402454 
1 1 1   28   27    6 o   56.273   4.0368   70.834   9.2200   68.977   14.208   72.185   12.118   55.225   6.2379   57.321   5.1256 -2.096638 8.073600 
1 1 1   28   27    7 o   60.279   3.7640   79.820   9.2831   84.215   14.182   76.526   12.279   61.514   5.5900   59.044   5.0422 2.470112 7.528034 
1 1 1   28   27    8 o   52.548   4.1942   61.508   8.9766   66.421   14.020   58.095   11.686   54.032   6.2911   51.065   5.5486 2.966324 8.388353 
1 1 1   28   27    9 o   52.800   5.7359   68.096   11.530   67.064   19.258   68.673   14.396   50.805   9.5408   54.795   6.3699 -3.990585 11.47177 
1 1 1   28   27   10 o   65.776   4.8949  104.644   12.426   86.255   20.143  115.940   15.788   59.335   8.2309   72.218   5.3004 -12.88295 9.789894 
1 1 1   28   27   11 o  104.527   2.8815  233.074   12.306  257.386   19.041  215.635   16.127  108.958   4.2371  100.097   3.9064 8.860733 5.763074 
1 1 1   28   27   12 o   52.225   4.2911   62.912   9.0408   58.500   13.941   66.114   11.877   50.018   6.7577   54.432   5.2903 -4.413952 8.582225 
1 1 1   28   27   13 o   41.419   5.3076   42.058   8.6527   39.571   13.458   43.811   11.297   39.246   8.5555   43.591   6.2837 -4.344700 10.61512 
1 1 1   28   27   14 o   61.147   3.9267   84.671   9.8079   80.697   14.660   87.892   13.196   59.424   5.9813   62.870   5.0891 -3.445518 7.853371 
1 1 1   28   28    0 o   17.232   6.5275   10.055   8.9982   10.055   8.9982   10.055   8.9982   17.232   9.2313   17.232   9.2313 0.000000 0.000000 
1 1 1   28   28    1 f   41.149   5.2108   42.788   7.9076   33.360   13.441   47.778   9.7790   35.777   9.0905   46.522   5.0965 -10.74548 10.42169 
1 1 1   28   28    2 o   43.388   4.3572   41.754   7.4523   46.696   12.777   39.207   9.1743   44.750   6.9228   42.026   5.2928 2.723721 8.714325 
1 1 1   28   28    3 o   88.855   3.6430  185.729   11.553  149.091   21.365  200.868   13.734   80.574   6.4291   97.137   3.4280 -16.56338 7.285944 
1 1 1   28   28    4 o   23.506   6.0940   12.994   7.9272   8.5496   12.067   16.368   10.514   21.476   8.7195   25.537   8.5159 -4.060692 12.18808 
1 1 1   28   28    5 o   48.256   4.5764   52.692   9.0098   60.789   14.064   47.055   11.734   51.191   6.6610   45.321   6.2774 5.870190 9.152831 
1 1 1   28   28    6 o   53.558   4.2234   65.235   9.1737   64.746   14.236   65.582   11.997   52.909   6.5236   54.208   5.3659 -1.299236 8.446859 
1 1 1   28   28    7 o   40.723   5.3223   40.329   8.5836   39.384   13.311   41.003   11.231   39.339   8.4552   42.108   6.4667 -2.768093 10.64468 
1 1 1   28   28    8 o   24.675   6.7381   10.143   8.8082   27.713   17.611   4.2824   10.172   30.822   10.986   18.528   7.8048 12.29309 13.47617 
1 1 1   28   28    9 f   35.040   7.1380   33.373   10.540   38.869   17.727   30.368   13.108   36.389   10.931   33.692   9.1819 2.696751 14.27596 
1 1 1   28   28   10 o   46.805   5.3018   53.330   9.8721   61.734   14.003   45.027   13.920   51.443   6.5998   42.166   8.2994 9.277073 10.60361 
1 1 1   28   28   11 f   87.415   3.1380  168.327   11.171  155.972   16.757  178.208   14.986   84.045   4.8342   90.785   4.0023 -6.739922 6.275977 
1 1 1   28   29    0 o   45.686   5.5653   50.006   13.510   50.006   13.510   50.006   13.510   45.686   7.8705   45.686   7.8705 0.000000 0.000000 
1 1 1   28   29    1 o   28.155   5.9380   20.049   7.1578   22.076   12.299   19.010   8.8019   28.722   9.1863   27.588   7.5265 1.133955 11.87594 
1 1 1   28   29    2 o   23.077   5.8623   8.5216   7.2166   24.274   12.875   1.3050   8.7142   29.928   9.3782   16.225   7.0366 13.70317 11.72450 
1 1 1   28   29    3 o   57.678   3.6488   73.804   8.3013   75.064   13.914   73.109   10.344   57.425   5.8746   57.930   4.3293 -0.5053864 7.297510 
1 1 1   28   29    4 o   23.147   6.0534   12.601   7.9676   6.9035   12.061   17.012   10.613   20.552   8.5672   25.742   8.5545 -5.189697 12.10684 
1 1 1   28   29    5 o   72.770   3.5140  116.683   10.471  122.975   15.934  111.901   13.892   74.243   5.2035   71.297   4.7241 2.945999 7.028093 
1 1 1   28   29    6 o   48.845   4.5295   54.912   9.0415   58.349   13.887   52.384   11.912   49.861   6.7529   47.829   6.0385 2.032463 9.058944 
1 1 1   29    0    1 o  192.052   2.2512  763.220   25.202  763.220   25.202  763.220   25.202  192.052   3.1836  192.052   3.1836 0.000000 0.000000 
1 1 1   29    0    2 o   22.118   6.6351   14.537   8.6798   14.537   8.6798   14.537   8.6798   22.118   9.3835   22.118   9.3835 0.000000 0.000000 
1 1 1   29    0    3 o   17.155   6.4303   8.9625   8.6503   8.9625   8.6503   8.9625   8.6503   17.155   9.0939   17.155   9.0939 0.000000 0.000000 
1 1 1   29    0    4 o   54.066   3.1585   61.819   9.8041   61.819   9.8041   61.819   9.8041   54.066   4.4667   54.066   4.4667 0.000000 0.000000 
1 1 1   29    0    5 o   55.937   3.1814   66.117   10.226   66.117   10.226   66.117   10.226   55.937   4.4992   55.937   4.4992 0.000000 0.000000 
1 1 1   29    0    6 o  117.642   2.2645  286.864   15.513  286.864   15.513  286.864   15.513  117.642   3.2025  117.642   3.2025 0.000000 0.000000 
1 1 1   29    0    7 o   33.156   5.2837   26.114   8.9157   26.114   8.9157   26.114   8.9157   33.156   7.4723   33.156   7.4723 0.000000 0.000000 
1 1 1   29    0    8 o   28.965   6.0233   21.515   8.8428   21.515   8.8428   21.515   8.8428   28.965   8.5183   28.965   8.5183 0.000000 0.000000 
1 1 1   29    0    9 o   36.117   4.7178   29.785   8.9404   29.785   8.9404   29.785   8.9404   36.117   6.6720   36.117   6.6720 0.000000 0.000000 
1 1 1   29    0   10 o  111.648   2.2463  258.452   14.602  258.452   14.602  258.452   14.602  111.648   3.1768  111.648   3.1768 0.000000 0.000000 
1 1 1   29    0   11 o   72.422   2.6443  109.481   11.102  109.481   11.102  109.481   11.102   72.422   3.7397   72.422   3.7397 0.000000 0.000000 
1 1 1   29    0   12 o   34.487   5.0111   27.738   8.9058   27.738   8.9058   27.738   8.9058   34.487   7.0867   34.487   7.0867 0.000000 0.000000 
1 1 1   29    0   13 o  114.601   2.2757  272.536   15.185  272.536   15.185  272.536   15.185  114.601   3.2183  114.601   3.2183 0.000000 0.000000 
1 1 1   29    0   14 o   54.199   3.1711   62.290   9.8671   62.290   9.8671   62.290   9.8671   54.199   4.4846   54.199   4.4846 0.000000 0.000000 
1 1 1   29    0   15 o   17.791   6.6770   9.8105   9.3350   9.8105   9.3350   9.8105   9.3350   17.791   9.4427   17.791   9.4427 0.000000 0.000000 
1 1 1   29    0   16 o   98.577   3.1315  203.247   17.923  203.247   17.923  203.247   17.923   98.577   4.4286   98.577   4.4286 0.000000 0.000000 
1 1 1   29    0   17 o   66.234   2.8324   92.068   10.851   92.068   10.851   92.068   10.851   66.234   4.0056   66.234   4.0056 0.000000 0.000000 
1 1 1   29    0   18 o   29.924   5.7603   22.507   8.6914   22.507   8.6914   22.507   8.6914   29.924   8.1463   29.924   8.1463 0.000000 0.000000 
1 1 1   29    0   19 o   30.891   5.5211   23.488   8.6026   23.488   8.6026   23.488   8.6026   30.891   7.8080   30.891   7.8080 0.000000 0.000000 
1 1 1   29    0   20 f   21.315   7.5329   14.585   11.425   14.585   11.425   14.585   11.425   21.315   10.653   21.315   10.653 0.000000 0.000000 
1 1 1   29    0   21 o   47.333   4.8924   50.084   12.664   50.084   12.664   50.084   12.664   47.333   6.9189   47.333   6.9189 0.000000 0.000000 
1 1 1   29    0   22 o   41.377   7.1010   42.458   14.853   42.458   14.853   42.458   14.853   41.377   10.042   41.377   10.042 0.000000 0.000000 
1 1 1   29    0   23 o   45.880   5.0220   47.545   12.481   47.545   12.481   47.545   12.481   45.880   7.1021   45.880   7.1021 0.000000 0.000000 
1 1 1   29    0   24 o  165.785   2.7560  573.145   26.617  573.145   26.617  573.145   26.617  165.785   3.8975  165.785   3.8975 0.000000 0.000000 
1 1 1   29    0   25 o   12.485   5.8260  -1.4451   10.940  -1.4451   10.940  -1.4451   10.940   12.485   8.2392   12.485   8.2392 0.000000 0.000000 
1 1 1   29    0   26 o  166.100   2.8021  576.711   27.113  576.711   27.113  576.711   27.113  166.100   3.9628  166.100   3.9628 0.000000 0.000000 
1 1 1   29    0   27 o   14.336   6.4606   2.3120   11.932   2.3120   11.932   2.3120   11.932   14.336   9.1366   14.336   9.1366 0.000000 0.000000 
1 1 1   29    0   28 o   32.318   11.987   41.163   29.821   41.163   29.821   41.163   29.821   32.318   16.952   32.318   16.952 0.000000 0.000000 
1 1 1   29    0   29 o   17.632   8.0862   3.2125   19.773   3.2125   19.773   3.2125   19.773   17.632   11.436   17.632   11.436 0.000000 0.000000 
1 1 1   29    0   30 o   15.404   7.2970  -2.9533   18.276  -2.9533   18.276  -2.9533   18.276   15.404   10.319   15.404   10.319 0.000000 0.000000 
1 1 1   29    0   31 o   30.718   10.149   34.126   20.289   34.126   20.289   34.126   20.289   30.718   14.353   30.718   14.353 0.000000 0.000000 
1 1 1   29    1    0 o   39.888   4.2312   35.213   9.1912   35.213   9.1912   35.213   9.1912   39.888   5.9838   39.888   5.9838 0.000000 0.000000 
1 1 1   29    1    1 o   74.396   2.6358  114.857   8.0731  105.535   11.246  124.768   11.596   71.270   3.8260   77.522   3.6267 -6.252045 5.271692 
1 1 1   29    1    2 o   55.478   3.1516   64.060   7.2078   61.688   10.018   66.605   10.378   54.413   4.4639   56.542   4.4503 -2.128616 6.303271 
1 1 1   29    1    3 o  150.971   2.1982  472.310   13.686  482.092   19.515  462.841   19.199  152.511   3.1024  149.432   3.1151 3.079147 4.396474 
1 1 1   29    1    4 o   55.201   3.0820   63.534   7.0101   65.122   9.7817   61.857   10.051   55.926   4.2407   54.476   4.4735 1.449177 6.164092 
1 1 1   29    1    5 o  107.082   2.3036  237.687   10.166  224.371   14.192  251.718   14.568  103.994   3.3087  110.170   3.2061 -6.175674 4.607242 
1 1 1   29    1    6 o   33.130   4.7748   24.013   6.3030   24.943   8.9342   23.092   8.8936   33.806   6.6444   32.453   6.8591 1.353249 9.549613 
1 1 1   29    1    7 o  121.077   2.2321  304.101   11.145  306.593   15.672  301.551   15.852  121.586   3.1253  120.568   3.1877 1.017746 4.464188 
1 1 1   29    1    8 o   94.412   2.3765  185.059   9.2536  186.148   13.057  183.960   13.116   94.695   3.3431   94.130   3.3784 0.5648346 4.752932 
1 1 1   29    1    9 o   81.877   2.5115  139.198   8.4758  146.502   12.141  132.254   11.838   83.979   3.5052   79.776   3.5979 4.203789 5.023067 
1 1 1   29    1   10 o   85.170   2.4478  150.654   8.5959  155.524   12.202  145.857   12.111   86.544   3.4186   83.796   3.5042 2.747360 4.895518 
1 1 1   29    1   11 o   66.769   2.8255   92.940   7.7382   80.769   10.810  105.733   11.082   62.245   4.2106   71.294   3.7688 -9.048977 5.650985 
1 1 1   29    1   12 o   65.253   2.7912   88.848   7.5023   92.005   10.478   85.527   10.747   66.465   3.8222   64.041   4.0687 2.424126 5.582447 
1 1 1   29    1   13 o   57.390   2.9806   68.894   7.0471   72.507   9.9547   65.266   9.9775   58.920   4.0963   55.859   4.3307 3.060997 5.961154 
1 1 1   29    1   14 o  153.365   2.2228  488.898   14.060  485.072   19.822  492.773   19.946  152.760   3.1460  153.970   3.1409 -1.209824 4.445513 
1 1 1   29    1   15 o   59.771   3.6108   74.763   8.8642   66.106   12.048   84.978   13.088   55.996   5.2169   63.546   4.9936 -7.549805 7.221645 
1 1 1   29    1   16 o  124.212   2.7482  319.702   13.829  335.481   21.925  309.277   17.821  126.607   4.1987  121.818   3.5470 4.789040 5.496395 
1 1 1   29    1   17 o   35.492   4.5580   27.383   6.4977   26.565   9.5894   28.078   8.8353   34.622   6.9568   36.363   5.8911 -1.740623 9.116082 
1 1 1   29    1   18 o   39.618   3.9897   33.226   6.5137   35.168   9.3323   31.381   9.0958   40.763   5.5508   38.473   5.7322 2.290192 7.979343 
1 1 1   29    1   19 o   30.219   5.6779   20.454   6.9985   21.157   11.694   20.062   8.7355   30.524   8.8035   29.914   7.1729 0.6091442 11.35570 
1 1 1   29    1   20 o   17.551   5.4612  -1.7207   7.6431  -1.9321   10.446  -1.4770   11.213   17.150   7.5638   17.953   7.8797 -0.8025398 10.92249 
1 1 1   29    1   21 o   74.915   3.7981  120.206   11.503  113.639   17.843  124.877   15.047   72.909   5.9336   76.922   4.7428 -4.012589 7.596210 
1 1 1   29    1   22 o   33.389   6.6621   25.746   10.113   14.972   14.268   36.621   14.335   27.069   9.8571   39.709   8.9650 -12.64030 13.32416 
1 1 1   29    1   23 o   63.448   3.6821   85.895   9.6122   90.498   13.411   81.033   13.784   65.284   4.9808   61.611   5.4242 3.672810 7.364134 
1 1 1   29    1   24 o   23.719   6.3415   10.453   8.4879   11.494   11.321   9.1158   12.827   24.025   8.7753   23.412   9.1570 0.6132011 12.68293 
1 1 1   29    1   25 o   48.265   4.7386   50.938   9.3243   61.745   13.631   41.433   12.783   53.269   6.2041   43.261   7.1643 10.00829 9.477287 
1 1 1   29    1   26 o   53.070   4.2449   61.338   9.2515   54.610   12.980   68.286   13.190   49.970   6.2981   56.171   5.6932 -6.201527 8.489887 
1 1 1   29    1   27 o   20.314   5.9280   4.4988   8.1061   1.7176   11.249   7.5033   11.692   18.878   8.0887   21.750   8.6683 -2.872293 11.85610 
1 1 1   29    1   28 o   69.988   5.2277  113.162   14.730  125.672   19.715   97.353   22.162   75.293   6.3485   64.682   8.3074 10.61118 10.45542 
1 1 1   29    1   29 o   27.782   7.8574   15.677   13.772   10.408   19.314   21.126   19.643   25.749   10.796   29.815   11.420 -4.066265 15.71473 
1 1 1   29    1   30 f   52.184   7.4272   69.838   15.648   62.699   22.696   76.308   21.603   48.295   11.550   56.074   9.3411 -7.778614 14.85436 
1 1 1   29    1   31 o   33.179   9.8084   30.227   20.251   27.881   47.622   30.744   22.375   33.362   15.292   32.996   12.286 0.3658295 19.61678 
1 1 1   29    1   32 o   30.500   12.090   24.930   22.632   0.0000   0.0000   24.930   22.632  ?   ?    30.500   12.090      ?      ? 
1 1 1   29    2    0 o   60.009   3.0117   75.719   10.420   75.719   10.420   75.719   10.420   60.009   4.2592   60.009   4.2592 0.000000 0.000000 
1 1 1   29    2    1 o  107.744   2.2882  240.634   10.165  232.161   14.257  249.396   14.498  105.809   3.2668  109.678   3.2050 -3.868515 4.576488 
1 1 1   29    2    2 o   40.115   4.2655   34.846   6.6224   46.650   9.5261   23.806   9.2127   47.266   4.8865   32.964   6.9928 14.30232 8.530919 
1 1 1   29    2    3 o   89.708   2.4368  166.899   9.0129  172.598   12.930  161.512   12.570   91.199   3.4375   88.218   3.4547 2.980309 4.873521 
1 1 1   29    2    4 o   69.091   2.7270   99.048   7.7634   94.036   10.720  104.576   11.258   67.255   3.8645   70.926   3.8485 -3.671211 5.453936 
1 1 1   29    2    5 o   64.857   2.8263   87.541   7.5578   90.091   10.682   84.985   10.695   65.812   3.9352   63.902   4.0579 1.909389 5.652636 
1 1 1   29    2    6 o   42.235   3.7538   37.623   6.4516   30.430   9.0603   45.021   9.1888   38.052   5.7731   46.418   4.7996 -8.366798 7.507612 
1 1 1   29    2    7 o   53.190   3.2167   59.178   7.0392   63.296   9.8901   54.950   10.021   55.096   4.3522   51.284   4.7377 3.812637 6.433355 
1 1 1   29    2    8 o  113.644   2.2664  267.934   10.622  263.329   14.942  272.637   15.103  112.655   3.2159  114.633   3.1943 -1.978470 4.532728 
1 1 1   29    2    9 o  120.879   2.2421  303.096   11.178  300.630   15.711  305.624   15.906  120.382   3.1644  121.375   3.1773 -0.9928284 4.484251 
1 1 1   29    2   10 o  190.370   2.2609  751.469   17.747  732.417   24.750  771.630   25.461  187.889   3.1939  192.850   3.2010 -4.961456 4.521878 
1 1 1   29    2   11 o   77.372   2.5929  124.525   8.2670  131.176   11.737  117.977   11.646   79.438   3.5823   75.307   3.7495 4.131134 5.185765 
1 1 1   29    2   12 o  103.443   2.3240  222.284   9.9144  218.297   13.911  226.400   14.134  102.500   3.2905  104.387   3.2829 -1.886955 4.648081 
1 1 1   29    2   13 o  173.139   2.2328  622.942   15.944  624.720   22.621  621.187   22.477  173.382   3.1633  172.895   3.1521 0.4862366 4.465639 
1 1 1   29    2   14 o   57.131   3.0168   68.316   7.1067   69.563   10.006   67.047   10.095   57.668   4.2068   56.593   4.3251 1.075512 6.033532 
1 1 1   29    2   15 o   36.586   5.1678   29.792   7.4914   30.500   10.114   28.931   11.150   37.221   6.8405   35.952   7.7479 1.268959 10.33554 
1 1 1   29    2   16 o  189.093   2.8576  746.540   21.814  752.701   34.639  742.491   28.082  189.477   4.4324  188.710   3.6080 0.7670898 5.715234 
1 1 1   29    2   17 o   83.188   2.5979  144.411   8.8873  143.668   13.057  145.052   12.131   82.951   3.8164   83.425   3.5256 -0.4740677 5.195708 
1 1 1   29    2   18 o  141.035   2.3611  414.936   13.677  404.323   20.137  424.024   18.635  139.290   3.5052  142.781   3.1644 -3.490921 4.722250 
1 1 1   29    2   19 o   62.202   3.2877   82.487   8.1720   76.769   13.034   86.190   10.490   60.232   5.2466   64.172   3.9633 -3.940315 6.575323 
1 1 1   29    2   20 o   51.371   4.6500   55.055   9.6375   48.684   12.184   65.701   15.751   47.650   6.1997   55.092   6.9321 -7.441772 9.300056 
1 1 1   29    2   21 o   59.709   4.9409   74.715   11.078   83.659   20.883   71.212   13.069   61.554   8.2259   57.864   5.4759 3.689541 9.881835 
1 1 1   29    2   22 o   91.550   3.5556  178.243   13.389  189.967   18.743  166.027   19.132   94.747   4.7964   88.353   5.2501 6.393890 7.111210 
1 1 1   29    2   23 o   31.732   6.3273   23.746   8.9089   29.765   12.092   16.600   13.176   35.895   8.3286   27.569   9.5276 8.325537 12.65463 
1 1 1   29    2   24 o   30.746   5.9810   21.890   8.2165   13.253   11.670   30.380   11.570   25.152   8.9453   36.339   7.9416 -11.18664 11.96192 
1 1 1   29    2   25 o   22.310   5.6553   6.0731   7.8796  -7.3955   11.140   19.560   11.147   15.707   7.2701   28.913   8.6645 -13.20610 11.31054 
1 1 1   29    2   26 f   22.559   6.0850   9.3422   7.9010   7.4427   11.181   11.236   11.166   21.537   8.5105   23.582   8.6995 -2.045067 12.17002 
1 1 1   29    2   27 o   21.457   6.1487   4.8752   9.3835   13.275   11.305 -13.7274   16.824   24.716   8.8028   18.198   8.5869 6.518473 12.29736 
1 1 1   29    2   28 o   23.859   7.0878   4.4583   12.407  -7.0311   17.081   17.292   18.052   19.690   9.0745   28.028   10.890 -8.338190 14.17564 
1 1 1   29    2   29 o   50.417   7.4013   64.362   15.179   50.640   21.157   78.917   21.789   43.443   11.592   57.390   9.2052 -13.94664 14.80258 
1 1 1   29    2   30 o   27.916   7.9144   16.796   13.865   19.093   20.105   14.712   19.145   28.835   11.406   26.998   10.975 1.836924 15.82882 
1 1 1   29    2   31 o   20.888   6.9063 -10.0435   14.916 -18.1618   20.911  -1.6341   21.282   19.178   9.1953   22.598   10.307 -3.420166 13.81268 
1 1 1   29    2   32 o   47.446   13.071   68.257   26.395   0.0000   0.0000   68.257   26.395  ?   ?    47.446   13.071      ?      ? 
1 1 1   29    3    0 o   69.595   2.7576  101.217   11.114  101.217   11.114  101.217   11.114   69.595   3.8999   69.595   3.8999 0.000000 0.000000 
1 1 1   29    3    1 o  128.772   2.2196  343.755   11.789  343.422   16.700  344.087   16.644  128.708   3.1458  128.835   3.1322 -0.1273956 4.439238 
1 1 1   29    3    2 o   55.206   3.1346   63.445   7.1268   68.410   10.250   58.797   9.9161   57.307   4.3365   53.105   4.5273 4.202324 6.269099 
1 1 1   29    3    3 o   30.033   5.0725   19.786   6.2665   24.852   9.0350   15.089   8.6989   33.740   6.7285   26.326   7.5926 7.413853 10.14500 
1 1 1   29    3    4 o   77.008   2.5915  123.246   8.2283  121.144   11.719  125.290   11.556   76.351   3.7213   77.665   3.6076 -1.313492 5.183001 
1 1 1   29    3    5 o   55.693   3.1233   65.077   7.0957   76.377   10.067   53.923   10.002   60.578   4.0294   50.807   4.7733 9.771282 6.246631 
1 1 1   29    3    6 o   69.025   2.7158   99.099   7.7315   99.406   10.910   98.788   10.958   69.135   3.8261   68.915   3.8553 0.2196350 5.431617 
1 1 1   29    3    7 o   31.000   5.0351   21.325   6.3425   25.355   8.8905   17.149   9.0508   34.095   6.5603   27.905   7.6403 6.190853 10.07029 
1 1 1   29    3    8 o   90.516   2.4169  170.027   9.0107  158.113   12.575  182.600   12.918   87.245   3.4946   93.787   3.3396 -6.542160 4.833716 
1 1 1   29    3    9 o   33.421   4.6473   24.006   6.2772   27.973   9.0791   20.372   8.6885   36.439   6.0409   30.402   7.0637 6.037077 9.294595 
1 1 1   29    3   10 o   46.301   3.5131   44.868   6.7081   44.470   9.5286   45.258   9.4455   46.091   5.0124   46.510   4.9239 -0.4186211 7.026284 
1 1 1   29    3   11 o   47.375   3.4767   47.107   6.7762   50.256   9.5053   43.853   9.6626   49.020   4.7014   45.730   5.1230 3.289314 6.953315 
1 1 1   29    3   12 o   67.321   2.7560   94.380   7.6311   85.048   10.601  104.417   10.994   63.846   4.0256   70.795   3.7653 -6.949165 5.512048 
1 1 1   29    3   13 o  113.067   2.2694  265.795   10.582  260.699   14.950  270.912   14.980  111.973   3.2372  114.161   3.1814 -2.188164 4.538814 
1 1 1   29    3   14 o   85.680   2.8614  153.426   9.8109  153.511   12.459  153.287   15.918   85.848   3.5186   85.511   4.5134 0.3365936 5.722874 
1 1 1   29    3   15 o   65.760   3.4838   90.698   9.3518   89.088   12.326   92.882   14.356   65.161   4.5863   66.359   5.2453 -1.198135 6.967560 
1 1 1   29    3   16 o  118.645   2.6816  293.781   13.120  289.819   18.367  297.909   18.748  117.833   3.7793  119.457   3.8053 -1.623413 5.363140 
1 1 1   29    3   17 o   16.010   4.8808  -0.7680   5.9295   2.2000   8.5544  -3.5125   8.2262   17.473   7.2435   14.547   6.5438 2.925533 9.761636 
1 1 1   29    3   18 o  145.032   2.3737  436.574   14.115  450.881   21.287  425.348   18.857  147.081   3.5090  142.984   3.1976 4.097061 4.747435 
1 1 1   29    3   19 o   52.443   3.8453   59.692   7.8000   54.168   13.240   62.628   9.6531   50.264   6.3864   54.622   4.2848 -4.358608 7.690603 
1 1 1   29    3   20 o   48.539   4.5448   50.499   9.0803   53.333   13.368   48.072   12.372   49.772   6.5122   47.305   6.3414 2.467072 9.089632 
1 1 1   29    3   21 o   49.779   4.8887   54.070   9.7786   51.708   15.460   55.644   12.625   48.573   7.7172   50.986   6.0036 -2.412815 9.777400 
1 1 1   29    3   22 o   42.656   5.2323   40.252   8.7262   58.190   13.026   25.650   11.753   52.027   6.0706   33.285   8.5240 18.74166 10.46469 
1 1 1   29    3   23 o   15.132   5.0406 -10.7973   8.0882  -7.9720   10.506 -14.9090   12.674   15.086   7.0095   15.179   7.2457 -0.9378242E-01 10.08130 
1 1 1   29    3   24 o   59.373   3.7048   75.311   9.0302   84.915   12.961   66.250   12.589   63.153   4.9759   55.593   5.4903 7.560287 7.409638 
1 1 1   29    3   25 o   26.412   6.2364   15.763   7.9880   16.753   11.051   14.679   11.560   27.024   8.7144   25.799   8.9236 1.225170 12.47288 
1 1 1   29    3   26 o   43.870   5.0658   43.826   8.7506   33.747   12.361   53.952   12.389   37.973   8.1372   49.766   6.0361 -11.79322 10.13157 
1 1 1   29    3   27 o   75.347   3.9712  120.658   12.037  112.059   15.207  135.086   19.697   72.154   5.1098   78.540   6.0804 -6.386047 7.942416 
1 1 1   29    3   28 o   70.975   5.1759  110.768   14.901   89.846   19.274  141.850   23.492   62.799   7.4413   79.151   7.1962 -16.35205 10.35171 
1 1 1   29    3   29 o   21.129   6.6736  -6.7344   12.358 -20.3599   16.428   11.028   18.757   16.493   7.9690   25.764   10.707 -9.271446 13.34712 
1 1 1   29    3   30 o   36.974   8.4889   37.967   14.781   41.395   21.862   35.080   20.061   38.262   12.249   35.685   11.757 2.576591 16.97783 
1 1 1   29    3   31 o   45.124   10.202   70.369   21.661   61.680   46.368   72.794   24.498   39.216   16.599   51.032   11.864 -11.81660 20.40322 
1 1 1   29    3   32 o   31.064   12.111   26.648   22.383   0.0000   0.0000   26.648   22.383  ?   ?    31.064   12.111      ?      ? 
1 1 1   29    4    0 f   17.431   6.4168   9.3438   8.4979   9.3438   8.4979   9.3438   8.4979   17.431   9.0747   17.431   9.0747 0.000000 0.000000 
1 1 1   29    4    1 o   15.623   4.8031  -1.4668   5.8427   1.1122   8.2102  -4.1129   8.3166   16.741   7.0298   14.505   6.5470 2.235714 9.606291 
1 1 1   29    4    2 o  111.963   2.2776  259.985   10.517  254.996   14.815  265.053   14.931  110.877   3.2397  113.049   3.2022 -2.172729 4.555173 
1 1 1   29    4    3 o  107.462   2.3048  239.580   10.213  232.838   14.406  246.393   14.481  105.934   3.2971  108.989   3.2215 -3.054832 4.609684 
1 1 1   29    4    4 o  145.478   2.1962  438.538   13.172  423.644   18.363  454.325   18.906  142.933   3.1149  148.023   3.0967 -5.090027 4.392323 
1 1 1   29    4    5 o   84.524   2.5027  148.462   8.7194  142.432   12.328  154.499   12.335   82.794   3.6100   86.255   3.4672 -3.460854 5.005407 
1 1 1   29    4    6 o  103.883   2.3084  223.708   9.8844  213.702   13.742  234.434   14.228  101.475   3.2834  106.291   3.2455 -4.815872 4.616719 
1 1 1   29    4    7 o  193.889   2.2573  779.936   18.051  774.697   25.465  785.227   25.591  193.233   3.1952  194.544   3.1894 -1.310944 4.514605 
1 1 1   29    4    8 o   77.597   2.5722  125.082   8.2282  119.725   11.508  130.686   11.770   75.891   3.6765   79.302   3.5984 -3.411179 5.144381 
1 1 1   29    4    9 o   82.174   2.4998  140.281   8.4717  137.543   11.939  143.057   12.023   81.363   3.5577   82.986   3.5128 -1.622704 4.999693 
1 1 1   29    4   10 o   62.122   2.8341   80.406   7.2586   78.866   10.346   81.900   10.186   61.525   4.0771   62.719   3.9378 -1.194046 5.668248 
1 1 1   29    4   11 o  126.020   2.4016  329.801   12.340  328.312   16.253  331.826   18.960  125.757   3.1335  126.282   3.6403 -0.5249863 4.803237 
1 1 1   29    4   12 o   67.598   2.9748   94.625   8.2085   89.798   10.751  101.374   12.711   65.598   3.9736   69.599   4.4281 -4.000870 5.949611 
1 1 1   29    4   13 o   83.657   2.5961  145.261   8.9361  155.214   13.206  136.854   12.137   86.279   3.7110   81.034   3.6314 5.244705 5.192160 
1 1 1   29    4   14 o  119.668   2.7673  298.263   13.433  294.896   17.442  303.171   21.061  118.969   3.5546  120.367   4.2423 -1.396973 5.534609 
1 1 1   29    4   15 o   75.181   3.1921  119.157   9.8237  124.544   13.302  112.694   14.570   77.150   4.1804   73.212   4.8251 3.937439 6.384154 
1 1 1   29    4   16 o   91.648   2.6683  176.314   9.9670  168.244   15.106  182.535   13.264   89.686   4.0837   93.610   3.4355 -3.923912 5.336593 
1 1 1   29    4   17 o   77.483   2.6910  124.836   8.5744  131.611   12.731  119.212   11.600   79.379   3.8887   75.587   3.7208 3.791199 5.382005 
1 1 1   29    4   18 o   24.231   5.8813   10.301   6.8111   18.091   12.102   6.6884   8.2402   28.614   9.1080   19.847   7.4431 8.766935 11.76251 
1 1 1   29    4   19 o   37.718   4.7909   30.611   7.0026   33.200   11.771   29.193   8.7117   38.410   7.6986   37.026   5.7047 1.383678 9.581875 
1 1 1   29    4   20 o   65.301   3.6697   79.936   8.7674  114.415   18.095   69.359   10.022   73.137   5.9988   57.465   4.2286 15.67167 7.339421 
1 1 1   29    4   21 o  105.770   2.8622  234.561   12.478  247.094   17.914  222.752   17.390  108.532   4.0020  103.007   4.0931 5.524506 5.724483 
1 1 1   29    4   22 o   86.462   3.0475  157.685   10.853  153.343   15.616  161.741   15.093   85.252   4.4413   87.671   4.1741 -2.418945 6.094918 
1 1 1   29    4   23 o   85.424   3.4189  155.440   11.958  161.515   16.179  148.126   17.752   87.436   4.4865   83.413   5.1601 4.023376 6.837765 
1 1 1   29    4   24 o   27.424   5.6769   16.584   9.1086 -12.3343   15.766   31.073   11.160   18.005   8.4382   36.843   7.5963 -18.83769 11.35373 
1 1 1   29    4   25 o  100.253   2.8996  212.140   11.980  223.352   17.282  201.767   16.623  102.814   4.0755   97.691   4.1255 5.123169 5.799134 
1 1 1   29    4   26 o   22.292   6.0886   8.6227   8.0009   11.606   11.548   5.8686   11.096   23.900   8.8410   20.683   8.3738 3.217583 12.17719 
1 1 1   29    4   27 o  115.011   3.7038  290.190   16.003  297.597   19.232  273.515   28.857  118.565   3.9327  111.458   6.2774 7.107201 7.407551 
1 1 1   29    4   28 o   67.907   5.4270  105.860   14.913  106.334   19.417  105.179   23.288   68.797   6.8429   67.018   8.4253 1.779091 10.85407 
1 1 1   29    4   29 o   59.890   5.8242   83.654   14.357   83.674   19.729   83.632   20.933   60.130   7.9552   59.649   8.5088 0.4808464 11.64838 
1 1 1   29    4   30 o   36.169   7.4180   31.821   14.548   62.313   20.673   1.9078   20.475   48.964   10.548   23.375   10.433 25.58922 14.83606 
1 1 1   29    4   31 o   25.468   8.5587  -4.6517   20.328  -4.1125   44.699  -4.7922   22.825   28.468   13.594   22.469   10.402 5.998466 17.11732 
1 1 1   29    4   32 o   72.135   9.3095  130.260   27.697   0.0000   0.0000  130.260   27.697  ?   ?    72.135   9.3095      ?      ? 
1 1 1   29    5    0 f   76.850   2.6183  123.108   11.674  123.108   11.674  123.108   11.674   76.850   3.7028   76.850   3.7028 0.000000 0.000000 
1 1 1   29    5    1 f   55.568   3.0890   64.369   7.0790   65.530   10.043   63.222   9.9799   56.070   4.3427   55.067   4.3941 1.003109 6.177977 
1 1 1   29    5    2 o   65.205   2.8543   88.750   7.6206  102.135   10.873   75.826   10.684   70.091   3.7611   60.319   4.2944 9.771992 5.708583 
1 1 1   29    5    3 o   47.571   3.5150   47.597   6.8487   41.651   9.7572   53.371   9.6154   44.579   5.3068   50.563   4.6108 -5.983398 7.029998 
1 1 1   29    5    4 o   49.406   3.4384   51.053   7.0039   52.339   9.8673   49.747   9.9431   50.045   4.7805   48.768   4.9434 1.277214 6.876771 
1 1 1   29    5    5 o   44.321   3.8514   41.976   6.8057   29.647   9.5639   54.623   9.6867   37.494   6.1846   51.148   4.5918 -13.65416 7.702827 
1 1 1   29    5    6 o   87.322   2.4393  158.188   8.7600  175.287   12.621  142.290   12.169   91.892   3.3299   82.753   3.5654 9.139420 4.878551 
1 1 1   29    5    7 o   98.411   2.5484  198.798   10.226  186.021   13.325  217.107   15.950   94.649   3.4133  102.172   3.7850 -7.522720 5.096752 
1 1 1   29    5    8 o  131.228   2.3679  355.748   12.732  372.068   19.312  343.204   16.932  133.837   3.4986  128.619   3.1918 5.218719 4.735805 
1 1 1   29    5    9 o  122.995   2.3731  313.457   11.960  319.644   18.049  308.613   15.968  124.031   3.5282  121.959   3.1746 2.071831 4.746134 
1 1 1   29    5   10 o  160.886   2.2135  537.193   14.688  533.881   20.737  540.528   20.806  160.387   3.1349  161.385   3.1258 -0.9984436 4.426966 
1 1 1   29    5   11 o   42.128   3.7732   37.406   6.5473   38.760   9.1456   35.983   9.3774   42.939   5.1641   41.318   5.5027 1.620113 7.546373 
1 1 1   29    5   12 o   90.592   2.4324  170.789   9.0819  179.676   12.952  162.192   12.738   92.924   3.3794   88.259   3.4993 4.665176 4.864760 
1 1 1   29    5   13 o   49.582   3.4523   51.451   7.0397   48.813   9.5255   54.626   10.450   48.205   4.7910   50.959   4.9719 -2.753769 6.904624 
1 1 1   29    5   14 o   96.879   3.0504  194.288   12.119  172.010   16.190  222.673   18.275   90.629   4.3313  103.128   4.2965 -12.49911 6.100790 
1 1 1   29    5   15 o   64.912   3.3122   88.563   8.8223   77.362   12.312  100.384   12.648   60.628   4.9237   69.195   4.4318 -8.566860 6.624448 
1 1 1   29    5   16 o   45.521   3.8557   44.397   7.1164   39.863   10.745   47.940   9.4985   43.301   6.0163   47.742   4.8238 -4.441223 7.711343 
1 1 1   29    5   17 o   79.151   2.5638  130.633   8.3681  131.370   11.966  129.929   11.706   79.362   3.6559   78.940   3.5955 0.4218750 5.127662 
1 1 1   29    5   18 o   24.729   5.6868   9.3947   6.6081   23.088   12.119   3.6013   7.8831   31.798   8.8931   17.660   7.0903 14.13801 11.37364 
1 1 1   29    5   19 o  127.470   2.5596  341.732   13.141  329.167   20.753  350.142   16.978  125.307   4.0154  129.634   3.1754 -4.326965 5.119266 
1 1 1   29    5   20 o  113.597   4.6745  292.867   14.911  256.937   38.808  299.089   16.150  107.427   8.7587  119.767   3.2695 -12.34012 9.349022 
1 1 1   29    5   21 o   93.965   2.9681  185.814   11.485  174.122   16.243  197.503   16.241   90.949   4.3302   96.982   4.0604 -6.033142 5.936111 
1 1 1   29    5   22 o   37.831   5.4021   31.971   8.2756   39.699   12.081   25.138   11.359   42.698   6.8601   32.964   8.3467 9.733799 10.80411 
1 1 1   29    5   23 o   27.414   6.6353   16.315   8.9819   14.211   11.949   19.047   13.619   25.834   9.0649   28.993   9.6921 -3.158674 13.27067 
1 1 1   29    5   24 o   33.421   6.2903   25.520   8.9647   18.038   11.845   35.550   13.716   27.994   9.0217   38.848   8.7681 -10.85420 12.58059 
1 1 1   29    5   25 o   17.702   5.4116  -1.9445   7.6893 -10.1684   10.945   6.0704   10.805   14.745   6.9478   20.660   8.2988 -5.915654 10.82326 
1 1 1   29    5   26 o   21.036   5.5563   3.3183   7.7302 -10.0417   10.743   17.662   11.132   14.571   6.8712   27.501   8.7335 -12.93025 11.11252 
1 1 1   29    5   27 o   47.001   6.4588   58.276   10.931   65.954   13.074   40.436   19.928   54.948   5.7686   39.054   11.558 15.89439 12.91758 
1 1 1   29    5   28 o   34.918   7.1766   26.738   10.577   17.792   12.682   47.177   19.170   27.343   9.3519   42.492   10.888 -15.14894 14.35327 
1 1 1   29    5   29 o   85.721   4.7093  159.829   16.401  132.607   21.219  200.229   25.850   76.890   6.6910   94.552   6.6287 -17.66286 9.418563 
1 1 1   29    5   30 o   54.162   7.4337   75.957   16.204   80.894   22.282   70.415   23.607   57.346   9.4210   50.978   11.502 6.368004 14.86744 
1 1 1   29    5   31 o   41.725   9.4946   63.718   22.448   14.888   48.746   76.861   25.290   31.277   14.715   52.173   12.002 -20.89648 18.98913 
1 1 1   29    5   32 o   27.995   11.876   17.486   23.823   0.0000   0.0000   17.486   23.823  ?   ?    27.995   11.876      ?      ? 
1 1 1   29    5   33 o   35.233   13.078   41.345   25.314   0.0000   0.0000   41.345   25.314  ?   ?    35.233   13.078      ?      ? 
1 1 1   29    6    0 o   26.047   6.5387   18.718   9.0463   18.718   9.0463   18.718   9.0463   26.047   9.2471   26.047   9.2471 0.000000 0.000000 
1 1 1   29    6    1 o   19.355   5.2409   5.2903   5.9576   2.3719   8.4343   8.1962   8.4164   17.584   7.2316   21.125   7.5877 -3.540922 10.48186 
1 1 1   29    6    2 o  109.354   2.5030  250.307   11.145  261.977   14.843  235.222   16.875  112.371   3.2025  106.337   3.8476 6.034172 5.006014 
1 1 1   29    6    3 o   66.557   3.0585   91.185   8.3329   83.046   10.991  102.187   12.779   63.126   4.2216   69.988   4.4269 -6.861217 6.117075 
1 1 1   29    6    4 o  132.501   2.5790  365.310   14.072  388.454   19.889  342.109   19.913  136.742   3.5265  128.260   3.7642 8.481628 5.158062 
1 1 1   29    6    5 o   43.135   3.7686   39.383   6.6236   32.832   9.4464   45.718   9.2900   39.508   5.7972   46.763   4.8167 -7.255051 7.537148 
1 1 1   29    6    6 o  129.353   2.2232  347.064   11.860  350.726   16.819  343.441   16.727  130.034   3.1361  128.673   3.1519 1.361298 4.446322 
1 1 1   29    6    7 o   93.098   2.3861  179.902   9.1610  176.230   12.852  183.696   13.062   92.131   3.3821   94.065   3.3669 -1.934105 4.772243 
1 1 1   29    6    8 o   47.553   3.4675   47.313   6.8007   47.866   9.6520   46.767   9.5835   47.831   4.8926   47.276   4.9150 0.5554581 6.935042 
1 1 1   29    6    9 o   55.427   3.1089   64.156   7.1016   61.026   10.000   67.340   10.087   54.048   4.4861   56.805   4.3052 -2.756252 6.217712 
1 1 1   29    6   10 o  104.457   2.5685  228.920   10.900  238.783   14.419  215.766   16.652  107.198   3.2612  101.716   3.9692 5.482224 5.137087 
1 1 1   29    6   11 o   84.061   2.4613  147.091   8.5334  146.877   12.038  147.307   12.098   84.001   3.4745   84.121   3.4870 -0.1202087 4.922576 
1 1 1   29    6   12 o   34.347   4.5578   25.919   6.2303   17.996   8.6999   34.260   8.9264   28.401   7.3651   40.293   5.3713 -11.89213 9.115687 
1 1 1   29    6   13 o   98.997   2.5142  205.269   10.210  220.127   14.091  188.850   14.813  102.852   3.3218   95.141   3.7749 7.710892 5.028340 
1 1 1   29    6   14 o   41.219   4.3069   36.307   7.1778   37.104   9.3447   35.158   11.210   41.906   5.4066   40.532   6.7057 1.374420 8.613780 
1 1 1   29    6   15 o   95.595   2.5912  189.182   10.126  201.097   15.564  180.436   13.335   98.131   3.8454   93.060   3.4742 5.070831 5.182386 
1 1 1   29    6   16 o   85.957   2.6908  153.184   9.4765  163.178   14.413  145.574   12.577   88.368   3.9546   83.546   3.6500 4.821503 5.381565 
1 1 1   29    6   17 o   84.266   2.7950  144.533   9.5402  128.944   12.173  169.352   15.360   78.588   3.7556   89.945   4.1403 -11.35747 5.589930 
1 1 1   29    6   18 o   93.922   2.9266  182.724   10.660  191.679   18.744  178.443   12.960   95.348   4.7665   92.497   3.3970 2.851013 5.853124 
1 1 1   29    6   19 o   76.199   4.0964  121.615   10.168  127.690   23.217  120.173   11.310   76.573   7.3514   75.825   3.6166 0.7480850 8.192872 
1 1 1   29    6   20 o   94.687   3.1494  185.990   11.208  195.577   20.863  182.100   13.289   95.989   5.2697   93.385   3.4503 2.604286 6.298719 
1 1 1   29    6   21 o   90.644   2.9433  172.450   10.988  185.529   15.916  160.537   15.190   93.944   4.1076   87.343   4.2165 6.600723 5.886533 
1 1 1   29    6   22 o   58.020   3.7903   71.818   9.0333   71.767   13.379   71.861   12.246   57.912   5.6015   58.128   5.1078 -0.2158661 7.580657 
1 1 1   29    6   23 o   70.948   3.4284  107.258   9.9912   96.930   14.185  117.427   14.075   67.437   5.0998   74.459   4.5832 -7.021301 6.856708 
1 1 1   29    6   24 o   31.679   6.3314   24.215   8.7704   28.083   11.625   19.105   13.362   34.621   8.2568   28.736   9.6006 5.885118 12.66279 
1 1 1   29    6   25 o   27.081   6.1365   16.821   8.0318   11.075   11.686   21.967   11.058   23.688   8.8675   30.474   8.4848 -6.786591 12.27291 
1 1 1   29    6   26 f   63.348   3.7249   86.220   9.6981   76.775   13.346   96.787   14.117   59.599   5.4293   67.097   5.1011 -7.498699 7.449761 
1 1 1   29    6   27 o   60.486   5.1847   82.297   11.478   81.566   13.479   84.224   21.890   61.295   5.3319   59.677   8.8937 1.617424 10.36950 
1 1 1   29    6   28 o   58.538   5.5772   82.013   11.823   86.806   14.374   71.986   20.790   63.069   5.5259   54.008   9.6894 9.061447 11.15440 
1 1 1   29    6   29 o   21.662   6.8753  -0.7732   12.691   0.6187   16.760  -2.6441   19.431   21.444   9.5129   21.881   9.9290 -0.4364738 13.75064 
1 1 1   29    6   30 o   54.188   8.2551  111.601   24.033  -2.4299   48.420  148.877   27.684   29.608   14.141   78.768   8.5214 -49.16040 16.51023 
1 1 1   29    6   31 o   52.846   9.9180   99.005   23.437   73.352   47.740  107.150   26.901   41.071   17.076   64.621   10.093 -23.54974 19.83600 
1 1 1   29    6   32 o   38.474   12.580   45.867   22.986   0.0000   0.0000   45.867   22.986  ?   ?    38.474   12.580      ?      ? 
1 1 1   29    6   33 o   46.430   12.597   67.259   24.737   0.0000   0.0000   67.259   24.737  ?   ?    46.430   12.597      ?      ? 
1 1 1   29    7    0 o  154.288   2.5115  493.530   22.575  493.530   22.575  493.530   22.575  154.288   3.5519  154.288   3.5519 0.000000 0.000000 
1 1 1   29    7    1 o  161.454   2.3769  541.040   15.696  540.054   20.886  542.319   23.792  161.354   3.1384  161.554   3.5706 -0.1994171 4.753809 
1 1 1   29    7    2 o   94.414   2.6298  186.902   10.068  176.019   15.478  194.883   13.255   91.932   4.0820   96.895   3.3168 -4.962540 5.259659 
1 1 1   29    7    3 o   44.714   3.6715   41.870   6.7686   42.651   9.7294   41.138   9.4225   45.112   5.2291   44.315   5.1553 0.7973366 7.343033 
1 1 1   29    7    4 o   70.663   2.6985  103.976   7.8552   99.191   11.185  108.634   11.035   69.039   3.9279   72.287   3.7011 -3.248383 5.396920 
1 1 1   29    7    5 o   88.008   2.4407  160.855   8.8590  163.061   12.541  158.658   12.516   88.614   3.4314   87.402   3.4719 1.211723 4.881467 
1 1 1   29    7    6 o   96.699   2.3508  194.163   9.3724  199.470   13.230  188.817   13.280   98.036   3.2719   95.363   3.3763 2.673424 4.701571 
1 1 1   29    7    7 o  119.914   2.2534  298.437   11.143  304.616   15.750  292.245   15.767  121.166   3.1517  118.663   3.2215 2.502190 4.506841 
1 1 1   29    7    8 o  160.552   2.2059  534.908   14.606  528.958   20.532  541.005   20.784  159.649   3.1181  161.456   3.1211 -1.806915 4.411792 
1 1 1   29    7    9 o   49.176   3.2841   50.637   6.6604   50.115   9.3501   51.175   9.4899   48.920   4.6341   49.432   4.6547 -0.5112305 6.568152 
1 1 1   29    7   10 o   72.893   2.6590  110.755   7.9923  110.075   11.170  111.468   11.440   72.671   3.7268   73.115   3.7938 -0.4442749 5.318052 
1 1 1   29    7   11 f   91.649   2.4314  174.870   9.1900  172.256   12.977  177.499   13.016   90.957   3.4592   92.341   3.4176 -1.384315 4.862732 
1 1 1   29    7   12 o   69.295   3.0192  100.479   8.6282   99.133   12.100  101.872   12.306   68.825   4.2628   69.766   4.2769 -0.9411469 6.038428 
1 1 1   29    7   13 o  104.950   3.5967  232.370   12.752  232.640   14.399  231.390   27.457  105.732   3.3019  104.167   6.3908 1.565346 7.193431 
1 1 1   29    7   14 o   94.133   2.6123  186.628   9.9894  196.872   13.264  173.203   15.185   97.254   3.3067   91.012   4.0451 6.241852 5.224674 
1 1 1   29    7   15 o   59.703   3.1497   74.893   7.7063   73.434   11.502   76.080   10.381   59.114   4.7176   60.292   4.1744 -1.177856 6.299333 
1 1 1   29    7   16 o   69.265   2.9627  101.674   8.3507   89.721   12.362  111.705   11.325   65.372   4.5850   73.157   3.7534 -7.784828 5.925356 
1 1 1   29    7   17 o   92.124   2.7099  176.472   9.9736  181.289   16.360  173.623   12.582   92.969   4.2666   91.279   3.3421 1.689987 5.419723 
1 1 1   29    7   18 o   23.364   5.9283   8.9899   6.8540   16.522   12.517   5.7649   8.1911   27.576   9.2917   19.153   7.3651 8.423241 11.85669 
1 1 1   29    7   19 f   25.286   6.3956   11.449   7.1607   16.605   15.923   10.142   8.0172   28.502   10.408   22.070   7.4362 6.432093 12.79126 
1 1 1   29    7   20 f   87.443   2.9407  165.068   10.114  144.351   16.415  177.745   12.841   82.620   4.8172   92.265   3.3744 -9.644463 5.881484 
1 1 1   29    7   21 o   37.386   5.4633   32.026   8.2663   24.272   11.983   39.065   11.418   32.300   8.7697   42.471   6.5180 -10.17145 10.92663 
1 1 1   29    7   22 o  113.378   2.7672  268.082   12.880  290.617   19.389  250.281   17.232  117.566   3.9985  109.191   3.8264 8.375053 5.534423 
1 1 1   29    7   23 o   55.904   4.0490   67.046   9.3104   74.293   13.632   60.710   12.746   58.766   5.6243   53.043   5.8263 5.723083 8.098052 
1 1 1   29    7   24 o   40.739   5.8193   38.570   9.3653   37.941   12.404   39.404   14.284   40.631   7.6831   40.848   8.7422 -0.2175598 11.63857 
1 1 1   29    7   25 f   47.885   4.5340   50.398   8.9138   56.056   12.680   44.870   12.534   50.699   6.0638   45.071   6.7424 5.628170 9.068074 
1 1 1   29    7   26 o   34.055   7.1418   29.278   10.132   30.445   11.675   25.715   20.397   35.889   8.0816   32.222   11.778 3.667030 14.28364 
1 1 1   29    7   27 o   30.812   7.3337   22.863   10.233   21.836   11.959   25.670   19.772   29.871   8.9797   31.753   11.597 -1.882141 14.66745 
1 1 1   29    7   28 o   72.640   4.8556  121.535   12.950  125.920   15.427  111.074   23.826   76.400   4.8959   68.880   8.3868 7.520241 9.711247 
1 1 1   29    7   29 o   50.650   7.0382   64.986   14.162   67.097   19.638   62.698   20.443   51.932   9.5191   49.368   10.370 2.563717 14.07646 
1 1 1   29    7   30 o   52.411   8.5425   83.380   19.630   48.169   29.760  110.498   26.117   38.299   14.188   66.523   9.5187 -28.22476 17.08508 
1 1 1   29    7   31 o   38.302   10.627   41.514   19.998   83.424   47.355   32.418   22.062   43.267   17.376   33.336   12.239 9.931492 21.25343 
1 1 1   29    7   32 o   47.937   10.280   89.041   23.962   70.254   48.757   95.023   27.513   38.547   16.681   57.326   12.021 -18.77902 20.56062 
1 1 1   29    7   33 o   88.480   8.9087  199.090   32.511   0.0000   0.0000  199.090   32.511  ?   ?    88.480   8.9087      ?      ? 
1 1 1   29    8    0 o   53.435   3.2874   60.573   10.068   60.573   10.068   60.573   10.068   53.435   4.6491   53.435   4.6491 0.000000 0.000000 
1 1 1   29    8    1 o   84.558   2.4868  148.483   8.6710  152.868   12.370  144.246   12.158   85.788   3.4959   83.327   3.5377 2.461815 4.973634 
1 1 1   29    8    2 o   55.479   3.1675   64.654   7.1422   78.199   10.196   51.604   10.008   61.285   4.0336   49.674   4.8849 11.61079 6.335032 
1 1 1   29    8    3 o  185.406   2.2505  712.951   17.207  700.714   24.077  725.725   24.600  183.782   3.1764  187.029   3.1890 -3.246765 4.501049 
1 1 1   29    8    4 o   73.265   2.6469  111.648   7.9959  112.723   11.204  110.533   11.415   73.633   3.6891   72.896   3.7967 0.7364502 5.293845 
1 1 1   29    8    5 o  112.738   2.4354  263.265   11.214  258.736   14.803  269.365   17.180  111.656   3.2145  113.820   3.6596 -2.163902 4.870873 
1 1 1   29    8    6 o   93.170   2.5757  177.325   9.7908  159.617   12.752  202.754   15.281   87.629   3.5283   98.711   3.7534 -11.08229 5.151427 
1 1 1   29    8    7 o  148.843   2.7480  466.194   15.947  447.153   27.145  476.227   19.705  146.239   4.5006  151.447   3.1547 -5.208313 5.496087 
1 1 1   29    8    8 o   55.829   3.5689   66.738   8.0380   73.850   10.715   57.588   12.155   59.424   4.3720   52.234   5.6421 7.190464 7.137732 
1 1 1   29    8    9 o  170.354   2.4359  603.982   16.887  603.770   22.153  604.277   26.090  170.446   3.1513  170.262   3.7152 0.1842957 4.871708 
1 1 1   29    8   10 o   90.389   2.4434  170.114   9.1075  170.332   12.763  169.888   13.000   90.456   3.4210   90.321   3.4897 0.1351318 4.886841 
1 1 1   29    8   11 o   87.400   2.4741  159.158   8.9142  161.192   12.464  157.027   12.754   87.988   3.4345   86.812   3.5622 1.175659 4.948205 
1 1 1   29    8   12 o   69.603   2.8467  101.444   8.1111  102.906   10.875   99.611   12.177   70.230   3.7544   68.976   4.2802 1.253288 5.693481 
1 1 1   29    8   13 o   21.086   5.3275   7.9929   6.3104   12.839   8.0550   0.2924   10.154   24.266   7.3865   17.907   7.6791 6.359137 10.65498 
1 1 1   29    8   14 o   73.229   2.8767  111.320   8.6214  105.858   11.394  118.637   13.187   71.189   3.8805   75.269   4.2477 -4.079842 5.753386 
1 1 1   29    8   15 o  139.664   2.4126  407.167   13.792  398.379   20.697  414.186   18.498  138.214   3.6307  141.113   3.1782 -2.898911 4.825268 
1 1 1   29    8   16 o  133.829   2.6539  370.740   13.989  385.241   23.785  363.072   17.296  135.572   4.2537  132.086   3.1749 3.486435 5.307893 
1 1 1   29    8   17 o   21.696   5.6505   8.5140   6.3663   9.1472   11.118   8.2051   7.7655   22.833   8.6280   20.560   7.2985 2.273039 11.30097 
1 1 1   29    8   18 o   33.934   6.4048   23.134   7.3971   32.682   18.000   21.193   8.1139   37.029   10.991   30.840   6.5796 6.189491 12.80962 
1 1 1   29    8   19 o   57.747   4.6085   64.374   8.9546   85.773   20.645   59.415   9.9380   62.395   8.0224   53.098   4.5379 9.296047 9.216935 
1 1 1   29    8   20 f   62.292   3.5876   87.440   8.4375   67.898   14.222   98.053   10.481   56.172   6.1388   68.412   3.7146 -12.23999 7.175128 
1 1 1   29    8   21 o   80.928   3.1013  138.179   10.348  138.206   14.830  138.153   14.446   80.912   4.4438   80.945   4.3271 -0.3298950E-01 6.202555 
1 1 1   29    8   22 o   23.509   6.1522   10.724   7.8995   9.7914   11.852   11.469   10.596   23.290   8.8824   23.728   8.5147 -0.4379921 12.30440 
1 1 1   29    8   23 o   48.329   4.7273   51.393   8.9032   69.215   13.228   36.634   12.038   56.645   5.6621   40.012   7.5716 16.63308 9.454569 
1 1 1   29    8   24 o   48.203   5.3566   54.519   9.9266   64.371   13.234   41.848   15.009   54.451   5.8929   41.955   8.9469 12.49540 10.71321 
1 1 1   29    8   25 o  129.937   2.6999  356.015   14.462  345.371   20.074  367.500   20.852  127.931   3.8045  131.944   3.8318 -4.013206 5.399722 
1 1 1   29    8   26 o   47.463   6.6344   60.672   11.063   67.768   12.956   41.572   21.255   55.741   5.6355   39.185   12.013 16.55610 13.26881 
1 1 1   29    8   27 o   30.205   7.3328   21.392   10.268   19.230   12.160   26.764   19.168   28.191   9.1466   32.220   11.464 -4.028463 14.66552 
1 1 1   29    8   28 o   43.835   6.6500   44.696   10.960   39.444   13.121   56.819   19.935   40.680   8.1048   46.989   10.545 -6.308826 13.30007 
1 1 1   29    8   29 o   51.288   8.5381   68.689   16.805   88.226   30.082   59.826   20.261   54.771   13.421   47.806   10.558 6.965752 17.07620 
1 1 1   29    8   30 o   42.129   8.6716   56.068   18.579   24.724   29.105   77.624   24.136   30.964   13.131   53.294   11.329 -22.33010 17.34315 
1 1 1   29    8   31 o   25.978   8.5859   4.0407   18.823 -15.8273   49.570   7.3880   20.347   27.675   13.481   24.281   10.637 3.394594 17.17180 
1 1 1   29    8   32 o   23.784   8.0581  -6.4557   20.203 -33.7102   46.067   0.0342   22.480   24.786   12.255   22.782   10.466 2.004169 16.11614 
1 1 1   29    8   33 o   41.644   13.255   58.787   25.632   0.0000   0.0000   58.787   25.632  ?   ?    41.644   13.255      ?      ? 
1 1 1   29    9    0 o   49.787   3.4395   52.925   9.7695   52.925   9.7695   52.925   9.7695   49.787   4.8642   49.787   4.8642 0.000000 0.000000 
1 1 1   29    9    1 o   93.653   2.3938  182.180   9.2456  180.480   13.121  183.857   13.030   93.214   3.4129   94.093   3.3575 -0.8788910 4.787560 
1 1 1   29    9    2 o   24.203   5.3291   11.193   6.3530   19.575   9.3926   4.1248   8.6253   29.716   7.6255   18.691   7.4465 11.02543 10.65828 
1 1 1   29    9    3 o   61.560   3.1029   78.792   7.8524   82.905   11.689   75.410   10.601   62.999   4.4986   60.122   4.2750 2.877697 6.205889 
1 1 1   29    9    4 o   76.633   2.8578  120.574   8.8938  112.611   11.461  132.630   14.102   73.551   3.7779   79.714   4.2891 -6.162872 5.715689 
1 1 1   29    9    5 o  132.351   2.2285  363.715   12.164  369.211   17.252  358.282   17.153  133.349   3.1368  131.352   3.1662 1.996826 4.456934 
1 1 1   29    9    6 f  108.326   2.2853  243.590   10.205  233.596   14.185  254.312   14.692  106.023   3.2439  110.630   3.2200 -4.607651 4.570688 
1 1 1   29    9    7 o   54.540   3.1643   62.279   7.0988   56.362   9.9146   68.504   10.169   51.852   4.6360   57.229   4.3081 -5.376289 6.328657 
1 1 1   29    9    8 o  102.705   2.3073  219.260   9.7682  208.930   13.655  230.085   13.979  100.218   3.3037  105.192   3.2220 -4.973763 4.614676 
1 1 1   29    9    9 o  127.747   2.3623  338.920   12.378  345.722   18.585  333.497   16.594  128.842   3.4973  126.652   3.1767 2.189720 4.724648 
1 1 1   29    9   10 o   58.916   3.2440   73.661   7.7440   78.240   10.250   67.570   11.821   61.183   4.0617   56.650   5.0593 4.532616 6.488046 
1 1 1   29    9   11 o   65.750   3.2335   90.986   8.5331   91.964   10.920   89.451   13.675   66.339   3.9909   65.160   5.0886 1.179634 6.466911 
1 1 1   29    9   12 o   67.076   3.2275   92.766   8.8497  109.275   13.609   80.670   11.649   72.154   4.5731   61.999   4.5555 10.15514 6.454919 
1 1 1   29    9   13 o   18.173   5.3027  -1.4131   6.8519   9.4033   10.783  -8.7381   8.8737   22.935   8.5315   13.412   6.2998 9.523700 10.60538 
1 1 1   29    9   14 o   66.184   3.0091   91.158   8.1384   87.751   10.719   95.795   12.505   64.789   4.0114   67.579   4.4864 -2.789940 6.018243 
1 1 1   29    9   15 o   55.855   3.3122   64.731   7.5587   71.849   11.703   59.637   9.9008   58.414   4.8576   53.296   4.5041 5.118027 6.624416 
1 1 1   29    9   16 o   55.502   4.0879   62.732   8.2531   71.954   16.498   59.654   9.5314   57.714   6.9310   53.291   4.3365 4.423195 8.175798 
1 1 1   29    9   17 o   29.712   5.0557   22.542   6.7679   5.3681   11.866   30.823   8.2394   21.303   8.6475   38.121   5.2403 -16.81859 10.11139 
1 1 1   29    9   18 o   75.225   3.5753  123.518   9.7562  111.664   18.456  128.115   11.493   72.148   6.2022   78.302   3.5589 -6.154411 7.150689 
1 1 1   29    9   19 o   98.945   2.9422  204.849   11.247  208.642   19.777  203.036   13.673   99.291   4.8294   98.600   3.3621 0.6914139 5.884472 
1 1 1   29    9   20 o   62.783   3.3473   83.435   8.3153   83.516   13.851   83.389   10.398   62.575   5.3667   62.992   4.0021 -0.4172287 6.694610 
1 1 1   29    9   21 o  106.260   2.8674  235.879   12.517  257.478   18.748  218.508   16.813  110.589   4.1104  101.932   3.9992 8.656357 5.734897 
1 1 1   29    9   22 o   71.296   3.4445  108.913   10.043  101.923   14.891  114.746   13.602   69.011   5.2315   73.581   4.4820 -4.569534 6.888906 
1 1 1   29    9   23 o   19.437   5.7043   2.8327   7.6618   7.8072   11.177  -1.5770   10.523   21.756   8.5368   17.118   7.5685 4.637968 11.40867 
1 1 1   29    9   24 o   43.371   5.6383   44.417   9.5838   50.430   12.672   36.382   14.648   47.934   6.4098   38.807   9.2777 9.127037 11.27654 
1 1 1   29    9   25 o   52.549   5.0718   62.073   10.558   62.571   13.295   61.224   17.373   53.455   6.0305   51.644   8.1564 1.811028 10.14364 
1 1 1   29    9   26 o   41.473   6.6921   43.969   10.699   46.870   12.782   37.178   19.556   45.723   6.7778   37.223   11.541 8.499550 13.38415 
1 1 1   29    9   27 o   65.380   5.0704  101.133   12.133  108.203   14.595   85.313   21.832   70.760   5.0008   60.001   8.8219 10.75916 10.14077 
1 1 1   29    9   28 f   56.032   5.8426   77.298   11.726   83.058   14.250   65.221   20.635   61.505   5.6175   50.560   10.246 10.94478 11.68530 
1 1 1   29    9   29 o   39.029   9.3012   44.494   17.729   61.812   27.956   32.844   22.930   44.300   13.809   33.759   12.464 10.54114 18.60236 
1 1 1   29    9   30 o   21.465   7.1753 -11.3587   16.658 -27.8928   28.842  -3.0832   20.405   21.164   10.303   21.765   9.9891 -0.6010857 14.35068 
1 1 1   29    9   31 f   23.054   7.9412 -11.9457   18.687 -28.7476   47.437  -8.8592   20.332   25.832   12.707   20.275   9.5275 5.557610 15.88247 
1 1 1   29    9   32 o   24.325   8.2852  -5.0987   20.728 -17.3396   48.314  -2.3374   22.947   26.331   12.927   22.319   10.367 4.011526 16.57038 
1 1 1   29    9   33 o   26.053   11.440   13.989   23.655   0.0000   0.0000   13.989   23.655  ?   ?    26.053   11.440      ?      ? 
1 1 1   29   10    0 o   53.742   3.2997   61.343   10.164   61.343   10.164   61.343   10.164   53.742   4.6665   53.742   4.6665 0.000000 0.000000 
1 1 1   29   10    1 o   28.210   5.5945   17.695   6.7384   16.866   10.348   18.305   8.8787   27.718   8.3577   28.701   7.4391 -0.9838924 11.18891 
1 1 1   29   10    2 o   72.000   2.8041  107.997   8.3024  106.561   11.281  109.695   12.263   71.507   3.8249   72.494   4.1015 -0.9871216 5.608258 
1 1 1   29   10    3 o   98.827   2.3384  203.038   9.5313  201.579   13.452  204.510   13.507   98.469   3.3122   99.185   3.3018 -0.7158508 4.676772 
1 1 1   29   10    4 o   60.230   2.9594   75.806   7.3510   77.130   10.421   74.494   10.372   60.759   4.1583   59.702   4.2120 1.057362 5.918810 
1 1 1   29   10    5 o   52.249   3.2618   57.538   6.9486   68.086   9.9000   47.297   9.7552   57.066   4.2062   47.432   4.9866 9.634323 6.523671 
1 1 1   29   10    6 o   70.037   2.7120  102.066   7.7926   88.278   10.732  117.442   11.333   65.011   4.0025   75.063   3.6607 -10.05149 5.424083 
1 1 1   29   10    7 o   17.925   5.0718   3.0055   5.8897   7.0292   8.2458  -1.1852   8.4152   20.118   7.4651   15.732   6.8675 4.386786 10.14352 
1 1 1   29   10    8 o   21.858   5.2694   9.5777   5.7463   11.531   8.0802   7.5794   8.1734   23.274   7.4461   20.441   7.4579 2.832588 10.53870 
1 1 1   29   10    9 o   32.304   4.7784   23.139   6.1681   26.749   8.7793   19.620   8.6678   34.953   6.3225   29.655   7.1664 5.298189 9.556801 
1 1 1   29   10   10 o   28.002   5.2627   17.612   6.2570   20.822   8.6646   14.115   9.0451   30.575   7.0192   25.428   7.8431 5.147501 10.52538 
1 1 1   29   10   11 o   85.435   2.5938  151.161   9.1010  140.755   12.201  164.213   13.664   82.162   3.6005   88.708   3.7347 -6.545868 5.187661 
1 1 1   29   10   12 o   85.205   2.5013  151.311   8.7889  150.953   12.318  151.683   12.544   85.109   3.5091   85.301   3.5654 -0.1911316 5.002601 
1 1 1   29   10   13 o   87.221   2.7117  159.561   9.6558  164.375   12.891  153.408   14.574   88.811   3.5193   85.630   4.1265 3.181320 5.423443 
1 1 1   29   10   14 o   48.078   3.4490   48.687   6.8346   50.975   9.7071   46.438   9.6246   49.218   4.7819   46.939   4.9715 2.279404 6.897965 
1 1 1   29   10   15 o   52.812   3.4928   59.060   7.4609   58.025   11.693   59.771   9.6896   52.294   5.4214   53.330   4.4052 -1.036247 6.985553 
1 1 1   29   10   16 o   32.728   6.4033   21.874   8.3887   33.970   15.577   16.933   9.9557   38.018   9.8532   27.439   8.1806 10.57919 12.80653 
1 1 1   29   10   17 o   16.916   5.1574  -1.6736   7.0976 -21.5169   13.861   5.3782   8.2630   14.876   7.2192   18.957   7.3674 -4.080400 10.31478 
1 1 1   29   10   18 o   74.356   3.6028  118.474   9.7470  114.608   18.694  119.917   11.423   73.013   6.2078   75.699   3.6585 -2.685989 7.205629 
1 1 1   29   10   19 o   57.279   3.9554   71.295   8.4104   67.355   15.504   72.937   10.011   55.673   6.7518   58.884   4.1223 -3.210781 7.910783 
1 1 1   29   10   20 o   76.211   3.2369  120.468   9.3601  128.935   17.202  116.907   11.156   77.722   5.3663   74.700   3.6210 3.022697 6.473742 
1 1 1   29   10   21 o   95.604   3.0069  192.220   11.816  202.341   17.604  183.921   15.941   97.826   4.3630   93.382   4.1389 4.443710 6.013856 
1 1 1   29   10   22 o   21.515   6.1042   6.2149   8.2614   10.152   12.485   3.1487   11.019   23.587   9.0868   19.443   8.1531 4.143810 12.20834 
1 1 1   29   10   23 o   52.765   4.1386   60.187   8.9855   64.130   13.275   56.853   12.207   54.321   5.9253   51.210   5.7794 3.111130 8.277136 
1 1 1   29   10   24 o   82.321   3.1741  144.172   10.765  153.979   15.480  134.987   14.981   85.074   4.4117   79.568   4.5649 5.505325 6.348293 
1 1 1   29   10   25 o   48.970   8.8558   73.533   13.270   75.558   13.799   48.627   48.398   58.809   5.6892   39.132   16.773 19.67651 17.71154 
1 1 1   29   10   26 o   56.453   5.8581   74.969   11.665   75.363   13.737   73.948   22.085   58.675   5.6765   54.232   10.249 4.443501 11.71622 
1 1 1   29   10   27 o   21.236   6.5125   3.5350   9.9772   5.7861   11.738  -2.3266   18.940   20.701   8.5242   21.771   9.8483 -1.069944 13.02508 
1 1 1   29   10   28 o   35.046   7.7479   32.822   12.170   31.925   15.251   34.394   20.193   34.992   10.042   35.100   11.802 -0.1084290 15.49579 
1 1 1   29   10   29 o   58.913   8.2313  106.245   20.035   49.438   30.277  150.492   26.721   38.446   14.297   79.380   8.1618 -40.93363 16.46266 
1 1 1   29   10   30 o   52.733   8.8357   80.588   18.711   85.820   29.146   76.920   24.403   53.014   13.340   52.452   11.589 0.5620384 17.67132 
1 1 1   29   10   31 o   50.631   10.981   93.174   23.505  115.563   52.734   87.623   26.257   46.380   18.433   54.881   11.940 -8.501606 21.96191 
1 1 1   29   10   32 o   31.312   9.5608   31.444   21.031   26.942   50.176   32.403   23.164   30.728   14.597   31.896   12.352 -1.168295 19.12167 
1 1 1   29   11    0 o   23.061   6.5521   15.566   8.5752   15.566   8.5752   15.566   8.5752   23.061   9.2661   23.061   9.2661 0.000000 0.000000 
1 1 1   29   11    1 o   65.600   2.8398   89.996   7.6315   76.981   10.644  103.767   10.948   60.661   4.2541   70.538   3.7631 -9.876514 5.679662 
1 1 1   29   11    2 o  122.866   2.2315  313.696   11.306  323.813   16.137  303.944   15.844  124.818   3.1346  120.915   3.1770 3.902779 4.463052 
1 1 1   29   11    3 o   42.254   3.7428   37.657   6.5214   36.875   9.2385   38.433   9.2068   41.806   5.3580   42.703   5.2274 -0.8969078 7.485568 
1 1 1   29   11    4 o   60.028   2.9389   75.334   7.2747   77.556   10.357   73.171   10.220   60.908   4.1229   59.148   4.1894 1.759792 5.877857 
1 1 1   29   11    5 o   20.923   5.1769   6.9233   6.3486  -3.3129   9.6590   14.709   8.4238   16.031   7.1597   25.815   7.4794 -9.783396 10.35383 
1 1 1   29   11    6 o   74.694   3.6444  124.969   9.9350  100.506   17.985  135.712   11.918   68.688   6.3485   80.700   3.5808 -12.01195 7.288720 
1 1 1   29   11    7 o   19.582   5.3064   5.9693   5.9993   5.8600   8.4169   6.0822   8.5533   19.468   7.4708   19.697   7.5377 -0.2292061 10.61271 
1 1 1   29   11    8 o   36.661   4.4183   29.316   6.4420   34.711   9.0917   23.877   9.1291   40.527   5.4392   32.796   6.9643 7.731098 8.836660 
1 1 1   29   11    9 o   76.944   2.5374  123.428   8.0522  121.886   11.368  124.980   11.407   76.458   3.6049   77.430   3.5720 -0.9720383 5.074870 
1 1 1   29   11   10 o  122.165   2.3618  310.817   11.850  311.857   16.051  309.571   17.567  122.445   3.1783  121.886   3.4945 0.5585709 4.723683 
1 1 1   29   11   11 o  172.010   2.3696  615.423   16.707  610.867   22.378  621.161   25.112  171.379   3.1659  172.641   3.5267 -1.261932 4.739257 
1 1 1   29   11   12 o   67.912   3.0147   97.253   8.3474  101.711   11.160   91.592   12.577   69.780   3.8776   66.043   4.6171 3.737686 6.029418 
1 1 1   29   11   13 o  111.365   2.6705  255.932   11.820  247.702   14.747  270.721   19.767  109.066   3.2782  113.663   4.2166 -4.596802 5.341036 
1 1 1   29   11   14 o   56.579   3.1323   67.759   7.2546   59.898   10.435   75.112   10.093   53.300   4.7468   59.857   4.0881 -6.556324 6.264602 
1 1 1   29   11   15 o   67.338   3.7889  101.549   9.1538   84.962   17.198  108.106   10.813   62.767   6.6431   71.909   3.6457 -9.142395 7.577787 
1 1 1   29   11   16 o   34.900   5.4607   33.977   7.5625   9.9718   14.860   42.367   8.7853   24.998   9.8323   44.802   4.7544 -19.80461 10.92145 
1 1 1   29   11   17 o   45.429   4.9731   42.809   7.9423   51.117   16.075   40.126   9.1351   47.360   8.5440   43.497   5.0920 3.863125 9.946253 
1 1 1   29   11   18 o   71.103   3.0935  107.682   8.7318  102.363   14.239  110.888   11.054   69.454   4.9706   72.752   3.6840 -3.297592 6.186968 
1 1 1   29   11   19 o   54.948   3.9860   66.303   8.1820   60.452   14.772   68.892   9.8270   52.693   6.7973   57.203   4.1652 -4.509983 7.971940 
1 1 1   29   11   20 o   53.345   4.2607   63.551   8.4479   56.093   15.207   66.880   10.160   50.437   7.3101   56.254   4.3790 -5.816689 8.521315 
1 1 1   29   11   21 o   39.569   5.5512   36.067   8.7379   37.208   12.538   34.990   12.184   40.195   7.8446   38.944   7.8566 1.251568 11.10240 
1 1 1   29   11   22 o  116.138   3.2119  290.842   15.105  314.661   20.123  260.103   22.860  122.058   3.9972  110.218   5.0288 11.84037 6.423863 
1 1 1   29   11   23 o   19.665   5.7614   2.5873   8.0335  -4.5021   11.497   9.3501   11.229   16.817   7.6336   22.513   8.6316 -5.696196 11.52287 
1 1 1   29   11   24 o   32.099   6.2743   25.070   8.6140   27.173   12.000   22.834   12.372   33.559   8.6234   30.639   9.1162 2.920540 12.54862 
1 1 1   29   11   25 o   52.048   9.2664   77.367   13.451   77.544   14.012   75.290   48.006   59.494   5.7103   44.601   17.631 14.89286 18.53277 
1 1 1   29   11   26 o   22.477   6.7655   5.7630   10.695   9.4091   12.590  -3.6895   20.272   22.827   9.0274   22.126   10.079 0.7004261 13.53100 
1 1 1   29   11   27 o   29.916   7.4370   20.384   10.631   15.998   12.686   30.733   19.485   26.137   9.3231   33.695   11.589 -7.558357 14.87402 
1 1 1   29   11   28 o   18.494   6.0265  -9.9475   11.418   3.4840   15.153 -27.5951   17.369   21.255   9.2484   15.733   7.7295 5.521987 12.05310 
1 1 1   29   11   29 o   39.000   9.3201   48.246   18.105   41.805   28.112   52.812   23.666   36.093   13.700   41.907   12.640 -5.814690 18.64027 
1 1 1   29   11   30 o   41.284   9.3948   55.287   18.129   54.759   28.508   55.645   23.491   39.934   14.002   42.634   12.530 -2.700382 18.78965 
1 1 1   29   11   31 o   33.268   8.7980   35.719   17.572   18.855   27.187   47.820   23.030   28.045   12.291   38.491   12.592 -10.44637 17.59610 
1 1 1   29   11   32 o   56.918   8.9966  136.504   25.314   54.104   51.666  162.531   29.038   33.931   15.688   79.904   8.8110 -45.97374 17.99312 
1 1 1   29   12    0 o   52.414   3.2311   58.403   9.7057   58.403   9.7057   58.403   9.7057   52.414   4.5695   52.414   4.5695 0.000000 0.000000 
1 1 1   29   12    1 o   17.740   5.0259   3.4437   5.6374   5.3783   7.9659   1.5027   7.9792   18.859   7.2602   16.621   6.9518 2.237356 10.05179 
1 1 1   29   12    2 f   32.762   4.6613   23.567   6.1696   17.929   8.6975   29.278   8.7531   28.339   7.3714   37.186   5.7071 -8.847101 9.322528 
1 1 1   29   12    3 o   62.850   2.8373   82.605   7.3334   74.763   10.291   90.696   10.453   59.784   4.1735   65.917   3.8449 -6.133327 5.674597 
1 1 1   29   12    4 o   38.798   3.9987   31.878   6.3943   33.223   9.0448   30.534   9.0410   39.638   5.5325   37.958   5.7749 1.680145 7.997357 
1 1 1   29   12    5 o   83.536   2.4663  145.356   8.4970  146.827   12.086  143.918   11.949   83.953   3.4903   83.118   3.4854 0.8347702 4.932628 
1 1 1   29   12    6 o   28.971   4.9988   18.761   5.9457   16.236   8.4474   21.240   8.3700   26.997   7.3768   30.946   6.7480 -3.948778 9.997604 
1 1 1   29   12    7 o   69.621   2.7161  101.076   7.7875  109.152   11.222   93.574   10.815   72.318   3.7625   66.925   3.9182 5.392685 5.432184 
1 1 1   29   12    8 o   15.429   4.7020  -0.9257   5.5806  -4.7345   8.1017   2.5132   7.6982   13.948   6.3608   16.910   6.9263 -2.962668 9.403901 
1 1 1   29   12    9 o   33.096   4.7591   23.882   6.4002   15.088   8.7413   34.045   9.3966   26.111   7.6346   40.082   5.6841 -13.97121 9.518151 
1 1 1   29   12   10 o   38.640   4.1155   31.679   6.5571   31.665   9.1673   31.693   9.3828   38.644   5.7516   38.636   5.8880 0.8094788E-02 8.231021 
1 1 1   29   12   11 o   33.103   5.1322   24.368   6.7608   25.216   10.333   23.732   8.9397   33.506   7.6462   32.700   6.8479 0.8062248 10.26439 
1 1 1   29   12   12 o   54.041   3.5963   62.750   7.7582   66.552   9.9956   56.987   12.304   56.319   4.3032   51.764   5.7632 4.555481 7.192512 
1 1 1   29   12   13 o   15.988   4.8680  -2.5216   6.0816  -8.2991   8.1390   4.7820   9.1509   12.737   5.9986   19.240   7.6685 -6.502998 9.735965 
1 1 1   29   12   14 o   30.332   4.9504   20.694   6.1486   26.533   8.8054   15.137   8.5895   34.656   6.3960   26.008   7.5575 8.647421 9.900764 
1 1 1   29   12   15 o   22.254   6.1367   6.6457   7.0824   12.144   14.693   4.9816   8.0834   25.922   9.8891   18.586   7.2692 7.336491 12.27334 
1 1 1   29   12   16 o   41.356   7.2840   34.185   8.4514   48.554   26.702   32.585   8.9094   43.614   13.480   39.098   5.5249 4.515785 14.56798 
1 1 1   29   12   17 o   38.731   5.6990   35.221   7.7321   30.914   15.710   36.597   8.8824   35.987   10.146   41.476   5.1925 -5.488613 11.39795 
1 1 1   29   12   18 o   37.572   5.0398   32.014   7.1748   29.475   12.320   33.317   8.8259   35.642   8.5003   39.502   5.4172 -3.860210 10.07968 
1 1 1   29   12   19 f   58.670   3.4913   73.902   8.0223   70.826   13.492   75.584   9.9776   57.422   5.6969   59.918   4.0374 -2.496025 6.982527 
1 1 1   29   12   20 o   20.762   5.5352   0.8921   6.5938   18.876   12.531  -5.9941   7.7541   28.548   9.2862   12.975   6.0265 15.57346 11.07037 
1 1 1   29   12   21 o   42.958   5.2336   43.128   8.7305   29.807   12.649   55.248   12.065   35.413   8.7184   50.503   5.7923 -15.09003 10.46715 
1 1 1   29   12   22 o   48.436   4.5083   50.909   8.9564   57.599   13.533   45.695   11.948   51.222   6.4055   45.649   6.3457 5.573170 9.016600 
1 1 1   29   12   23 o   72.946   3.4876  113.816   10.436  118.669   15.717  109.990   13.956   74.209   5.1351   71.683   4.7205 2.525932 6.975129 
1 1 1   29   12   24 o   62.329   3.9122   84.768   10.051   81.298   14.183   88.269   14.245   60.981   5.6391   63.677   5.4241 -2.695595 7.824337 
1 1 1   29   12   25 o   25.759   8.6147  -2.4195   11.507  -4.5591   11.914   27.309   44.409   16.951   7.7237   34.567   15.401 -17.61673 17.22939 
1 1 1   29   12   26 o   53.232   7.0485   81.144   12.457   91.325   14.394   50.756   24.867   64.679   5.3957   41.786   13.024 22.89277 14.09710 
1 1 1   29   12   27 o   49.787   6.8619   57.347   12.255   51.495   14.158   74.835   24.476   47.271   7.2617   52.304   11.645 -5.032520 13.72387 
1 1 1   29   12   28 o   39.109   7.9657   38.680   13.221   27.499   16.188   61.078   22.912   31.922   10.563   46.296   11.926 -14.37456 15.93132 
1 1 1   29   12   29 f   56.045   8.5387   91.096   19.283   80.164   29.800   98.972   25.293   50.020   13.929   62.070   9.8798 -12.05065 17.07743 
1 1 1   29   12   30 o   25.677   7.7253   9.7913   16.224 -19.2216   26.844   26.487   20.363   21.072   10.183   30.281   11.620 -9.208200 15.45065 
1 1 1   29   12   31 o   27.407   8.3697   18.077   17.009   21.350   26.918   15.901   21.945   28.437   12.350   26.378   11.300 2.058716 16.73932 
1 1 1   29   13    0 o  138.003   2.4778  395.541   19.916  395.541   19.916  395.541   19.916  138.003   3.5041  138.003   3.5041 0.000000 0.000000 
1 1 1   29   13    1 o   60.126   2.8922   75.616   7.1714   77.016   10.139   74.216   10.145   60.691   4.0504   59.562   4.1296 1.129547 5.784441 
1 1 1   29   13    2 o   59.822   2.8979   74.845   7.1495   73.438   10.063   76.279   10.160   59.250   4.1178   60.393   4.0787 -1.142990 5.795874 
1 1 1   29   13    3 o   47.613   3.3568   47.742   6.5641   53.000   9.3217   42.570   9.2450   50.264   4.4965   44.961   4.9854 5.303486 6.713628 
1 1 1   29   13    4 o   54.169   3.1123   61.730   6.9154   54.495   9.7888   68.939   9.7710   50.935   4.6596   57.402   4.1271 -6.466801 6.224513 
1 1 1   29   13    5 o   36.502   4.2021   28.885   6.1104   33.675   8.6507   24.117   8.6322   39.941   5.2513   33.064   6.5616 6.877110 8.404219 
1 1 1   29   13    6 o  128.849   2.2126  345.122   11.756  339.401   16.424  351.134   16.834  127.759   3.1169  129.940   3.1412 -2.181129 4.425127 
1 1 1   29   13    7 o   33.181   4.5046   24.023   6.0068   19.207   8.4196   29.016   8.5724   29.345   7.0456   37.017   5.6148 -7.672489 9.009244 
1 1 1   29   13    8 o   88.937   2.5358  164.115   9.2663  156.376   12.466  173.673   13.853   86.631   3.4889   91.243   3.6810 -4.612534 5.071681 
1 1 1   29   13    9 o   79.880   2.6276  133.075   8.6312  131.936   11.740  134.416   12.733   79.543   3.5786   80.217   3.8485 -0.6746750 5.255197 
1 1 1   29   13   10 o   77.168   2.5858  124.315   8.2276  128.113   11.680  120.575   11.592   78.348   3.6145   75.987   3.6987 2.361176 5.171503 
1 1 1   29   13   11 o  111.565   2.4413  258.565   11.168  269.905   16.869  249.717   14.901  113.677   3.5979  109.453   3.3008 4.224075 4.882666 
1 1 1   29   13   12 o  132.969   2.4232  368.733   13.151  366.927   17.375  371.157   20.124  132.701   3.1746  133.237   3.6620 -0.5360718 4.846488 
1 1 1   29   13   13 o  101.435   2.6647  217.180   10.934  204.773   16.933  226.053   14.320   98.769   4.1567  104.101   3.3352 -5.331161 5.329332 
1 1 1   29   13   14 o   76.578   3.6128  133.030   9.9192  105.226   18.338  144.529   11.793   69.956   6.3558   83.199   3.4368 -13.24333 7.225511 
1 1 1   29   13   15 o  103.880   3.3263  240.843   12.790  196.659   22.724  261.332   15.474   95.893   5.7455  111.867   3.3537 -15.97434 6.652650 
1 1 1   29   13   16 f   81.328   5.0441  146.722   11.109  141.110   30.765  147.563   11.913   78.649   9.4843   84.006   3.4382 -5.357277 10.08827 
1 1 1   29   13   17 o  111.933   3.0571  257.675   13.183  282.703   23.704  246.467   15.862  115.365   4.9818  108.502   3.5446 6.863495 6.114161 
1 1 1   29   13   18 o   36.845   5.2641   32.269   7.4510   24.751   12.465   36.450   9.2943   32.434   9.0005   41.257   5.4620 -8.822945 10.52820 
1 1 1   29   13   19 o   17.996   5.2711   2.9363   6.4478  -4.7519   11.715   6.2770   7.7227   16.998   7.7120   18.994   7.1876 -1.995289 10.54218 
1 1 1   29   13   20 o   29.010   5.9840   19.315   7.1372   20.193   13.369   18.965   8.4406   29.308   9.5947   28.712   7.1538 0.5961857 11.96809 
1 1 1   29   13   21 o   34.118   5.9726   27.715   8.2728   26.703   12.994   28.404   10.728   33.258   9.1747   34.978   7.6493 -1.719196 11.94512 
1 1 1   29   13   22 o   53.530   4.2585   62.955   9.2383   61.059   14.304   64.311   12.100   52.525   6.6029   54.535   5.3797 -2.009438 8.516992 
1 1 1   29   13   23 o   55.187   4.4119   66.500   9.8247   87.277   14.729   49.846   13.187   63.195   5.6510   47.179   6.7768 16.01607 8.823730 
1 1 1   29   13   24 o   35.975   7.0045   34.112   10.669   37.557   12.960   26.867   18.793   39.679   8.1909   32.272   11.365 7.406712 14.00910 
1 1 1   29   13   25 o   33.486   8.3973   29.685   12.352   31.518   12.929   10.505   41.822   35.823   8.8115   31.148   14.297 4.674814 16.79453 
1 1 1   29   13   26 o   28.716   8.3822   17.874   12.209   19.368   12.700  -0.3452   44.351   27.988   9.3596   29.444   13.908 -1.455915 16.76436 
1 1 1   29   13   27 o   45.077   7.3735   52.752   13.306   45.658   17.314   62.984   20.795   41.571   10.180   48.583   10.670 -7.011879 14.74697 
1 1 1   29   13   28 o   98.616   4.6454  206.462   17.801  178.570   21.324  270.592   32.334   89.463   5.7791  107.768   7.2746 -18.30583 9.290751 
1 1 1   29   13   29 o   41.408   9.2471   56.485   18.118   47.986   28.162   62.487   23.665   37.287   13.804   45.528   12.308 -8.240334 18.49428 
1 1 1   29   13   30 o   32.818   8.6956   34.250   17.851   11.632   27.974   49.787   23.185   26.445   11.965   39.190   12.621 -12.74526 17.39113 
1 1 1   29   13   31 o   26.249   8.1639   14.310   17.238   8.2004   26.649   18.705   22.603   25.289   11.534   27.209   11.557 -1.920397 16.32788 
1 1 1   29   14    0 o   83.991   2.4565  146.967   11.988  146.967   11.988  146.967   11.988   83.991   3.4740   83.991   3.4740 0.000000 0.000000 
1 1 1   29   14    1 o  101.072   2.3111  212.616   9.6330  209.781   13.665  215.417   13.581  100.393   3.3003  101.751   3.2362 -1.357597 4.622203 
1 1 1   29   14    2 o  153.536   2.2035  490.056   13.952  502.258   19.877  478.207   19.587  155.426   3.1008  151.646   3.1317 3.779343 4.407044 
1 1 1   29   14    3 o   66.469   2.7681   92.369   7.5765   98.723   10.746   86.088   10.684   68.771   3.7885   64.167   4.0370 4.603828 5.536257 
1 1 1   29   14    4 o  130.051   2.2229  351.643   11.921  360.125   16.990  343.417   16.732  131.600   3.1302  128.502   3.1570 3.098251 4.445749 
1 1 1   29   14    5 o   28.758   4.6604   18.113   5.9812   6.8201   8.4063   29.692   8.5122   20.054   7.5183   37.462   5.5091 -17.40814 9.320724 
1 1 1   29   14    6 o   28.706   4.7322   18.215   5.8837   26.723   8.2945   9.5988   8.3473   35.507   5.6638   21.905   7.5827 13.60216 9.464424 
1 1 1   29   14    7 o  108.154   2.3972  243.851   10.640  245.248   14.370  242.156   15.829  108.554   3.2095  107.753   3.5618 0.8002319 4.794499 
1 1 1   29   14    8 o   95.243   2.4452  188.960   9.5748  186.535   12.997  191.838   14.159   94.613   3.3307   95.872   3.5807 -1.258415 4.890308 
1 1 1   29   14    9 o   36.215   4.3766   28.758   6.3201   31.998   8.7131   25.161   9.1813   38.823   5.4415   33.606   6.8562 5.217113 8.753099 
1 1 1   29   14   10 o   22.214   5.2361   10.336   5.6276   9.5077   7.8770   11.199   8.0429   21.548   7.3703   22.879   7.4395 -1.330681 10.47225 
1 1 1   29   14   11 o   68.430   2.9522   98.797   8.2557  102.461   11.084   94.231   12.373   69.955   3.8416   66.905   4.4837 3.050140 5.904362 
1 1 1   29   14   12 o   85.292   2.6856  152.033   9.3583  150.499   12.386  154.073   14.286   84.875   3.5382   85.709   4.0413 -0.8337936 5.371244 
1 1 1   29   14   13 o  112.645   2.5948  270.614   11.747  238.309   18.120  294.034   15.429  106.520   4.1245  118.770   3.1497 -12.24983 5.189599 
1 1 1   29   14   14 o   91.890   3.2394  184.008   10.877  165.538   20.326  191.418   12.875   88.020   5.5989   95.760   3.2599 -7.739349 6.478820 
1 1 1   29   14   15 o   20.624   6.5952   0.7206   7.2295  -2.4519   24.398   1.0260   7.5694   25.392   11.357   15.856   6.7089 9.535626 13.19032 
1 1 1   29   14   16 o   74.253   3.5291  114.452   9.6123  123.211   18.698  111.306   11.206   75.655   5.9924   72.851   3.7297 2.804291 7.058242 
1 1 1   29   14   17 o   73.152   3.1183  115.320   9.0355  104.642   14.596  121.955   11.505   70.071   5.0505   76.234   3.6590 -6.163574 6.236637 
1 1 1   29   14   18 o   46.428   4.0751   44.335   7.5131   55.030   12.908   38.854   9.2397   50.284   6.2237   42.571   5.2623 7.712582 8.150220 
1 1 1   29   14   19 o   31.882   5.3470   25.857   7.0164   14.057   12.476   31.316   8.4856   25.620   9.2342   38.145   5.3937 -12.52414 10.69404 
1 1 1   29   14   20 o   43.361   5.2376   45.945   7.9428   35.117   14.577   50.518   9.4725   38.070   9.3513   48.653   4.7206 -10.58303 10.47528 
1 1 1   29   14   21 o   24.548   6.4506   12.213   8.4033   13.867   14.272   11.335   10.397   25.835   9.7724   23.261   8.4227 2.574211 12.90117 
1 1 1   29   14   22 o   30.016   6.9346   21.995   9.4797   21.462   17.245   22.226   11.348   29.767   10.837   30.265   8.6554 -0.4982643 13.86926 
1 1 1   29   14   23 o   21.309   6.3767   2.5323   9.4073   12.091   15.845  -2.6706   11.691   25.225   10.079   17.393   7.8145 7.831224 12.75344 
1 1 1   29   14   24 f   71.947   4.6230  117.785   12.678  122.118   15.493  109.005   22.056   75.140   4.9993   68.754   7.7779 6.385689 9.245980 
1 1 1   29   14   25 o   68.602   4.6675  104.342   12.361  101.234   14.994  110.935   21.837   68.033   5.3436   69.170   7.6544 -1.136963 9.335055 
1 1 1   29   14   26 o   31.043   9.3895   10.357   11.942   5.5842   12.416   69.314   43.638   20.678   8.6621   41.408   16.662 -20.72979 18.77896 
1 1 1   29   14   27 o   45.505   7.8207   53.494   13.977   44.929   17.159   70.386   24.096   41.142   10.170   49.869   11.884 -8.727600 15.64149 
1 1 1   29   14   28 o   29.588   8.0323   22.349   13.216   17.459   16.323   31.655   22.517   26.666   10.357   32.509   12.280 -5.842148 16.06470 
1 1 1   29   14   29 o   36.701   13.814   48.231   28.433   48.231   28.433   0.0000   0.0000   36.701   13.814  ?   ?       ?      ? 
1 1 1   29   14   30 o   22.120   7.4366 -13.0591   17.032   13.480   29.237 -26.6921   20.955   26.859   12.185   17.381   8.5292 9.477486 14.87329 
1 1 1   29   15    0 o   41.560   3.9506   37.946   9.0902   37.946   9.0902   37.946   9.0902   41.560   5.5869   41.560   5.5869 0.000000 0.000000 
1 1 1   29   15    1 o   95.848   2.3438  191.304   9.2653  190.224   13.131  192.374   13.075   95.574   3.3311   96.122   3.2981 -0.5476990 4.687657 
1 1 1   29   15    2 o   61.734   2.8552   79.746   7.2623   75.080   10.206   84.532   10.336   59.883   4.1323   63.585   3.9411 -3.701237 5.710409 
1 1 1   29   15    3 o   38.860   4.0474   32.694   6.2466   26.838   8.8237   38.577   8.8445   34.953   6.3548   42.766   5.0142 -7.813553 8.094795 
1 1 1   29   15    4 o   75.464   2.5822  118.894   8.0327  113.714   11.297  124.191   11.424   73.786   3.7120   77.142   3.5907 -3.355766 5.164497 
1 1 1   29   15    5 o   55.544   3.0702   64.766   7.0323   65.196   10.048   64.353   9.8450   55.718   4.3726   55.370   4.3110 0.3474236 6.140368 
1 1 1   29   15    6 o  105.798   2.4053  232.318   10.446  222.256   13.992  244.991   15.702  103.263   3.2853  108.333   3.5142 -5.069984 4.810671 
1 1 1   29   15    7 o   81.464   2.6268  139.096   8.7829  142.298   11.932  135.309   12.976   82.552   3.5044   80.376   3.9141 2.175766 5.253679 
1 1 1   29   15    8 o   15.665   4.7381  -0.6931   5.6174  -4.8110   7.8744   3.5742   8.0160   13.627   6.2362   17.703   7.1350 -4.076018 9.476174 
1 1 1   29   15    9 o   64.783   2.7580   87.909   7.3688   87.691   10.359   88.131   10.484   64.707   3.8817   64.860   3.9191 -0.1524124 5.516012 
1 1 1   29   15   10 o   90.830   2.3967  172.113   8.9586  157.123   12.508  187.900   12.837   86.736   3.4965   94.923   3.2788 -8.187302 4.793342 
1 1 1   29   15   11 o   58.890   3.2265   73.464   7.7325   75.428   10.226   70.842   11.816   59.928   4.1373   57.851   4.9522 2.076912 6.453016 
1 1 1   29   15   12 o   90.133   2.6236  169.408   9.6718  164.602   12.797  175.808   14.770   88.727   3.4970   91.539   3.9120 -2.812912 5.247165 
1 1 1   29   15   13 o   38.383   4.9708   35.643   7.0211   24.589   11.958   41.457   8.6735   32.516   8.7321   44.251   4.7523 -11.73526 9.941551 
1 1 1   29   15   14 o   89.903   4.8117  185.804   12.203  161.357   31.393  190.155   13.244   84.428   9.0152   95.378   3.3668 -10.94996 9.623391 
1 1 1   29   15   15 o   49.340   6.7243   46.984   8.6725   71.473   27.005   44.167   9.1576   53.072   12.537   45.609   4.8681 7.462532 13.44860 
1 1 1   29   15   16 o   56.019   3.6208   67.010   7.9713   67.024   13.460   67.003   9.8926   55.727   5.8564   56.311   4.2594 -0.5846519 7.241520 
1 1 1   29   15   17 o   23.161   5.8320   10.860   6.7070   12.177   11.716   10.219   8.1799   24.385   8.9241   21.938   7.5106 2.446754 11.66402 
1 1 1   29   15   18 o   28.969   5.7535   18.141   6.8315   25.215   12.055   14.794   8.2913   32.530   8.7807   25.408   7.4372 7.121571 11.50706 
1 1 1   29   15   19 o   33.297   5.4166   27.639   7.1043   18.752   12.772   31.620   8.5488   28.311   9.3832   38.283   5.4142 -9.972303 10.83315 
1 1 1   29   15   20 o   53.934   4.0677   62.250   8.2590   66.063   15.299   60.682   9.8115   54.510   6.8049   53.358   4.4583 1.151947 8.135321 
1 1 1   29   15   21 o   21.675   5.9425   7.4169   8.3613  -5.1703   13.890   14.570   10.471   18.192   8.3087   25.158   8.4982 -6.966227 11.88506 
1 1 1   29   15   22 o   40.334   5.6993   38.701   9.2468   33.169   13.545   43.530   12.655   36.724   9.0102   43.945   6.9819 -7.221542 11.39869 
1 1 1   29   15   23 o   48.509   4.8497   53.382   9.6027   48.065   14.064   58.024   13.143   45.872   7.4336   51.145   6.2305 -5.273464 9.699398 
1 1 1   29   15   24 o   51.566   5.6088   61.869   11.065   60.315   13.706   64.778   18.750   51.889   6.4042   51.243   9.2099 0.6457481 11.21762 
1 1 1   29   15   25 o   36.388   6.9258   37.751   11.075   44.530   13.315   22.532   19.951   43.138   7.7693   29.638   11.467 13.49956 13.85152 
1 1 1   29   15   26 o   34.774   9.5114   31.053   15.036   27.862   16.090   53.047   42.235   32.107   10.526   37.442   15.845 -5.335358 19.02278 
1 1 1   29   15   27 o   55.012   6.7115   74.412   14.445   65.779   18.037   89.855   24.123   51.941   8.4194   58.083   10.454 -6.141472 13.42302 
1 1 1   29   15   28 f   37.811   7.9977   42.447   13.347   43.429   16.730   40.728   22.133   39.758   10.164   35.865   12.351 3.892841 15.99544 
1 1 1   29   15   29 o   18.885   6.5144 -22.0527   15.928 -23.0871   26.061 -21.4359   20.123   20.048   9.7675   17.721   8.6226 2.326811 13.02890 
1 1 1   29   16    0 o   17.762   6.3184   9.9557   8.0662   9.9557   8.0662   9.9557   8.0662   17.762   8.9355   17.762   8.9355 0.000000 0.000000 
1 1 1   29   16    1 o   51.354   3.1731   55.692   6.6866   49.489   9.4760   61.843   9.4367   48.435   4.7435   54.272   4.2158 -5.837101 6.346154 
1 1 1   29   16    2 o   38.574   3.9255   31.653   6.2450   31.738   8.8758   31.570   8.7885   38.621   5.5721   38.527   5.5307 0.9347916E-01 7.850909 
1 1 1   29   16    3 o   81.163   2.5059  137.617   8.3873  136.779   11.938  138.434   11.786   80.909   3.5775   81.417   3.5098 -0.5081253 5.011745 
1 1 1   29   16    4 o  102.922   2.3033  220.783   9.7760  225.701   13.966  216.059   13.689  104.047   3.2544  101.798   3.2603 2.248718 4.606651 
1 1 1   29   16    5 o   24.261   5.2623   12.946   5.7865   11.640   8.2245   14.227   8.1428   23.260   7.5197   25.262   7.3634 -2.002094 10.52454 
1 1 1   29   16    6 o   64.785   2.8812   88.121   7.6820   89.408   10.570   86.681   11.184   65.327   3.9230   64.243   4.2208 1.083237 5.762407 
1 1 1   29   16    7 o  109.874   2.3907  251.482   10.799  246.715   14.633  257.184   16.003  108.777   3.2615  110.971   3.4965 -2.193237 4.781485 
1 1 1   29   16    8 o   68.339   2.8499   97.150   7.9854  105.356   12.120   90.855   10.615   70.834   4.1484   65.845   3.9089 4.988983 5.699892 
1 1 1   29   16    9 o   70.003   2.6877  102.740   7.7415  111.641   11.011   94.038   10.887   73.045   3.6547   66.961   3.9419 6.084457 5.375477 
1 1 1   29   16   10 o  125.487   2.4373  329.577   12.494  332.363   16.609  325.945   18.963  126.219   3.1905  124.755   3.6853 1.464218 4.874545 
1 1 1   29   16   11 o   50.079   3.5831   53.391   7.3374   54.166   9.8063   52.405   11.060   50.595   4.6992   49.562   5.4104 1.033360 7.166255 
1 1 1   29   16   12 o   65.672   3.1772   88.122   8.3634  103.673   13.934   79.365   10.457   69.932   4.8308   61.412   4.1283 8.519745 6.354473 
1 1 1   29   16   13 o   26.413   5.5274   16.794   6.7452   7.4168   12.140   20.982   8.1126   22.275   8.8471   30.551   6.6287 -8.275681 11.05488 
1 1 1   29   16   14 o   93.518   4.7650  194.078   12.341  186.169   33.291  195.338   13.287   90.412   8.9277   96.624   3.3342 -6.212273 9.529969 
1 1 1   29   16   15 o   53.351   4.4098   60.590   8.1987   64.449   17.085   59.435   9.3451   53.696   7.7144   53.007   4.2745 0.6890450 8.819537 
1 1 1   29   16   16 o  109.807   2.6816  256.216   11.806  243.598   18.788  264.449   15.177  107.262   4.2469  112.352   3.2753 -5.089813 5.363181 
1 1 1   29   16   17 o   32.343   5.2749   26.999   7.0795   12.968   12.268   34.005   8.6686   24.923   9.1302   39.764   5.2856 -14.84079 10.54978 
1 1 1   29   16   18 o   37.319   5.3227   34.801   7.3586   24.288   13.150   39.594   8.8788   31.673   9.3926   42.965   5.0104 -11.29272 10.64545 
1 1 1   29   16   19 o   23.086   5.1201   11.937   6.7332  -6.5705   12.204   20.037   8.0732   16.667   7.6771   29.506   6.7767 -12.83922 10.24021 
1 1 1   29   16   20 o   34.100   5.6202   27.583   7.3177   27.614   13.227   27.569   8.7846   33.367   9.2759   34.834   6.3484 -1.466743 11.24031 
1 1 1   29   16   21 o   36.849   6.0219   31.448   8.9885   44.465   14.170   22.684   11.627   43.223   8.2496   30.476   8.7748 12.74763 12.04379 
1 1 1   29   16   22 o   24.475   6.7888   11.756   10.054   14.218   13.195   8.3493   15.523   25.404   9.4400   23.546   9.7591 1.857674 13.57769 
1 1 1   29   16   23 o   36.142   7.2655   34.226   11.190   34.762   14.151   33.330   18.282   37.189   9.2612   35.094   11.197 2.094902 14.53102 
1 1 1   29   16   24 o   25.610   6.8831   12.094   9.9951   4.8259   12.460   25.209   16.739   20.408   8.6196   30.813   10.734 -10.40524 13.76625 
1 1 1   29   16   25 o   29.045   7.1173   18.780   10.184   11.364   12.478   33.581   17.627   23.301   9.0541   34.789   10.984 -11.48775 14.23459 
1 1 1   29   16   26 o   39.482   8.9929   51.605   16.366   53.928   17.518   35.678   45.876   45.565   9.6233   33.400   15.195 12.16544 17.98571 
1 1 1   29   16   27 o   24.926   7.1992   12.347   12.805   22.154   15.993  -5.1696   21.374   28.570   10.431   21.283   9.9253 7.287043 14.39839 
1 1 1   29   16   28 o   22.174   6.9185   4.8463   12.302   0.7244   16.389   10.166   18.619   20.382   9.1958   23.965   10.339 -3.583660 13.83708 
1 1 1   29   17    0 o  106.785   2.2666  237.047   14.089  237.047   14.089  237.047   14.089  106.785   3.2055  106.785   3.2055 0.000000 0.000000 
1 1 1   29   17    1 o   73.011   2.6168  111.448   7.8746  105.910   11.020  117.228   11.257   71.142   3.7556   74.879   3.6450 -3.736649 5.233550 
1 1 1   29   17    2 o   61.556   2.8254   79.458   7.1718   80.187   10.070   78.708   10.216   61.855   3.9472   61.257   4.0437 0.5972633 5.650830 
1 1 1   29   17    3 o   97.421   2.3370  197.924   9.3889  193.671   13.171  202.317   13.387   96.354   3.3143   98.488   3.2957 -2.133690 4.673975 
1 1 1   29   17    4 o   50.682   3.2926   54.205   6.8780   56.695   9.7589   51.746   9.6954   51.862   4.5624   49.502   4.7487 2.359722 6.585264 
1 1 1   29   17    5 o   39.307   4.0474   33.162   6.5241   35.914   9.0483   30.182   9.4156   41.102   5.3374   37.512   6.0858 3.590874 8.094753 
1 1 1   29   17    6 o   43.036   3.8188   39.314   6.7107   32.308   9.2141   47.228   9.7931   38.875   5.7467   47.197   5.0308 -8.322372 7.637679 
1 1 1   29   17    7 o   38.906   3.9278   32.430   6.2654   36.319   8.8541   28.530   8.8673   41.333   5.1937   36.478   5.8938 4.855591 7.855668 
1 1 1   29   17    8 o   94.220   2.7045  188.788   10.259  172.812   15.959  200.037   13.392   90.580   4.2718   97.860   3.3180 -7.280884 5.409007 
1 1 1   29   17    9 o   72.811   2.6215  111.127   7.8717  110.309   11.186  111.930   11.079   72.535   3.7390   73.087   3.6755 -0.5513992 5.243021 
1 1 1   29   17   10 o  110.980   2.4941  255.482   11.298  242.612   14.798  273.470   17.495  107.748   3.3300  114.212   3.7139 -6.463943 4.988207 
1 1 1   29   17   11 o   40.817   4.9352   38.275   7.7682   30.814   12.108   43.496   10.127   36.527   8.2336   45.106   5.4437 -8.579208 9.870451 
1 1 1   29   17   12 o   55.614   3.6104   67.253   7.8583   61.425   13.044   70.573   9.8457   53.367   5.9260   57.860   4.1257 -4.493229 7.220741 
1 1 1   29   17   14 o   81.840   5.3792  162.878   11.511  130.833   31.276  167.898   12.380   74.182   10.222   89.498   3.3538 -15.31547 10.75836 
1 1 1   29   17   15 o   76.309   3.5159  121.122   9.7042  131.955   19.326  117.470   11.221   77.889   6.0159   74.729   3.6408 3.160355 7.031848 
1 1 1   29   17   16 o   67.552   3.3034   97.558   8.7198   96.501   14.858   98.114   10.769   66.906   5.3844   68.198   3.8287 -1.292137 6.606863 
1 1 1   29   17   17 o   79.482   2.9974  132.400   9.2853  139.445   16.164  128.930   11.344   80.684   4.8572   78.281   3.5135 2.403290 5.994744 
1 1 1   29   17   18 o   66.959   3.3216   95.646   8.5742   97.390   15.104   94.817   10.415   66.956   5.4691   66.962   3.7711 -0.5905151E-02 6.643260 
1 1 1   29   17   19 o   67.485   3.5063   97.061   9.6110  105.499   15.190   91.427   12.411   69.694   5.2844   65.275   4.6100 4.419022 7.012644 
1 1 1   29   17   20 o   57.047   4.0514   67.819   8.6440   79.985   16.573   63.272   10.131   59.753   6.7246   54.341   4.5203 5.411209 8.102717 
1 1 1   29   17   21 o   58.712   4.5086   77.977   10.612   70.265   16.500   83.416   13.859   55.600   7.1953   61.823   5.4350 -6.223202 9.017243 
1 1 1   29   17   22 o   49.303   5.2600   58.601   9.7903   37.927   14.108   77.807   13.598   39.095   8.9431   59.510   5.5400 -20.41523 10.52005 
1 1 1   29   17   23 o   67.421   4.6557   99.663   12.306   92.192   15.011  114.968   21.486   64.521   5.6409   70.320   7.4083 -5.798759 9.311458 
1 1 1   29   17   24 o   27.267   6.7697   19.060   10.202   25.223   12.266   5.2298   18.375   31.436   9.0015   23.098   10.114 8.338537 13.53942 
1 1 1   29   17   25 o   21.030   6.5935   1.8064   11.309  -0.9403   15.164   5.2488   16.976   19.672   8.8633   22.387   9.7641 -2.715414 13.18697 
1 1 1   29   17   26 o   25.927   10.227   16.316   16.122   16.316   16.122   0.0000   0.0000   25.927   10.227  ?   ?       ?      ? 
1 1 1   29   17   27 o   29.008   10.850   23.819   17.488   23.819   17.488   0.0000   0.0000   29.008   10.850  ?   ?       ?      ? 
1 1 1   29   17   28 o   24.434   7.8102   7.3506   16.082   9.9588   27.666   6.0197   19.763   25.847   11.775   23.021   10.264 2.826281 15.62049 
1 1 1   29   18    0 f   29.372   5.8657   22.080   8.7023   22.080   8.7023   22.080   8.7023   29.372   8.2954   29.372   8.2954 0.000000 0.000000 
1 1 1   29   18    1 o   42.597   3.6445   38.569   6.3936   35.917   8.9705   41.307   9.1150   41.073   5.2953   44.121   5.0090 -3.047329 7.289059 
1 1 1   29   18    2 o   77.614   2.5581  126.091   8.1735  136.610   11.688  116.023   11.434   80.816   3.5065   74.411   3.7257 6.405396 5.116274 
1 1 1   29   18    3 o  119.679   2.3716  299.535   11.657  302.445   15.824  296.082   17.238  120.391   3.1867  118.967   3.5131 1.423325 4.743150 
1 1 1   29   18    4 o   94.093   2.5050  184.958   9.6844  181.736   13.086  188.861   14.400   93.241   3.4027   94.944   3.6774 -1.702911 5.010101 
1 1 1   29   18    5 o  147.552   2.5625  456.761   15.558  442.284   22.561  469.889   21.484  145.228   3.7665  149.876   3.4754 -4.648407 5.124965 
1 1 1   29   18    6 o  114.519   2.2795  273.709   10.759  259.652   15.063  288.346   15.372  111.496   3.2757  117.542   3.1707 -6.046242 4.558906 
1 1 1   29   18    7 o   23.697   4.9976   11.970   5.7463   18.964   8.0431   4.6783   8.2124   28.977   6.8398   18.417   7.2885 10.56023 9.995242 
1 1 1   29   18    8 o   35.821   4.3666   28.415   6.1041   39.902   8.9014   18.220   8.3865   43.331   4.9807   28.311   7.1736 15.02035 8.733137 
1 1 1   29   18    9 o   24.129   5.3018   12.886   5.8794   15.123   8.3683   10.705   8.2621   25.828   7.4464   22.429   7.5489 3.399025 10.60351 
1 1 1   29   18   10 o   28.832   5.2419   19.112   6.2586   19.693   8.4764   18.414   9.2802   29.384   7.0782   28.280   7.7337 1.103903 10.48387 
1 1 1   29   18   11 o   58.673   3.4494   73.194   7.9864   74.014   13.409   72.743   9.9424   58.650   5.5431   58.697   4.1069 -0.4714203E-01 6.898703 
1 1 1   29   18   12 o   46.098   5.5724   49.067   8.2628   47.127   17.951   49.588   9.3075   43.927   10.117   48.269   4.6752 -4.341545 11.14476 
1 1 1   29   18   13 o   23.416   6.5790   10.222   7.5577 -15.0639   26.517   12.457   7.8847   23.294   10.925   23.538   7.3331 -0.2442875 13.15806 
1 1 1   29   18   14 o   32.169   6.2033   23.763   7.3885   25.415   16.237   23.332   8.2973   32.226   10.575   32.111   6.4882 0.1148720 12.40662 
1 1 1   29   18   15 f   91.806   3.4075  170.818   12.220  210.470   21.813  152.683   14.752   98.772   5.3546   84.841   4.2157 13.93114 6.814929 
1 1 1   29   18   16 o   53.747   4.3364   65.510   8.4123   58.552   15.857   68.235   9.9240   50.844   7.5615   56.650   4.2474 -5.805759 8.672720 
1 1 1   29   18   17 o   37.990   5.0017   31.540   7.1385   37.214   12.981   29.080   8.5469   39.511   8.2330   36.469   5.6822 3.041451 10.00343 
1 1 1   29   18   18 o   19.931   5.4109   6.9013   6.6635  -5.1999   12.816   11.385   7.8009   17.411   7.9632   22.452   7.3280 -5.040991 10.82181 
1 1 1   29   18   19 o   52.101   3.9195   57.637   7.8312   63.906   14.188   54.891   9.3913   53.585   6.4198   50.617   4.4985 2.967979 7.838995 
1 1 1   29   18   20 o   71.946   3.3271  112.123   9.3888  109.332   15.796  113.647   11.675   70.753   5.4129   73.139   3.8703 -2.386795 6.654242 
1 1 1   29   18   21 o   70.537   3.8390  108.793   11.120  113.372   16.640  105.099   14.947   71.717   5.6257   69.358   5.2251 2.358543 7.677907 
1 1 1   29   18   22 o   80.859   3.8296  144.756   12.672  137.426   18.791  150.869   17.162   78.593   5.7970   83.124   5.0058 -4.530457 7.659221 
1 1 1   29   18   23 o   29.612   7.2965   21.417   10.407   17.456   12.666   29.646   18.256   26.585   9.3328   32.638   11.218 -6.053381 14.59299 
1 1 1   29   18   24 o   27.748   7.5039   19.580   11.979   20.065   17.186   19.121   16.707   27.974   10.690   27.521   10.534 0.4530964 15.00772 
1 1 1   29   18   25 o   18.715   6.4816 -22.0750   12.995  -1.9759   26.176 -28.6481   14.970   23.568   10.988   13.863   6.8775 9.704442 12.96326 
1 1 1   29   18   26 o   35.084   7.8198   38.869   13.542   45.454   16.444   24.989   23.873   40.821   9.8748   29.347   12.128 11.47407 15.63958 
1 1 1   29   18   27 o   39.064   10.475   43.433   17.223   43.433   17.223   0.0000   0.0000   39.064   10.475  ?   ?       ?      ? 
1 1 1   29   19    0 o   31.060   5.4581   23.761   8.5571   23.761   8.5571   23.761   8.5571   31.060   7.7189   31.060   7.7189 0.000000 0.000000 
1 1 1   29   19    1 o   94.874   2.5016  188.528   9.7427  189.242   13.172  187.666   14.476   95.143   3.3567   94.604   3.7100 0.5390472 5.003209 
1 1 1   29   19    2 f  124.765   2.4906  325.794   12.815  331.518   18.317  320.308   17.934  125.834   3.5293  123.696   3.5153 2.138390 4.981297 
1 1 1   29   19    3 o   70.101   2.8154  102.916   8.1240   95.968   11.094  110.948   11.929   67.560   3.9815   72.641   3.9816 -5.081764 5.630777 
1 1 1   29   19    4 o   25.593   5.3013   14.632   6.0244   11.552   8.3252   18.017   8.7287   23.088   7.5719   28.098   7.4215 -5.009937 10.60250 
1 1 1   29   19    5 o   63.067   2.8627   83.689   7.4325   76.998   10.373   90.749   10.655   60.441   4.1611   65.692   3.9325 -5.251320 5.725311 
1 1 1   29   19    6 o   52.347   3.1948   58.210   6.8634   51.796   9.7197   64.589   9.6930   49.383   4.7721   55.312   4.2489 -5.929340 6.389534 
1 1 1   29   19    7 o   21.455   4.8351   8.3145   5.6140  -0.5634   7.9036   17.355   7.9757   15.322   6.6731   27.587   6.9987 -12.26445 9.670128 
1 1 1   29   19    8 o   22.579   5.0735   10.426   5.8054   3.5322   8.2066   17.330   8.2135   17.655   7.1821   27.503   7.1679 -9.847328 10.14705 
1 1 1   29   19    9 o   95.211   2.5600  190.225   9.9806  188.182   13.310  192.848   15.085   94.730   3.4067   95.692   3.8222 -0.9619370 5.120014 
1 1 1   29   19   10 o   17.001   5.2242  -3.3358   6.8029   6.4625   11.348  -8.8324   8.4994   21.171   8.5045   12.832   6.0697 8.339157 10.44836 
1 1 1   29   19   11 o   79.592   3.1589  135.073   10.223  131.646   15.712  137.588   13.462   78.502   4.8528   80.682   4.0454 -2.179550 6.317783 
1 1 1   29   19   12 o   56.087   4.1257   66.598   9.5440   0.0000   0.0000   66.598   9.5440  ?   ?    56.087   4.1257      ?      ? 
1 1 1   29   19   13 o  114.635   3.0706  282.578   13.105  271.024   24.171  287.389   15.597  112.201   5.2231  117.071   3.2301 -4.869965 6.141197 
1 1 1   29   19   14 o   41.002   5.4009   38.087   7.7749   39.828   15.440   37.496   8.9992   40.327   9.4483   41.677   5.2353 -1.350121 10.80180 
1 1 1   29   19   15 o   40.569   4.9669   37.995   7.5363   35.893   13.055   39.046   9.2296   38.697   8.4188   42.440   5.2728 -3.743492 9.933724 
1 1 1   29   19   16 o   42.676   5.1472   47.435   7.6818   28.509   13.381   56.738   9.3818   33.851   9.2988   51.501   4.4167 -17.65081 10.29447 
1 1 1   29   19   17 o   48.028   4.1839   48.912   7.7141   55.955   14.036   45.864   9.2335   49.923   6.8170   46.134   4.8527 3.788597 8.367784 
1 1 1   29   19   18 f   16.720   5.1031   0.4499   6.5747 -10.7084   12.345   4.8679   7.7680   15.562   7.3471   17.878   7.0843 -2.315406 10.20627 
1 1 1   29   19   19 o   31.081   5.8683   22.343   7.1701   27.073   13.224   20.373   8.5333   32.765   9.3343   29.396   7.1147 3.368834 11.73664 
1 1 1   29   19   20 o   75.789   3.1477  117.273   9.4779  148.703   16.292  101.194   11.653   82.822   4.7694   68.755   4.1091 14.06649 6.295424 
1 1 1   29   19   21 o   19.201   5.9604   1.1244   8.7323   3.7516   14.550  -0.3546   10.917   20.997   9.0991   17.405   7.7015 3.591480 11.92081 
1 1 1   29   19   22 o   64.653   5.0989   96.720   13.454   94.311   17.734   99.985   20.650   64.209   6.6966   65.097   7.6911 -0.8880234 10.19789 
1 1 1   29   19   23 o   19.289   6.1704  -1.8929   9.9608  -4.7384   12.299   3.5316   16.981   16.793   7.7248   21.785   9.6241 -4.992218 12.34086 
1 1 1   29   19   24 o   20.108   6.3471  -2.0912   11.166 -13.3002   15.349   10.509   16.274   16.606   7.9398   23.610   9.9047 -7.003382 12.69429 
1 1 1   29   19   25 f   63.155   6.1468  104.747   14.310  120.044   18.354   81.031   22.854   72.333   6.1521   53.978   10.644 18.35530 12.29368 
1 1 1   29   20    0 o   22.766   6.4782   15.429   8.3793   15.429   8.3793   15.429   8.3793   22.766   9.1616   22.766   9.1616 0.000000 0.000000 
1 1 1   29   20    1 o   83.600   2.7038  147.043   9.3207  151.535   13.289  142.695   13.076   84.869   3.7965   82.332   3.8508 2.536224 5.407580 
1 1 1   29   20    2 f   38.914   4.0542   32.667   6.4768   28.755   9.0200   36.830   9.3060   36.426   6.0038   41.401   5.4499 -4.975082 8.108431 
1 1 1   29   20    3 o   81.984   2.6139  140.976   8.8145  136.994   11.965  145.701   13.034   80.765   3.5920   83.203   3.7983 -2.438438 5.227749 
1 1 1   29   20    4 o   68.926   2.7590  100.178   7.8380   98.203   11.220  102.061   10.954   68.229   3.9871   69.622   3.8147 -1.393394 5.518046 
1 1 1   29   20    5 o  117.891   2.2728  290.949   11.051  294.564   15.642  287.347   15.614  118.632   3.1970  117.151   3.2314 1.481125 4.545623 
1 1 1   29   20    6 o   43.111   4.4150   42.942   7.1944   50.108   9.3676   32.636   11.234   48.511   4.6819   37.711   7.4866 10.79977 8.830025 
1 1 1   29   20    7 o  133.127   2.4753  370.481   13.406  361.935   17.484  382.672   20.883  131.455   3.2248  134.799   3.7562 -3.343643 4.950595 
1 1 1   29   20    8 o   65.124   2.9939   89.305   8.0063   95.643   12.026   84.259   10.730   67.141   4.3426   63.106   4.1225 4.034851 5.987792 
1 1 1   29   20    9 o   60.840   3.5960   78.933   8.8073   81.614   14.162   77.242   11.247   61.433   5.5894   60.248   4.5260 1.185326 7.192060 
1 1 1   29   20   10 o   15.817   5.0555  -3.2783   6.8496  -5.9416   11.459  -1.7976   8.5440   16.336   7.4931   15.297   6.7887 1.039449 10.11105 
1 1 1   29   20   11 o   25.363   6.4943   11.177   7.3070   21.432   16.458   8.6595   8.1548   30.019   10.629   20.708   7.4654 9.311636 12.98860 
1 1 1   29   20   12 o   35.886   6.5423   37.214   8.2050   12.804   25.054   40.146   8.6838   28.534   12.145   43.238   4.8694 -14.70480 13.08453 
1 1 1   29   20   13 f   18.214   5.3313   3.1194   6.8339 -12.4356   13.973   8.0104   7.8350   16.416   7.7702   20.012   7.3018 -3.596342 10.66260 
1 1 1   29   20   14 o   21.193   5.2634   8.3594   7.1830 -17.6209   14.598   16.659   8.2509   15.756   7.5878   26.630   7.2963 -10.87310 10.52671 
1 1 1   29   20   15 o   15.025   4.9028  -4.7438   6.5927  -7.1703   11.961  -3.6849   7.9013   16.217   7.5157   13.833   6.2979 2.384200 9.805600 
1 1 1   29   20   16 o   27.024   5.6951   18.319   7.0055   10.770   12.552   21.734   8.4428   23.465   9.0912   30.583   6.8620 -7.117828 11.39028 
1 1 1   29   20   17 o   50.596   4.9309   66.648   8.2526   39.855   14.586   79.263   10.009   40.169   9.0244   61.022   3.9766 -20.85293 9.861731 
1 1 1   29   20   18 o   24.490   6.6281   11.049   8.7195   19.746   16.011   7.3816   10.396   28.333   10.423   20.647   8.1912 7.686262 13.25620 
1 1 1   29   20   19 o   19.076   5.3535   4.9329   6.9721  -7.5850   12.160   11.063   8.5097   16.050   7.4853   22.103   7.6558 -6.053137 10.70704 
1 1 1   29   20   20 o   20.393   5.5060   7.5197   7.1372  -5.1104   12.769   13.259   8.6075   17.128   7.8760   23.658   7.6964 -6.529827 11.01204 
1 1 1   29   20   21 o   26.426   6.5357   17.265   8.7607   18.752   12.929   16.003   11.912   27.242   9.4365   25.611   9.0452 1.630398 13.07148 
1 1 1   29   20   22 o   24.849   6.5016   10.732   10.859   27.688   14.431 -11.4063   16.489   31.950   9.9153   17.749   8.4126 14.20112 13.00327 
1 1 1   29   20   23 o   67.844   5.1653  107.941   14.341   92.636   19.113  127.660   21.694   62.242   7.4452   73.445   7.1617 -11.20324 10.33058 
1 1 1   29   20   24 o   48.292   6.3964   59.208   12.391   48.756   16.430   72.994   18.870   42.617   9.5804   53.966   8.4778 -11.34937 12.79282 
1 1 1   29   21    0 o   51.216   3.5456   56.628   10.359   56.628   10.359   56.628   10.359   51.216   5.0142   51.216   5.0142 0.000000 0.000000 
1 1 1   29   21    1 o  122.725   2.8714  319.094   14.148  321.461   18.104  315.380   22.676  123.667   3.5494  121.783   4.5146 1.883995 5.742804 
1 1 1   29   21    2 o   26.222   5.6308   16.380   6.8975   20.362   8.6684   9.5067   11.388   29.731   7.1555   22.713   8.6962 7.017614 11.26163 
1 1 1   29   21    3 o   67.413   2.9564   95.723   8.1937  102.833   12.199   89.880   11.060   69.653   4.2464   65.173   4.1144 4.480614 5.912744 
1 1 1   29   21    4 o   74.134   2.6461  115.817   8.0873  111.599   11.409  120.077   11.466   72.751   3.8021   75.516   3.6813 -2.764732 5.292273 
1 1 1   29   21    5 o   28.931   5.1467   19.389   6.2145   15.219   8.7530   23.628   8.8248   25.704   7.6722   32.159   6.8624 -6.454887 10.29347 
1 1 1   29   21    6 o   31.729   4.8194   23.038   6.1221   21.150   8.6780   24.909   8.6379   30.300   7.0727   33.158   6.5485 -2.857899 9.638761 
1 1 1   29   21    7 o   56.820   3.0646   68.657   7.1700   64.069   10.118   73.285   10.162   54.858   4.4717   58.782   4.1916 -3.924770 6.129102 
1 1 1   29   21    8 o   46.758   4.5296   52.658   7.6397   35.858   12.414   62.900   9.6928   39.132   7.9623   54.385   4.3212 -15.25331 9.059292 
1 1 1   29   21    9 o   60.803   3.4992   77.310   8.6409   92.826   13.764   67.218   11.101   65.630   5.0850   55.976   4.8083 9.653885 6.998333 
1 1 1   29   21   10 o  106.409   3.4404  245.593   14.081  237.700   24.561  249.458   17.187  104.290   5.7100  108.528   3.8396 -4.237434 6.880858 
1 1 1   29   21   11 o   29.817   6.5604   23.297   8.0487   8.0605   22.956   25.432   8.5943   26.279   11.409   33.356   6.4805 -7.076941 13.12081 
1 1 1   29   21   12 o   66.596   3.6680   91.867   8.9441  105.889   17.676   87.042   10.370   69.162   6.1966   64.030   3.9265 5.131805 7.335914 
1 1 1   29   21   13 o   34.844   5.7676   28.825   7.5456   28.112   14.680   29.081   8.7967   33.312   9.9340   36.377   5.8632 -3.065220 11.53522 
1 1 1   29   21   14 o   29.701   6.6798   21.104   8.9301   24.983   14.904   18.932   11.154   31.419   10.119   27.984   8.7224 3.434429 13.35961 
1 1 1   29   21   15 f   50.246   3.9777   51.826   7.8577   67.911   13.910   44.287   9.5227   55.335   6.0949   45.158   5.1128 10.17728 7.955403 
1 1 1   29   21   16 o   38.712   4.9354   31.204   7.3401   46.367   13.271   24.521   8.8105   45.006   7.1493   32.419   6.8060 12.58637 9.870864 
1 1 1   29   21   17 o   36.157   5.3748   34.444   7.4014   21.934   13.077   40.341   8.9779   29.335   9.4818   42.979   5.0647 -13.64364 10.74965 
1 1 1   29   21   18 o   53.671   3.9571   64.895   8.1169   60.557   14.109   67.040   9.9236   51.549   6.6360   55.792   4.3125 -4.242790 7.914201 
1 1 1   29   21   19 o   70.476   3.3267  108.319   9.2522  106.510   15.387  109.344   11.579   69.467   5.3706   71.485   3.9273 -2.018761 6.653339 
1 1 1   29   21   20 o   55.484   4.0249   71.305   8.5825   60.166   14.268   77.622   10.744   51.066   6.7742   59.902   4.3486 -8.836689 8.049788 
1 1 1   29   21   21 o   61.084   5.0200   86.910   11.809   85.508   14.380   89.814   20.695   61.711   5.6499   60.457   8.2994 1.254467 10.04000 
1 1 1   29   21   22 o   22.493   6.6765   8.2880   10.900   14.601   14.192  -0.7927   17.021   24.696   9.6393   20.291   9.2405 4.404409 13.35299 
1 1 1   29   21   23 o   37.039   8.0273   41.409   13.615   34.218   19.009   48.985   19.510   33.439   11.449   40.639   11.255 -7.199314 16.05466 
1 1 1   29   22    0 o   33.774   5.4373   27.759   9.3356   27.759   9.3356   27.759   9.3356   33.774   7.6895   33.774   7.6895 0.000000 0.000000 
1 1 1   29   22    1 o   89.173   2.6786  167.880   9.8495  171.639   14.104  164.302   13.761   90.144   3.7934   88.203   3.7828 1.941910 5.357157 
1 1 1   29   22    2 o   90.599   2.7481  173.628   10.261  174.175   14.251  173.039   14.786   90.794   3.8057   90.404   3.9655 0.3894653 5.496233 
1 1 1   29   22    3 o   70.297   2.8982  105.214   8.3605  100.307   12.269  109.467   11.423   68.646   4.3335   71.949   3.8494 -3.302963 5.796301 
1 1 1   29   22    4 o   46.290   4.3792   50.238   7.5162   38.161   12.148   57.729   9.5675   40.568   7.5378   52.013   4.4599 -11.44520 8.758336 
1 1 1   29   22    5 o   52.223   3.2853   58.437   7.0494   64.981   10.081   52.174   9.8615   55.173   4.4299   49.272   4.8527 5.901897 6.570574 
1 1 1   29   22    6 o   21.572   5.3424   9.8898   5.9220   7.8776   8.4237   11.856   8.3271   20.200   7.5353   22.944   7.5752 -2.744101 10.68475 
1 1 1   29   22    7 o   53.613   3.7473   64.056   7.8101   56.719   12.978   68.222   9.7793   50.637   6.2139   56.590   4.1899 -5.952957 7.494524 
1 1 1   29   22    8 o   59.765   3.7594   79.357   8.9730   68.774   13.930   86.862   11.731   55.831   6.0494   63.699   4.4651 -7.867638 7.518785 
1 1 1   29   22    9 o   65.902   5.1253   92.867   10.942  108.237   25.471   89.388   12.117   67.230   9.1856   64.573   4.5496 2.657539 10.25054 
1 1 1   29   22   10 o   41.791   7.2325   46.609   10.445   38.232   25.453   48.305   11.453   36.729   13.195   46.852   5.9270 -10.12340 14.46493 
1 1 1   29   22   11 o   91.560   3.2172  175.694   10.897  189.287   20.890  170.613   12.773   93.186   5.4354   89.934   3.4435 3.251694 6.434396 
1 1 1   29   22   12 f   28.656   6.2866   19.529   7.4945   19.767   15.466   19.456   8.5677   28.578   10.283   28.733   7.2343 -0.1550941 12.57313 
1 1 1   29   22   13 f   89.301   3.3911  177.237   10.844  161.392   20.871  183.095   12.691   85.421   5.9240   93.181   3.3022 -7.760544 6.782162 
1 1 1   29   22   14 o   16.476   5.2150  -1.4939   6.7428  -0.5191   12.206  -1.9221   8.0891   18.325   8.1243   14.626   6.5406 3.699384 10.42996 
1 1 1   29   22   15 o  108.217   2.7803  256.054   12.019  220.154   18.636  281.621   15.727  101.018   4.4728  115.415   3.3037 -14.39774 5.560663 
1 1 1   29   22   16 o   38.501   5.3043   37.499   7.4987   28.932   13.368   41.432   9.0581   33.479   9.3316   43.522   5.0461 -10.04292 10.60860 
1 1 1   29   22   17 o   79.744   3.0781  136.862   9.5908  138.075   16.410  136.233   11.820   79.445   5.0081   80.043   3.5802 -0.5982437 6.156210 
1 1 1   29   22   18 o   39.812   5.0621   36.588   7.6068   39.666   13.406   35.126   9.2380   39.929   8.4061   39.696   5.6424 0.2329178 10.12424 
1 1 1   29   22   19 o   31.956   5.8647   26.631   7.6423   22.682   13.349   28.556   9.3209   29.213   9.5884   34.699   6.7559 -5.486004 11.72949 
1 1 1   29   22   20 o   25.928   6.5384   16.494   8.9690   23.002   13.369   11.168   12.094   29.199   9.5964   22.657   8.8833 6.542141 13.07684 
1 1 1   29   22   21 o   30.082   6.5861   15.697   10.445  -1.7068   12.808   50.255   18.049   17.813   8.0746   42.350   10.407 -24.53718 13.17228 
1 1 1   29   22   22 o   25.886   7.6697   15.796   13.728   15.152   20.849   16.289   18.240   25.897   11.052   25.875   10.637 0.2223587E-01 15.33930 
1 1 1   29   23    0 o   9.8050   4.7231  -4.1296   8.3060  -4.1296   8.3060  -4.1296   8.3060   9.8050   6.6795   9.8050   6.6795 0.000000 0.000000 
1 1 1   29   23    1 o   28.898   5.0827   19.821   6.1137   15.546   8.8838   23.667   8.4265   25.706   7.7422   32.090   6.5875 -6.384001 10.16543 
1 1 1   29   23    2 o   17.087   4.9189   2.3820   5.7558  -2.8809   8.2020   7.4885   8.0793   14.432   6.5089   19.742   7.3767 -5.310015 9.837728 
1 1 1   29   23    3 o   54.375   3.2801   63.159   7.3373   69.005   10.822   58.185   9.9821   56.697   4.6278   52.053   4.6496 4.644043 6.560107 
1 1 1   29   23    4 o   61.147   3.0785   80.013   7.7478   77.523   11.206   82.293   10.724   60.153   4.5166   62.141   4.1844 -1.988117 6.157007 
1 1 1   29   23    5 o  113.555   2.7047  273.389   12.613  273.908   17.079  272.766   18.705  113.821   3.6381  113.290   4.0032 0.5309448 5.409413 
1 1 1   29   23    6 o   40.016   5.6006   37.660   8.7634   38.950   13.876   36.804   11.303   40.124   8.6403   39.908   7.1284 0.2151413 11.20126 
1 1 1   29   23    7 o   68.989   3.5155   99.034   9.4401  114.529   16.787   91.867   11.416   72.350   5.6255   65.629   4.2176 6.721130 7.030951 
1 1 1   29   23    8 o   91.767   3.4047  182.387   12.383  178.120   20.378  184.885   15.591   90.334   5.4695   93.199   4.0561 -2.865105 6.809334 
1 1 1   29   23    9 o   32.150   7.4974   24.536   9.3476   27.602   25.383   24.055   10.054   32.566   12.837   31.734   7.7489 0.8321705 14.99471 
1 1 1   29   23   10 o   21.412   6.0415   7.8861   7.3394   6.9288   14.682   8.2050   8.4742   22.516   9.4246   20.308   7.5614 2.207474 12.08294 
1 1 1   29   23   11 o   51.313   4.8709   62.278   8.4290   55.687   16.559   64.584   9.7925   47.761   8.7279   54.866   4.3274 -7.105446 9.741777 
1 1 1   29   23   12 o   41.491   5.6939   44.931   7.9931   33.847   16.159   48.522   9.1972   35.649   10.368   47.334   4.7111 -11.68459 11.38777 
1 1 1   29   23   13 o   61.951   4.0296   85.400   9.2312   84.403   17.227   85.802   10.933   60.690   6.8823   63.212   4.1936 -2.521336 8.059294 
1 1 1   29   23   14 o   59.954   3.8501   84.752   8.5758   63.895   14.567   95.816   10.609   52.915   6.6745   66.992   3.8397 -14.07718 7.700121 
1 1 1   29   23   15 o   47.255   4.6312   52.449   8.0184   47.458   14.018   54.875   9.7754   44.269   7.9710   50.242   4.7174 -5.973083 9.262341 
1 1 1   29   23   16 o   70.093   3.5819  107.071   10.296  116.059   15.605  100.142   13.701   72.548   5.2152   67.638   4.9114 4.909904 7.163802 
1 1 1   29   23   17 o   35.101   5.6396   27.519   7.6329   42.362   13.673   20.799   9.1998   41.169   8.3385   29.033   7.5955 12.13584 11.27927 
1 1 1   29   23   18 o   29.234   6.1229   20.135   7.5045   29.600   13.455   15.861   9.0414   33.222   9.3984   25.245   7.8506 7.977257 12.24588 
1 1 1   29   23   19 o   24.826   6.1166   13.961   7.2759   21.410   13.005   10.568   8.7783   28.224   9.4713   21.427   7.7424 6.796503 12.23312 
1 1 1   29   23   20 o   36.831   6.8966   35.249   11.001   22.123   14.193   55.010   17.413   28.382   9.8837   45.280   9.6210 -16.89840 13.79317 
1 1 1   29   24    0 f   26.430   7.6784   21.804   11.701   21.804   11.701   21.804   11.701   26.430   10.859   26.430   10.859 0.000000 0.000000 
1 1 1   29   24    1 o   59.436   3.5047   77.578   8.4206   84.888   11.244   68.242   12.707   63.003   4.3271   55.869   5.5144 7.133335 7.009448 
1 1 1   29   24    2 o   29.175   5.2202   19.933   6.3246   24.240   9.3172   16.253   8.6130   32.138   7.2070   26.212   7.5538 5.925758 10.44030 
1 1 1   29   24    3 o   45.776   3.9033   46.910   7.1355   35.195   10.312   57.671   9.8838   39.768   6.2870   51.784   4.6277 -12.01590 7.806564 
1 1 1   29   24    4 o   30.625   5.1872   22.237   6.4721   20.716   9.3345   23.645   8.9814   29.463   7.6234   31.787   7.0365 -2.324186 10.37438 
1 1 1   29   24    5 o   35.168   5.6472   33.594   7.7791   18.520   14.675   39.485   9.1741   27.758   10.014   42.577   5.2242 -14.81943 11.29447 
1 1 1   29   24    6 o   22.532   5.9585   10.413   6.9548   10.241   13.306   10.478   8.1578   23.325   9.2627   21.738   7.4977 1.586643 11.91694 
1 1 1   29   24    7 o   22.339   6.1360   9.7741   7.7638   8.0339   14.102   10.531   9.3001   22.619   9.3322   22.058   7.9694 0.5608997 12.27197 
1 1 1   29   24    8 o   27.327   6.7429   19.246   8.9639   0.3969   24.381   22.192   9.6390   24.339   11.075   30.315   7.6957 -5.975323 13.48585 
1 1 1   29   24    9 o   81.555   5.0446  150.306   11.264  155.777   30.897  149.468   12.097   79.144   9.4653   83.965   3.4931 -4.820862 10.08926 
1 1 1   29   24   10 o  112.238   3.3253  266.555   15.393   0.0000   0.0000  266.555   15.393  ?   ?   112.238   3.3253      ?      ? 
1 1 1   29   24   11 o   67.134   3.7816   97.239   9.3833  104.059   17.916   94.662   11.015   67.786   6.4082   66.482   4.0171 1.304329 7.563192 
1 1 1   29   24   12 o  101.075   3.2427  228.133   12.005  205.249   22.233  237.549   14.262   96.178   5.6048  105.972   3.2631 -9.793312 6.485494 
1 1 1   29   24   13 o   21.987   5.9476   9.2085   6.9849   13.778   12.899   7.3129   8.3085   24.540   9.2886   19.435   7.4310 5.105021 11.89530 
1 1 1   29   24   14 o   32.626   5.7563   25.759   7.2596   28.820   13.267   24.450   8.6733   33.142   9.3172   32.111   6.7626 1.030907 11.51269 
1 1 1   29   24   15 o   45.048   4.8283   48.559   8.2004   43.651   13.590   51.369   10.284   41.928   8.1521   48.169   5.1762 -6.241436 9.656621 
1 1 1   29   24   16 o   29.809   5.9571   22.891   7.4457   22.219   12.886   23.228   9.1228   28.836   9.4185   30.783   7.2967 -1.947012 11.91428 
1 1 1   29   24   17 o   29.386   6.3247   22.485   8.2081   24.945   13.137   20.909   10.512   30.314   9.4692   28.457   8.3871 1.856838 12.64949 
1 1 1   29   24   18 o   55.316   4.4067   71.765   9.7730   62.005   14.879   79.171   12.961   51.125   7.0560   59.506   5.2811 -8.380600 8.813467 
1 1 1   29   25    0 o   15.953   6.2406   8.1783   8.4986   8.1783   8.4986   8.1783   8.4986   15.953   8.8256   15.953   8.8256 0.000000 0.000000 
1 1 1   29   25    1 o   49.677   3.4459   53.561   7.0437   58.745   10.160   48.764   9.7738   52.061   4.7318   47.293   5.0107 4.767349 6.891784 
1 1 1   29   25    2 o   16.105   4.8986   1.0527   5.8846   1.9262   8.3045   0.1718   8.3397   16.504   7.0075   15.706   6.8470 0.7980194 9.797256 
1 1 1   29   25    3 o   31.514   5.1691   23.571   6.5969   27.393   9.7072   20.291   8.9926   34.007   7.1478   29.020   7.4692 4.986925 10.33826 
1 1 1   29   25    4 o   55.177   4.0830   67.372   8.2991   68.182   15.677   67.057   9.7821   54.492   6.9754   55.862   4.2457 -1.369846 8.165964 
1 1 1   29   25    5 o   19.707   6.2119   2.8502   7.4316  -3.1302   21.587   3.6544   7.9154   22.315   10.253   17.098   7.0156 5.216633 12.42386 
1 1 1   29   25    6 o   26.772   6.8463   16.916   8.2570   13.857   21.651   17.436   8.9320   26.748   11.333   26.796   7.6838 -0.4763222E-01 13.69265 
1 1 1   29   25    7 o   79.015   4.9281  143.677   12.163  142.329   28.265  143.984   13.475   76.015   9.0154   82.016   3.9834 -6.001266 9.856185 
1 1 1   29   25    8 o   28.857   6.9445   21.709   8.8626   11.882   24.296   23.217   9.5185   26.748   11.673   30.967   7.5262 -4.218519 13.88898 
1 1 1   29   25    9 o   97.890   3.1183  197.374   11.199  228.932   22.104  186.476   12.990  101.972   5.2557   93.807   3.3574 8.165375 6.236554 
1 1 1   29   25   10 o   30.944   5.6196   26.869   7.5845   11.128   15.191   32.095   8.7536   23.899   9.7524   37.990   5.5867 -14.09069 11.23923 
1 1 1   29   25   11 o   50.354   5.0235   62.468   8.4489   52.671   16.409   66.002   9.8558   45.467   9.0680   55.240   4.3258 -9.773617 10.04700 
1 1 1   29   25   12 o   33.977   5.6092   27.369   7.3370   33.184   12.965   24.630   8.8991   35.898   8.8200   32.057   6.9324 3.840839 11.21835 
1 1 1   29   25   13 o   23.497   5.8464   13.549   7.0939   8.7507   12.612   15.769   8.5798   21.731   8.8789   25.264   7.6084 -3.532991 11.69284 
1 1 1   29   25   14 o   40.131   4.9477   37.445   7.6773   41.593   12.950   35.198   9.5331   40.881   7.9669   39.381   5.8693 1.500149 9.895479 
1 1 1   29   25   15 o   43.830   5.0034   48.593   7.9367   37.399   13.471   54.544   9.8226   37.905   8.7877   49.754   4.7866 -11.84879 10.00677 
1 1 1   29   25   16 o   35.536   5.3683   35.679   7.8611   16.261   13.025   46.804   9.8592   25.281   9.3819   45.791   5.2203 -20.51012 10.73651 
1 1 1   29   26    0 f   39.311   4.4300   35.504   9.3847   35.504   9.3847   35.504   9.3847   39.311   6.2649   39.311   6.2649 0.000000 0.000000 
1 1 1   29   26    1 o   55.626   3.2252   67.159   7.3605   59.113   10.336   75.440   10.485   52.087   4.8110   59.164   4.2967 -7.076447 6.450377 
1 1 1   29   26    2 o   21.848   5.4567   10.757   6.1345   10.307   8.8088   11.181   8.5482   21.579   7.7613   22.118   7.6724 -0.5384979 10.91345 
1 1 1   29   26    3 o   25.539   5.6890   16.448   6.9482   10.093   11.699   19.911   8.6365   22.351   8.7442   28.728   7.2800 -6.376287 11.37800 
1 1 1   29   26    4 o   33.392   5.3096   30.117   7.1698   16.434   12.545   36.754   8.7374   25.913   9.2684   40.871   5.1832 -14.95805 10.61925 
1 1 1   29   26    5 o   26.279   6.1605   15.355   7.1258   22.824   13.691   12.580   8.3451   29.501   9.7120   23.057   7.5819 6.443773 12.32105 
1 1 1   29   26    6 o   23.771   6.6793   11.618   7.8734   7.6743   22.136   12.189   8.4243   24.799   10.970   22.743   7.6228 2.055859 13.35865 
1 1 1   29   26    7 o   24.001   7.0055   9.5487   8.3370   18.265   22.754   8.1972   8.9601   27.826   11.695   20.175   7.7162 7.651335 14.01103 
1 1 1   29   26    8 o   72.730   3.5832  115.116   9.5563  120.115   18.350  113.255   11.194   72.714   6.1185   72.746   3.7309 -0.3172302E-01 7.166327 
1 1 1   29   26    9 o   64.709   3.8307   94.335   9.1311   90.840   17.002   95.752   10.825   62.700   6.5743   66.717   3.9339 -4.016598 7.661404 
1 1 1   29   26   10 o   55.094   4.2791   69.942   8.5856   66.854   16.167   71.155   10.132   52.937   7.4046   57.251   4.2910 -4.314888 8.558132 
1 1 1   29   26   11 o   98.741   2.9157  217.427   11.366  183.448   17.976  240.056   14.670   91.320   4.7728  106.161   3.3504 -14.84074 5.831373 
1 1 1   29   26   12 o   24.204   5.0997   14.656   7.2141  -7.3313   12.786   24.924   8.7378   16.232   7.6045   32.177   6.7971 -15.94516 10.19944 
1 1 1   29   26   13 o   45.511   5.9574   57.265   9.0680   41.758   17.951   62.578   10.507   37.744   10.913   53.279   4.7816 -15.53467 11.91476 
1 1 1   29   27    0 o   14.590   6.0432   6.3546   8.6248   6.3546   8.6248   6.3546   8.6248   14.590   8.5463   14.590   8.5463 0.000000 0.000000 
1 1 1   29   27    1 o   16.641   4.9815   2.4580   5.9363   3.9463   8.2763   0.8810   8.5193   17.308   7.1459   15.974   6.9425 1.334381 9.963058 
1 1 1   29   27    2 o   44.436   4.3803   44.467   7.6468   47.247   13.042   43.011   9.4394   44.840   7.0522   44.032   5.1977 0.8085861 8.760689 
1 1 1   29   27    3 o   72.905   3.1068  115.502   9.0064  115.835   14.807  115.306   11.347   72.477   4.9533   73.332   3.7516 -0.8545914 6.213651 
1 1 1   29   27    4 o   68.374   3.2430   98.597   8.7839  115.347   15.057   89.956   10.815   72.203   5.0560   64.545   4.0625 7.658409 6.485972 
1 1 1   29   27    5 o   52.501   4.9407   62.111   8.7658   69.648   19.002   60.074   9.8799   52.585   8.7612   52.417   4.5700 0.1681557 9.881455 
1 1 1   29   27    6 o   33.431   6.0378   33.357   8.8186   14.330   18.247   39.156   10.073   25.333   10.547   41.529   5.8810 -16.19601 12.07564 
1 1 1   29   27    7 o   17.516   5.4453   0.5692   7.1634   4.9147   12.468  -1.5721   8.7521   19.961   8.5333   15.070   6.7668 4.890281 10.89065 
1 1 1   29   27    8 o   24.810   5.3663   16.291   7.0308   1.5580   12.509   23.095   8.5006   18.713   8.2637   30.908   6.8484 -12.19563 10.73269 
1 1 1   29   27    9 o   17.373   5.3342   1.9326   6.7499   3.2572   11.655   1.2642   8.2797   18.862   8.1589   15.884   6.8737 2.978044 10.66843 
1 1 1   29   27   10 f   70.935   3.3276  113.602   9.1559  100.688   15.252  120.878   11.448   66.848   5.5319   75.023   3.6998 -8.174187 6.655112 
1 1 1   29   28    0 o  126.964   2.5712  339.845   19.006  339.845   19.006  339.845   19.006  126.964   3.6362  126.964   3.6362 0.000000 0.000000 
1 1 1   29   28    1 o   63.445   3.3727   87.292   8.5385   94.413   14.166   83.228   10.701   64.980   5.2856   61.909   4.1908 3.070290 6.745417 
1 1 1   29   28    2 o   38.061   5.2362   37.170   7.5619   28.798   12.631   41.847   9.4404   32.866   9.0372   43.255   5.2916 -10.38987 10.47243 
1 1 1   29   28    3 o   52.073   4.0904   64.557   8.1496   50.308   13.212   73.307   10.354   46.144   6.9421   58.002   4.3281 -11.85786 8.180748 
1 1 1   29   28    4 o   58.041   4.7632   79.687   9.2062   76.695   19.501   80.545   10.443   55.159   8.5721   60.924   4.1560 -5.765415 9.526419 
1 1 1   29   28    5 o   25.276   6.6857   12.957   7.8301   25.475   17.634   9.8824   8.7388   29.624   10.932   20.927   7.6999 8.697025 13.37138 
1 1 1   30    0    0 o   24.976   7.9331   18.885   12.351   18.885   12.351   18.885   12.351   24.976   11.219   24.976   11.219 0.000000 0.000000 
1 1 1   30    0    1 o   21.612   6.5510   13.967   8.4465   13.967   8.4465   13.967   8.4465   21.612   9.2645   21.612   9.2645 0.000000 0.000000 
1 1 1   30    0    2 o   37.165   4.6740   31.352   9.1769   31.352   9.1769   31.352   9.1769   37.165   6.6101   37.165   6.6101 0.000000 0.000000 
1 1 1   30    0    3 o   7.2130   3.6844 -15.0089   8.0056 -15.0089   8.0056 -15.0089   8.0056   7.2130   5.2106   7.2130   5.2106 0.000000 0.000000 
1 1 1   30    0    4 o  140.909   2.2083  411.290   18.130  411.290   18.130  411.290   18.130  140.909   3.1230  140.909   3.1230 0.000000 0.000000 
1 1 1   30    0    5 o   80.374   2.5254  134.540   11.786  134.540   11.786  134.540   11.786   80.374   3.5714   80.374   3.5714 0.000000 0.000000 
1 1 1   30    0    6 f  117.157   2.2600  284.652   15.418  284.652   15.418  284.652   15.418  117.157   3.1962  117.157   3.1962 0.000000 0.000000 
1 1 1   30    0    7 o   88.646   2.4587  163.497   12.668  163.497   12.668  163.497   12.668   88.646   3.4771   88.646   3.4771 0.000000 0.000000 
1 1 1   30    0    8 o   54.962   3.1117   63.933   9.8285   63.933   9.8285   63.933   9.8285   54.962   4.4006   54.962   4.4006 0.000000 0.000000 
1 1 1   30    0    9 o   24.583   6.3492   16.948   8.3918   16.948   8.3918   16.948   8.3918   24.583   8.9792   24.583   8.9792 0.000000 0.000000 
1 1 1   30    0   10 o   32.376   6.0233   26.103   9.8277   26.103   9.8277   26.103   9.8277   32.376   8.5182   32.376   8.5182 0.000000 0.000000 
1 1 1   30    0   11 o   11.362   5.3909  -3.5508   10.046  -3.5508   10.046  -3.5508   10.046   11.362   7.6239   11.362   7.6239 0.000000 0.000000 
1 1 1   30    0   12 o   12.935   5.8858   0.5420   10.201   0.5420   10.201   0.5420   10.201   12.935   8.3238   12.935   8.3238 0.000000 0.000000 
1 1 1   30    0   13 o  142.737   2.5014  423.170   20.797  423.170   20.797  423.170   20.797  142.737   3.5375  142.737   3.5375 0.000000 0.000000 
1 1 1   30    0   14 f   43.179   3.8732   40.717   9.3271   40.717   9.3271   40.717   9.3271   43.179   5.4775   43.179   5.4775 0.000000 0.000000 
1 1 1   30    0   15 f  122.636   2.2586  312.137   16.131  312.137   16.131  312.137   16.131  122.636   3.1941  122.636   3.1941 0.000000 0.000000 
1 1 1   30    0   16 o   73.932   2.6285  114.292   11.270  114.292   11.270  114.292   11.270   73.932   3.7172   73.932   3.7172 0.000000 0.000000 
1 1 1   30    0   17 o   44.863   3.6510   43.657   9.2252   43.657   9.2252   43.657   9.2252   44.863   5.1633   44.863   5.1633 0.000000 0.000000 
1 1 1   30    0   18 o   75.168   3.3051  119.160   14.363  119.160   14.363  119.160   14.363   75.168   4.6741   75.168   4.6741 0.000000 0.000000 
1 1 1   30    0   19 o   14.785   6.2831   5.0768   9.7765   5.0768   9.7765   5.0768   9.7765   14.785   8.8856   14.785   8.8856 0.000000 0.000000 
1 1 1   30    0   20 o   17.292   7.0511   8.5511   11.457   8.5511   11.457   8.5511   11.457   17.292   9.9718   17.292   9.9718 0.000000 0.000000 
1 1 1   30    0   21 o   15.348   6.5283   5.5801   10.574   5.5801   10.574   5.5801   10.574   15.348   9.2324   15.348   9.2324 0.000000 0.000000 
1 1 1   30    0   22 o   30.617   7.1692   25.797   11.385   25.797   11.385   25.797   11.385   30.617   10.139   30.617   10.139 0.000000 0.000000 
1 1 1   30    0   23 o   13.596   6.1664   1.3711   11.087   1.3711   11.087   1.3711   11.087   13.596   8.7206   13.596   8.7206 0.000000 0.000000 
1 1 1   30    0   24 o   65.911   3.7190   93.135   14.088   93.135   14.088   93.135   14.088   65.911   5.2594   65.911   5.2594 0.000000 0.000000 
1 1 1   30    0   25 o   14.127   6.3529   2.3676   11.463   2.3676   11.463   2.3676   11.463   14.127   8.9844   14.127   8.9844 0.000000 0.000000 
1 1 1   30    0   26 o   95.670   3.9669  196.100   21.962  196.100   21.962  196.100   21.962   95.670   5.6101   95.670   5.6101 0.000000 0.000000 
1 1 1   30    0   27 o   27.369   12.432   24.343   45.267   24.343   45.267   24.343   45.267   27.369   17.581   27.369   17.581 0.000000 0.000000 
1 1 1   30    0   28 o   13.386   6.5789 -12.4585   18.147 -12.4585   18.147 -12.4585   18.147   13.386   9.3040   13.386   9.3040 0.000000 0.000000 
1 1 1   30    0   29 o   80.081   5.4871  144.386   25.078  144.386   25.078  144.386   25.078   80.081   7.7600   80.081   7.7600 0.000000 0.000000 
1 1 1   30    1    0 o   75.202   2.6350  117.960   11.494  117.960   11.494  117.960   11.494   75.202   3.7265   75.202   3.7265 0.000000 0.000000 
1 1 1   30    1    1 o   32.089   4.8662   22.644   6.2464   23.503   8.7248   21.740   8.9468   32.767   6.6824   31.412   7.0756 1.354603 9.732362 
1 1 1   30    1    2 o   44.464   3.7388   42.016   6.7139   51.542   9.4799   32.430   9.5099   49.676   4.6269   39.252   5.8741 10.42375 7.477550 
1 1 1   30    1    3 o  160.038   2.2060  531.281   14.561  531.878   20.665  530.693   20.519  160.124   3.1291  159.951   3.1103 0.1728821 4.411949 
1 1 1   30    1    4 o   18.492   5.1463   4.1340   5.8364   1.7100   8.2458   6.5675   8.2621   17.055   7.0944   19.929   7.4571 -2.873857 10.29261 
1 1 1   30    1    5 o   65.060   2.7888   88.166   7.4823   88.964   10.522   87.350   10.642   65.364   3.9030   64.756   3.9845 0.6085510 5.577650 
1 1 1   30    1    6 o   75.009   2.6032  117.086   8.0525  119.665   11.421  114.537   11.355   75.835   3.6514   74.182   3.7114 1.653473 5.206477 
1 1 1   30    1    7 o   68.579   2.7294   98.033   7.7197   97.049   10.921   99.016   10.914   68.231   3.8806   68.927   3.8392 -0.6958923 5.458778 
1 1 1   30    1    8 o  121.041   2.2373  304.461   11.169  308.150   15.798  300.775   15.791  121.779   3.1453  120.302   3.1826 1.476913 4.474603 
1 1 1   30    1    9 o   33.282   4.7846   24.476   6.3388   24.882   8.7840   24.034   9.1565   33.630   6.5685   32.934   6.9588 0.6956749 9.569264 
1 1 1   30    1   10 o  126.755   2.5902  334.822   13.539  327.069   18.951  342.905   19.349  125.255   3.6683  128.255   3.6578 -3.000404 5.180325 
1 1 1   30    1   11 o   78.643   3.1889  127.475   10.255  111.599   13.502  149.117   15.765   72.962   4.4867   84.325   4.5327 -11.36305 6.377796 
1 1 1   30    1   12 o   77.881   3.3746  127.649   10.790  143.091   15.395  112.737   15.128   82.593   4.5192   73.169   5.0129 9.423950 6.749217 
1 1 1   30    1   13 o  152.345   2.3672  482.098   14.760  492.030   22.392  474.466   19.629  153.646   3.5336  151.043   3.1508 2.603683 4.734303 
1 1 1   30    1   14 o   67.986   2.7236   96.528   7.6365   98.164   10.814   94.901   10.786   68.567   3.8238   67.406   3.8796 1.161156 5.447234 
1 1 1   30    1   15 o   42.475   3.7859   38.251   6.5437   30.728   9.1071   46.281   9.4087   38.053   5.8027   46.898   4.8642 -8.844711 7.571776 
1 1 1   30    1   16 o   89.248   2.4591  165.991   9.0413  155.088   12.606  177.541   12.975   86.213   3.5452   92.284   3.4088 -6.070518 4.918157 
1 1 1   30    1   17 o   83.196   2.5482  144.648   8.7429  142.693   12.383  146.591   12.346   82.626   3.6336   83.765   3.5735 -1.139359 5.096349 
1 1 1   30    1   18 o   70.441   4.0588  108.033   11.288   97.186   18.299  114.695   14.341   67.148   6.6073   73.733   4.7158 -6.584496 8.117640 
1 1 1   30    1   19 o   24.038   5.3693   11.482   6.6983   20.281   9.3334   2.1365   9.6188   29.888   7.5647   18.188   7.6218 11.69982 10.73853 
1 1 1   30    1   20 o   27.216   6.2165   16.302   8.8077   24.599   11.398   4.0040   13.877   32.610   8.4172   21.823   9.1503 10.78661 12.43292 
1 1 1   30    1   21 o   89.225   2.9620  167.552   10.897  173.271   15.628  162.141   15.201   90.711   4.1771   87.739   4.2007 2.972038 5.923985 
1 1 1   30    1   22 o   68.938   3.4287  100.981   9.7140   90.074   13.523  112.611   13.963   65.008   5.0434   72.867   4.6462 -7.858231 6.857321 
1 1 1   30    1   23 o   39.784   5.9169   37.932   9.3100   42.491   11.901   30.743   14.946   44.036   6.5527   35.532   9.8540 8.503880 11.83380 
1 1 1   30    1   24 o   79.724   3.3932  136.267   11.100  128.391   16.220  143.204   15.223   77.383   5.0819   82.065   4.4975 -4.682449 6.786308 
1 1 1   30    1   25 o   36.860   5.8412   32.331   8.7239   25.439   12.340   39.217   12.335   32.472   8.9339   41.248   7.5276 -8.776207 11.68244 
1 1 1   30    1   26 o   83.004   4.6809  153.569   15.898  153.159   21.223  154.093   23.998   83.280   6.1788   82.728   7.0333 0.5517578 9.361862 
1 1 1   30    1   27 o   34.015   8.0558   29.198   14.531   12.608   20.650   45.472   20.451   26.904   11.212   41.125   11.570 -14.22141 16.11158 
1 1 1   30    1   28 f   24.942   7.4170   8.5708   13.227   1.2942   19.012   15.397   18.414   22.731   10.105   27.153   10.860 -4.422754 14.83405 
1 1 1   30    1   29 f   36.975   8.6674   39.226   15.284   37.789   20.036   41.227   23.637   36.639   11.726   37.312   12.767 -0.6728363 17.33479 
1 1 1   30    1   30 o   38.525   12.466   44.384   22.600   0.0000   0.0000   44.384   22.600  ?   ?    38.525   12.466      ?      ? 
1 1 1   30    2    0 o   61.737   2.8989   80.023   10.333   80.023   10.333   80.023   10.333   61.737   4.0996   61.737   4.0996 0.000000 0.000000 
1 1 1   30    2    1 o   74.156   2.6381  114.367   8.0582  106.829   11.314  122.127   11.480   71.660   3.8282   76.653   3.6310 -4.992729 5.276292 
1 1 1   30    2    2 o  103.937   2.3145  224.026   9.9084  240.751   14.227  208.273   13.807  107.715   3.2025  100.159   3.3424 7.555977 4.628946 
1 1 1   30    2    3 o   54.168   3.1597   61.254   7.0575   59.582   9.9596   62.939   10.002   53.418   4.5205   54.918   4.4158 -1.499752 6.319354 
1 1 1   30    2    4 o   80.476   2.5397  134.584   8.4175  144.772   12.048  124.869   11.765   83.467   3.4998   77.485   3.6814 5.981071 5.079494 
1 1 1   30    2    5 o   91.295   2.4035  173.068   9.0391  161.594   12.622  185.147   12.951   88.176   3.4706   94.413   3.3258 -6.237289 4.806921 
1 1 1   30    2    6 o   38.687   4.2151   32.119   6.5300   27.891   9.1831   36.444   9.2875   35.756   6.4649   41.619   5.4106 -5.862545 8.430268 
1 1 1   30    2    7 o  134.814   2.2264  377.515   12.379  383.415   17.584  371.717   17.430  135.862   3.1381  133.766   3.1592 2.095139 4.452867 
1 1 1   30    2    8 o   77.067   2.5864  123.758   8.2207  123.540   11.687  123.973   11.566   76.995   3.6802   77.140   3.6352 -0.1445389 5.172867 
1 1 1   30    2    9 o   84.809   2.4944  149.807   8.7217  144.166   12.274  155.561   12.396   83.184   3.5774   86.433   3.4772 -3.249512 4.988855 
1 1 1   30    2   10 o   88.179   2.9649  163.324   10.707  169.354   14.482  156.052   15.903   90.066   3.8984   86.292   4.4683 3.774597 5.929836 
1 1 1   30    2   11 o  123.094   2.9790  317.059   15.124  315.987   21.438  318.122   21.339  122.880   4.2299  123.309   4.1959 -0.4288406 5.958010 
1 1 1   30    2   12 o   68.645   3.2500   99.882   9.0500   92.739   13.818  105.247   11.976   66.350   5.0494   70.939   4.0931 -4.589478 6.500006 
1 1 1   30    2   13 o   57.231   3.1259   68.948   7.3283   65.987   10.877   71.409   9.9168   56.038   4.7062   58.423   4.1155 -2.384823 6.251850 
1 1 1   30    2   14 o   36.793   4.1686   28.703   6.3193   29.578   9.1946   27.920   8.6996   37.309   5.9752   36.277   5.8144 1.032013 8.337276 
1 1 1   30    2   15 o   18.166   4.9647   2.2308   5.9241  -5.7022   8.3188   10.394   8.4383   13.820   6.3557   22.512   7.6287 -8.692162 9.929357 
1 1 1   30    2   16 o   60.162   2.9702   75.634   7.3342   65.818   10.079   86.681   10.692   55.988   4.3648   64.336   4.0295 -8.348454 5.940386 
1 1 1   30    2   17 o  115.996   2.2993  280.286   10.993  266.666   15.339  294.670   15.764  113.086   3.2887  118.905   3.2143 -5.819000 4.598614 
1 1 1   30    2   18 o   72.156   3.8262  111.926   11.102  104.068   17.393  117.329   14.423   69.728   6.0480   74.583   4.6886 -4.854950 7.652474 
1 1 1   30    2   19 o   58.541   4.3888   72.191   10.486   63.366   13.691   84.717   16.311   54.335   6.1092   62.747   6.3027 -8.411800 8.777598 
1 1 1   30    2   20 o  113.935   3.2437  273.386   15.216  294.287   22.267  255.073   20.842  118.014   4.5747  109.855   4.6000 8.158295 6.487470 
1 1 1   30    2   21 o   66.106   3.7497   92.807   10.149   96.418   15.421   90.048   13.480   67.123   5.5702   65.090   5.0212 2.033363 7.499335 
1 1 1   30    2   22 o   74.757   3.2307  118.391   9.9149  103.848   13.780  134.003   14.277   69.903   4.7794   79.610   4.3482 -9.706848 6.461377 
1 1 1   30    2   23 o   82.604   3.1400  145.004   10.677  153.964   15.025  135.862   15.176   85.272   4.2720   79.935   4.6032 5.337105 6.280055 
1 1 1   30    2   24 o   78.201   3.2516  130.248   10.485  127.141   14.825  133.358   14.831   77.237   4.6538   79.164   4.5424 -1.926445 6.503162 
1 1 1   30    2   25 o   38.927   6.4141   35.775   9.8085   33.369   12.259   40.056   16.351   37.638   8.1344   40.217   9.9195 -2.578724 12.82828 
1 1 1   30    2   26 o   31.310   7.6516   24.282   12.015   20.201   16.152   29.338   17.977   29.032   10.500   33.588   11.132 -4.556757 15.30318 
1 1 1   30    2   27 o   26.065   7.6267   11.633   13.391   9.7908   18.834   13.517   19.045   25.377   10.651   26.754   10.919 -1.376987 15.25343 
1 1 1   30    2   28 o   33.442   8.2870   29.900   14.088   31.311   20.748   28.693   19.191   33.984   11.944   32.900   11.491 1.084007 16.57402 
1 1 1   30    2   29 o   33.903   8.5446   30.074   15.170   19.307   19.565   46.307   24.023   28.461   11.254   39.346   12.860 -10.88511 17.08929 
1 1 1   30    2   30 o   21.693   9.9675  -3.4591   20.398   0.0000   0.0000  -3.4591   20.398  ?   ?    21.693   9.9675      ?      ? 
1 1 1   30    3    0 o   67.223   2.8225   94.619   10.978   94.619   10.978   94.619   10.978   67.223   3.9916   67.223   3.9916 0.000000 0.000000 
1 1 1   30    3    1 o  111.644   2.2942  258.799   10.559  267.780   14.914  249.775   14.950  113.600   3.1831  109.688   3.3046 3.911873 4.588303 
1 1 1   30    3    2 o   48.020   3.4311   48.231   6.7833   44.431   9.4802   52.218   9.7100   46.063   4.9900   49.978   4.7106 -3.914772 6.862200 
1 1 1   30    3    3 o  128.386   2.2274  342.012   11.794  345.834   16.758  338.261   16.601  129.097   3.1474  127.675   3.1525 1.422592 4.454708 
1 1 1   30    3    4 o   54.590   3.1408   62.331   7.0567   66.841   9.9678   57.800   9.9915   56.599   4.2700   52.581   4.6072 4.017097 6.281633 
1 1 1   30    3    5 o   35.830   4.4636   27.940   6.3704   32.563   8.8963   23.076   9.1264   39.337   5.4833   32.323   7.0447 7.013988 8.927137 
1 1 1   30    3    6 o   43.390   3.7230   39.612   6.6479   36.307   9.3249   43.029   9.4802   41.519   5.4455   45.261   5.0784 -3.742016 7.446058 
1 1 1   30    3    7 o  122.918   2.2341  313.827   11.324  320.398   16.197  307.544   15.839  124.175   3.1626  121.661   3.1565 2.514648 4.468246 
1 1 1   30    3    8 o   94.520   2.3589  185.862   9.1960  186.576   13.037  185.156   12.973   94.700   3.3379   94.340   3.3342 0.3600998 4.717847 
1 1 1   30    3    9 o   65.808   2.8184   90.424   7.6427   85.272   10.702   95.788   10.918   63.879   4.0619   67.737   3.9081 -3.857567 5.636735 
1 1 1   30    3   10 o   53.189   3.8787   60.617   8.3773   67.020   11.336   52.912   12.435   56.464   4.8677   49.915   6.0400 6.548981 7.757337 
1 1 1   30    3   11 o   59.551   3.7012   76.723   8.8423   90.623   12.033   60.403   13.038   65.754   4.4368   53.347   5.9255 12.40710 7.402447 
1 1 1   30    3   12 o   26.410   5.5879   15.258   6.5195   16.753   9.8938   14.110   8.6674   27.464   8.1476   25.356   7.6496 2.108372 11.17588 
1 1 1   30    3   13 o   42.313   3.8652   37.639   6.7220   42.230   9.9180   33.738   9.1419   44.702   5.3794   39.924   5.5518 4.777607 7.730461 
1 1 1   30    3   14 o  178.200   2.6124  663.103   19.177  678.439   26.667  646.677   27.598  180.396   3.5841  176.004   3.8018 4.392471 5.224876 
1 1 1   30    3   15 o   47.746   3.7390   47.698   7.3009   44.731   9.6095   51.749   11.229   46.056   5.0589   49.436   5.5070 -3.380356 7.477916 
1 1 1   30    3   16 o   90.841   2.5995  172.453   9.7118  172.035   14.270  172.813   13.255   90.693   3.8150   90.989   3.5320 -0.2961121 5.199013 
1 1 1   30    3   17 f   43.236   5.0258   42.782   7.8009   37.159   14.145   45.240   9.3517   40.207   8.7759   46.265   4.9008 -6.057838 10.05161 
1 1 1   30    3   18 o  109.878   3.2333  253.660   14.333  257.996   22.839  250.842   18.409  110.412   5.0153  109.344   4.0819 1.068970 6.466507 
1 1 1   30    3   19 o   35.184   5.8583   28.649   8.3776   25.223   12.225   31.681   11.503   32.980   8.8174   37.387   7.7157 -4.406208 11.71658 
1 1 1   30    3   20 o   41.787   4.7140   35.150   7.5454   57.854   12.712   22.800   9.3756   51.891   5.9398   31.683   7.3216 20.20796 9.428017 
1 1 1   30    3   21 o   32.721   5.9531   24.834   8.3219   32.916   11.851   16.974   11.688   37.963   7.8291   27.478   8.9700 10.48517 11.90611 
1 1 1   30    3   22 o   37.251   5.4642   31.820   8.1183   34.059   11.706   29.747   11.268   38.587   7.6260   35.916   7.8278 2.671291 10.92839 
1 1 1   30    3   23 o   36.662   5.5029   30.761   8.2538   39.406   11.922   22.804   11.438   42.275   6.8378   31.048   8.6240 11.22685 11.00581 
1 1 1   30    3   24 o   30.741   5.9783   22.199   8.1256   14.508   11.374   30.217   11.613   25.560   8.8509   35.922   8.0388 -10.36215 11.95662 
1 1 1   30    3   25 o   19.309   6.0472  -1.7410   8.8876  -4.5120   10.753   4.2322   15.788   16.171   7.3567   22.447   9.5995 -6.275873 12.09430 
1 1 1   30    3   26 o   38.193   7.3479   39.687   13.067   53.812   17.065   19.665   20.318   47.010   9.1307   29.377   11.515 17.63272 14.69574 
1 1 1   30    3   27 o   34.618   8.2741   32.022   14.035   31.553   20.064   32.471   19.641   34.378   11.763   34.857   11.640 -0.4788780 16.54824 
1 1 1   30    3   28 o   62.095   6.0324   90.558   15.360  104.788   22.752   78.642   20.820   66.794   8.2587   57.396   8.7950 9.397568 12.06476 
1 1 1   30    3   29 o   42.026   8.9444   62.329   22.228  -6.0887   45.680   83.556   25.443   28.641   13.695   55.410   11.509 -26.76976 17.88884 
1 1 1   30    3   30 o   37.835   12.478   42.931   22.596   0.0000   0.0000   42.931   22.596  ?   ?    37.835   12.478      ?      ? 
1 1 1   30    4    0 o  110.013   2.6058  251.493   16.679  251.493   16.679  251.493   16.679  110.013   3.6852  110.013   3.6852 0.000000 0.000000 
1 1 1   30    4    1 o   69.425   2.7632  100.374   7.9108  101.855   11.148   98.873   11.227   69.948   3.8643   68.901   3.9507 1.046143 5.526397 
1 1 1   30    4    2 o   26.288   5.2737   14.919   6.1701   9.9386   8.6240   20.143   8.8314   22.403   7.7100   30.173   7.1973 -7.769724 10.54730 
1 1 1   30    4    3 o   84.019   2.4823  146.705   8.5983  148.540   12.366  144.988   11.963   84.520   3.5475   83.518   3.4730 1.002258 4.964513 
1 1 1   30    4    4 o   47.173   3.4656   46.848   6.6718   38.768   9.3503   55.229   9.5229   42.950   5.2784   51.396   4.4924 -8.446472 6.931262 
1 1 1   30    4    5 o   54.681   3.0870   62.509   6.9614   63.488   9.8465   61.532   9.8434   55.115   4.3316   54.248   4.3994 0.8670273 6.173962 
1 1 1   30    4    6 o   26.790   5.2482   15.880   5.9984   15.386   8.3583   16.405   8.6134   26.384   7.3877   27.197   7.4562 -0.8131218 10.49633 
1 1 1   30    4    7 o   66.086   2.8076   91.199   7.6358   83.518   10.701   99.167   10.900   63.222   4.1037   68.949   3.8328 -5.726273 5.615207 
1 1 1   30    4    8 o   72.006   2.6726  108.480   7.8897  122.760   11.208   94.453   11.108   76.768   3.5398   67.244   4.0053 9.524300 5.345291 
1 1 1   30    4    9 o   48.676   3.6194   50.694   7.1448   57.383   9.7426   42.910   10.510   52.319   4.5150   45.033   5.6583 7.285557 7.238848 
1 1 1   30    4   10 o   68.431   3.4734   99.982   9.6387  110.359   12.985   87.247   14.385   72.593   4.3369   64.269   5.4267 8.324478 6.946740 
1 1 1   30    4   11 o  155.880   3.4952  524.185   20.197  542.353   24.072  480.987   37.119  161.286   3.6187  150.475   5.9809 10.81078 6.990451 
1 1 1   30    4   12 o   40.167   4.4968   34.088   7.3633   36.578   11.462   32.338   9.6084   41.325   6.7246   39.009   5.9719 2.315575 8.993533 
1 1 1   30    4   13 o   72.536   2.7974  110.761   8.3052   99.262   12.050  121.168   11.463   68.851   4.2434   76.221   3.6463 -7.370094 5.594760 
1 1 1   30    4   14 o   53.998   3.3524   61.782   7.4021   55.396   10.793   67.453   10.171   51.260   5.1050   56.735   4.3466 -5.474655 6.704746 
1 1 1   30    4   15 o   25.980   5.3364   15.000   6.0633   15.741   8.4632   14.218   8.6908   26.562   7.4327   25.399   7.6593 1.162466 10.67286 
1 1 1   30    4   16 o   43.361   3.7042   40.016   6.5937   43.003   9.1554   36.796   9.5043   45.119   4.9198   41.604   5.5389 3.515129 7.408370 
1 1 1   30    4   17 o   33.755   5.9239   27.330   7.8444   19.969   15.274   29.967   9.1423   30.063   10.263   37.447   5.9193 -7.383976 11.84790 
1 1 1   30    4   18 o   49.811   5.1754   56.820   9.6240   47.649   16.004   62.016   12.045   45.611   8.8262   54.012   5.4071 -8.400349 10.35082 
1 1 1   30    4   19 o   24.390   5.8926   11.079   7.5506   19.679   11.228   3.9802   10.202   29.301   8.6768   19.479   7.9753 9.822258 11.78528 
1 1 1   30    4   20 o   92.425   2.9338  181.033   11.067  169.541   16.568  190.292   14.871   89.602   4.4832   95.248   3.7854 -5.646324 5.867543 
1 1 1   30    4   21 o   60.564   4.0508   79.277   9.9251   81.812   12.982   75.710   15.398   61.993   5.0773   59.134   6.3131 2.859253 8.101530 
1 1 1   30    4   22 o   71.906   3.3584  109.844   9.9519  104.086   13.816  116.053   14.347   69.931   4.7901   73.881   4.7084 -3.949745 6.716718 
1 1 1   30    4   23 o   36.844   5.8776   32.041   8.7367   28.161   12.557   35.681   12.163   34.375   8.8149   39.312   7.7771 -4.936493 11.75524 
1 1 1   30    4   24 o   72.766   3.9290  114.758   11.254  113.537   18.860  115.433   14.024   71.944   6.3559   73.588   4.6206 -1.644386 7.857980 
1 1 1   30    4   25 o   20.906   6.3230  -3.3333   9.4038 -11.5353   11.277   15.389   17.038   14.595   6.9291   27.217   10.579 -12.62277 12.64607 
1 1 1   30    4   26 o   40.922   7.4779   43.139   12.675   41.047   17.164   45.649   18.797   39.995   10.332   41.848   10.813 -1.852230 14.95574 
1 1 1   30    4   27 o   59.390   5.6422   81.504   13.714   80.485   18.291   82.813   20.726   59.367   7.4700   59.412   8.4580 -0.4555511E-01 11.28448 
1 1 1   30    4   28 o   37.910   8.0982   39.117   14.161   28.493   19.835   50.162   20.224   32.641   11.656   43.179   11.245 -10.53812 16.19631 
1 1 1   30    4   29 o   43.630   9.5163   67.484   21.150   33.916   45.887   76.538   23.832   34.065   15.377   53.194   11.216 -19.12893 19.03253 
1 1 1   30    4   30 o   59.355   11.533   96.902   27.218   0.0000   0.0000   96.902   27.218  ?   ?    59.355   11.533      ?      ? 
1 1 1   30    4   31 o   16.922   8.2513 -23.3886   18.708   0.0000   0.0000 -23.3886   18.708  ?   ?    16.922   8.2513      ?      ? 
1 1 1   30    5    0 o   65.499   2.8190   89.919   10.678   89.919   10.678   89.919   10.678   65.499   3.9866   65.499   3.9866 0.000000 0.000000 
1 1 1   30    5    1 o  105.822   2.2961  232.571   10.019  226.228   14.095  239.051   14.246  104.357   3.2747  107.287   3.2194 -2.929848 4.592165 
1 1 1   30    5    2 o   42.946   3.7577   38.908   6.6293   35.344   9.4459   42.368   9.3061   40.957   5.5918   44.935   5.0213 -3.978138 7.515376 
1 1 1   30    5    3 o  139.460   2.2060  403.829   12.688  409.694   18.025  398.069   17.863  140.466   3.1112  138.454   3.1282 2.012375 4.411959 
1 1 1   30    5    4 o   84.932   2.4781  150.140   8.6783  153.601   12.235  146.636   12.312   85.928   3.4522   83.935   3.5563 1.993149 4.956294 
1 1 1   30    5    5 o   53.563   3.1695   60.306   6.9553   68.341   9.8497   52.315   9.8228   57.189   4.1759   49.937   4.7693 7.251972 6.339077 
1 1 1   30    5    6 o   71.882   2.9514  107.999   8.5958  107.932   11.162  108.098   13.475   71.945   3.7616   71.818   4.5491 0.1271591 5.902866 
1 1 1   30    5    7 o   46.988   3.8522   45.574   7.3723   40.121   9.5513   53.611   11.596   43.616   5.3094   50.360   5.5827 -6.743443 7.704331 
1 1 1   30    5    8 o   52.856   3.5528   58.715   7.7143   51.893   10.696   66.110   11.136   49.617   5.2269   56.095   4.8134 -6.478283 7.105538 
1 1 1   30    5    9 o   18.268   5.2144   2.8536   6.1933  -0.6943   8.4877   6.8938   9.0574   16.017   6.9454   20.520   7.7794 -4.502478 10.42872 
1 1 1   30    5   10 o  111.524   2.8381  259.336   12.921  255.764   17.047  264.161   19.810  110.724   3.7328  112.325   4.2761 -1.601418 5.676108 
1 1 1   30    5   11 o   56.907   3.4931   68.043   8.1882   63.487   11.334   73.016   11.842   54.903   5.0054   58.911   4.8737 -4.008156 6.986186 
1 1 1   30    5   12 o   18.901   5.2386   4.4920   6.1635  -0.1959   9.3205   8.1352   8.2166   16.982   7.3210   20.821   7.4951 -3.838949 10.47729 
1 1 1   30    5   13 o   91.804   2.5448  175.872   9.5754  174.296   14.330  177.143   12.871   91.374   3.8024   92.234   3.3833 -0.8599091 5.089684 
1 1 1   30    5   14 o   99.448   2.4678  206.983   10.066  196.201   14.796  216.272   13.734   96.962   3.6998  101.934   3.2667 -4.971710 4.935567 
1 1 1   30    5   15 o  141.170   2.2552  414.985   13.131  411.585   18.556  418.395   18.584  140.586   3.2001  141.753   3.1786 -1.167511 4.510477 
1 1 1   30    5   16 o   81.585   2.5532  138.923   8.5829  147.829   12.366  130.643   11.922   84.119   3.5642   79.051   3.6567 5.067383 5.106415 
1 1 1   30    5   17 o   83.548   3.3089  143.867   10.328  155.236   19.536  139.458   12.167   85.412   5.5456   81.685   3.6113 3.727402 6.617792 
1 1 1   30    5   18 o   91.133   2.9791  172.901   11.137  199.497   16.630  151.273   14.997   97.457   4.1373   84.808   4.2874 12.64952 5.958133 
1 1 1   30    5   19 o   21.500   5.9330   6.7145   7.8156   1.9518   11.275   11.120   10.844   19.291   8.1763   23.709   8.5994 -4.418516 11.86598 
1 1 1   30    5   20 o   29.681   6.2978   15.399   8.0723   34.542   15.371   8.1091   9.4855   38.104   9.7427   21.257   7.9830 16.84764 12.59562 
1 1 1   30    5   21 o   51.108   4.7212   54.450   9.6947   41.013   12.413   75.470   15.524   43.259   6.9569   58.957   6.3843 -15.69814 9.442381 
1 1 1   30    5   22 o   32.454   5.9748   24.735   8.1490   29.419   11.686   20.301   11.370   35.500   8.1529   29.409   8.7363 6.091282 11.94964 
1 1 1   30    5   23 o   57.089   3.9941   71.446   9.2260   57.281   13.230   84.855   12.872   51.197   6.2655   62.981   4.9553 -11.78406 7.988245 
1 1 1   30    5   24 o   44.722   5.0316   46.148   8.7223   32.876   12.451   58.936   12.222   37.319   8.3035   52.125   5.6851 -14.80586 10.06323 
1 1 1   30    5   25 o   25.584   6.8391   4.6459   9.8352  -5.2912   11.517   31.412   18.902   16.480   7.5418   34.688   11.411 -18.20716 13.67813 
1 1 1   30    5   26 o   35.666   8.0232   33.837   13.248   34.040   17.775   33.584   19.873   35.971   10.978   35.361   11.704 0.6101303 16.04631 
1 1 1   30    5   27 o   69.057   5.3217  110.797   14.744  119.009   19.346   99.420   22.771   73.093   6.4173   65.021   8.4913 8.072670 10.64348 
1 1 1   30    5   28 o   25.561   7.5386   10.396   13.641   1.1561   20.024   18.398   18.634   22.967   10.279   28.155   11.030 -5.187489 15.07720 
1 1 1   30    5   29 o   51.415   8.6304   98.648   23.605   14.858   46.721  127.368   27.353   31.141   14.573   71.689   9.2509 -40.54832 17.26087 
1 1 1   30    5   30 o   33.652   12.270   33.358   22.119   0.0000   0.0000   33.358   22.119  ?   ?    33.652   12.270      ?      ? 
1 1 1   30    5   31 o   61.925   11.205  106.651   27.565   0.0000   0.0000  106.651   27.565  ?   ?    61.925   11.205      ?      ? 
1 1 1   30    6    0 o  110.569   2.2809  253.724   14.682  253.724   14.682  253.724   14.682  110.569   3.2257  110.569   3.2257 0.000000 0.000000 
1 1 1   30    6    1 o  145.430   2.2185  439.362   13.306  443.643   18.792  435.056   18.844  146.147   3.1176  144.713   3.1571 1.434479 4.437004 
1 1 1   30    6    2 o   93.651   2.6405  182.580   10.030  181.799   13.043  183.711   15.691   93.492   3.3825   93.809   4.0556 -0.3165131 5.281029 
1 1 1   30    6    3 o  112.308   2.4270  261.513   11.167  270.324   16.910  254.698   14.872  113.930   3.5986  110.686   3.2576 3.243858 4.854072 
1 1 1   30    6    4 o   99.848   2.4875  207.900   10.178  204.633   15.215  210.546   13.693   99.080   3.7233  100.617   3.2995 -1.536888 4.974928 
1 1 1   30    6    5 o   30.280   4.9570   20.562   6.1305   25.262   8.5912   15.685   8.7507   33.949   6.3696   26.612   7.5971 7.337681 9.914028 
1 1 1   30    6    6 o   75.031   2.6008  117.390   8.0461  120.063   11.350  114.689   11.408   75.901   3.6258   74.160   3.7296 1.740631 5.201504 
1 1 1   30    6    7 o   93.266   2.3974  181.117   9.2169  188.250   13.045  174.006   13.025   95.117   3.3251   91.416   3.4545 3.701447 4.794785 
1 1 1   30    6    8 o  112.774   2.4066  263.928   11.122  257.650   14.834  271.988   16.808  111.300   3.2315  114.249   3.5670 -2.948936 4.813105 
1 1 1   30    6    9 o  112.890   2.6724  262.943   11.913  255.818   14.753  276.291   20.193  110.898   3.2255  114.883   4.2617 -3.984680 5.344717 
1 1 1   30    6   10 o  116.986   2.5983  284.518   12.516  266.437   17.147  305.138   18.311  113.019   3.6785  120.952   3.6706 -7.932846 5.196625 
1 1 1   30    6   11 o   51.036   3.7014   54.974   7.7849   52.121   10.942   57.899   11.078   49.671   5.3410   52.401   5.1259 -2.729797 7.402799 
1 1 1   30    6   12 o   40.775   4.1192   35.040   6.8766   37.203   10.491   33.410   9.1058   41.819   6.0821   39.731   5.5568 2.088249 8.238307 
1 1 1   30    6   13 o   49.845   3.2840   52.206   6.7486   50.762   9.5774   53.629   9.5108   49.145   4.7250   50.545   4.5622 -1.400593 6.568028 
1 1 1   30    6   14 o   37.278   4.4562   30.833   6.5272   23.801   9.4780   37.176   9.0021   32.614   7.2354   41.941   5.2040 -9.327541 8.912493 
1 1 1   30    6   15 o   48.234   3.5668   49.191   7.0691   49.363   10.463   49.047   9.5887   48.260   5.2565   48.208   4.8225 0.5169678E-01 7.133559 
1 1 1   30    6   16 o   95.475   2.9939  194.006   10.993  184.180   19.141  198.842   13.428   93.317   4.9733   97.633   3.3346 -4.316811 5.987783 
1 1 1   30    6   17 o   48.348   5.2029   51.746   9.6180   50.711   16.109   52.319   11.990   47.215   8.5888   49.481   5.8748 -2.266563 10.40581 
1 1 1   30    6   18 o   41.707   5.0090   38.537   8.3598   36.893   12.402   39.906   11.317   40.400   7.7245   43.015   6.3792 -2.614964 10.01809 
1 1 1   30    6   19 o   44.003   4.8985   42.267   8.5188   54.562   12.711   32.243   11.478   50.327   6.1238   37.678   7.6472 12.64929 9.796946 
1 1 1   30    6   20 o   90.240   2.7759  172.503   10.031  164.968   16.046  177.338   12.852   88.393   4.4013   92.086   3.3839 -3.693344 5.551806 
1 1 1   30    6   21 o   28.204   6.3371   18.182   8.8382   25.415   11.862   9.1543   13.251   32.873   8.6367   23.535   9.2760 9.337921 12.67419 
1 1 1   30    6   22 o   62.813   3.6380   84.524   9.4216   84.004   13.136   85.076   13.521   62.641   5.0842   62.984   5.2049 -0.3431664 7.276033 
1 1 1   30    6   23 f   40.859   5.1582   37.565   8.4959   41.587   12.430   34.038   11.639   43.313   6.9580   38.406   7.6168 4.906666 10.31646 
1 1 1   30    6   24 o   25.182   6.9796   12.032   9.8803   12.838   11.554   9.8377   19.059   24.518   8.8789   25.847   10.771 -1.328899 13.95920 
1 1 1   30    6   25 f   40.846   6.7527   44.258   10.766   49.068   12.730   32.180   20.172   46.922   6.5779   34.771   11.795 12.15158 13.50531 
1 1 1   30    6   26 o   24.180   6.9784   8.3915   10.167   5.1159   12.099   16.261   18.753   20.646   8.5912   27.714   10.999 -7.067602 13.95681 
1 1 1   30    6   27 o   24.533   7.2649   8.9509   12.459   12.721   16.443   3.8679   19.093   25.565   10.249   23.501   10.300 2.063446 14.52971 
1 1 1   30    6   28 o   25.139   8.5047  -8.1190   19.177  -0.7922   44.889  -9.7548   21.210   29.340   13.899   20.939   9.8049 8.401022 17.00943 
1 1 1   30    6   29 o   37.327   9.3872   47.690   20.399   9.9574   47.247   56.335   22.616   30.469   14.381   44.184   12.069 -13.71532 18.77431 
1 1 1   30    6   30 f   25.204   8.3246   0.1918   20.129 -43.1508   47.971   9.4538   22.176   25.031   12.399   25.377   11.111 -0.3463917 16.64921 
1 1 1   30    6   31 o   34.044   12.429   36.632   22.706   0.0000   0.0000   36.632   22.706  ?   ?    34.044   12.429      ?      ? 
1 1 1   30    7    0 o   21.662   6.6944   14.241   8.8033   14.241   8.8033   14.241   8.8033   21.662   9.4673   21.662   9.4673 0.000000 0.000000 
1 1 1   30    7    1 o   85.649   2.6593  153.706   9.3214  159.895   12.587  146.189   13.872   87.635   3.4824   83.663   4.0200 3.972313 5.318577 
1 1 1   30    7    2 o   68.238   2.9881   98.602   8.2927  107.577   11.193   87.683   12.347   71.818   3.7789   64.657   4.6298 7.161453 5.976225 
1 1 1   30    7    3 o  133.286   2.4323  369.417   13.193  372.399   20.420  367.280   17.285  133.647   3.7046  132.925   3.1527 0.7220764 4.864525 
1 1 1   30    7    4 o  115.980   2.2639  279.398   10.823  293.227   15.572  266.477   15.052  118.760   3.1791  113.201   3.2239 5.559563 4.527741 
1 1 1   30    7    5 o   80.333   2.5327  134.460   8.3911  132.673   11.821  136.276   11.913   79.793   3.5920   80.874   3.5714 -1.081268 5.065337 
1 1 1   30    7    6 o   86.772   2.4927  156.949   8.9045  168.866   12.654  145.260   12.532   90.065   3.4065   83.478   3.6400 6.587654 4.985342 
1 1 1   30    7    7 o   98.340   2.4772  200.770   9.9896  195.402   13.352  207.595   15.056   96.897   3.3410   99.784   3.6583 -2.886986 4.954320 
1 1 1   30    7    8 o   82.182   2.6497  141.251   8.9407  144.901   12.177  136.980   13.170   83.388   3.5405   80.976   3.9432 2.412003 5.299408 
1 1 1   30    7    9 o  125.407   2.6435  325.764   13.153  319.511   16.418  336.968   21.977  123.932   3.2120  126.882   4.1995 -2.950737 5.287055 
1 1 1   30    7   10 o  110.606   2.6369  255.055   12.024  247.074   16.703  263.638   17.322  108.814   3.7217  112.397   3.7365 -3.583069 5.273765 
1 1 1   30    7   11 o   91.923   2.5818  174.546   9.7250  190.898   14.817  162.171   12.890   95.638   3.7564   88.207   3.5430 7.431252 5.163697 
1 1 1   30    7   12 o   51.964   3.8492   57.383   8.2026   60.981   11.268   53.328   11.964   53.789   5.0792   50.140   5.7852 3.648785 7.698446 
1 1 1   30    7   13 o   44.791   4.3798   40.448   7.3851   24.303   9.3289   67.550   12.087   33.025   7.0628   56.557   5.1816 -23.53201 8.759669 
1 1 1   30    7   14 f  137.993   2.3877  396.297   13.508  404.222   20.326  390.028   18.079  139.150   3.5415  136.837   3.2033 2.313446 4.775306 
1 1 1   30    7   15 o   74.677   2.7601  116.215   8.4635  122.994   12.702  110.802   11.351   76.590   4.0209   72.764   3.7821 3.825920 5.520138 
1 1 1   30    7   16 o  139.177   3.0285  418.062   16.655  363.349   26.694  452.939   21.312  131.090   4.9371  147.264   3.5089 -16.17342 6.057021 
1 1 1   30    7   17 o   64.370   3.3262   87.635   8.5142   86.973   13.992   88.024   10.729   63.972   5.3032   64.768   4.0164 -0.7962379 6.652445 
1 1 1   30    7   18 o   43.372   4.7837   40.851   8.5427   41.111   12.461   40.620   11.734   43.440   6.9552   43.305   6.5696 0.1351547 9.567399 
1 1 1   30    7   19 o   38.999   5.3825   34.040   8.2989   38.804   12.628   30.418   11.011   41.396   7.6786   36.601   7.5448 4.795959 10.76499 
1 1 1   30    7   20 o   68.498   3.1807   99.613   8.6444   97.936   14.242  100.591   10.877   67.796   5.0935   69.200   3.8110 -1.404686 6.361362 
1 1 1   30    7   21 o   61.015   4.3620   83.643   10.556   98.780   14.136   64.568   15.869   67.990   5.0411   54.039   7.1200 13.95176 8.723965 
1 1 1   30    7   22 o   85.051   3.1350  153.634   10.988  154.641   15.261  152.551   15.834   85.395   4.3329   84.707   4.5321 0.6885986 6.270081 
1 1 1   30    7   23 o   32.590   6.1289   25.389   8.4334   21.957   11.942   28.804   11.911   30.314   8.9407   34.866   8.3856 -4.552603 12.25782 
1 1 1   30    7   24 o   95.913   4.7544  197.156   18.808  197.156   18.808   0.0000   0.0000   95.913   4.7544  ?   ?       ?      ? 
1 1 1   30    7   25 o   58.216   5.7392   82.108   11.518   86.214   13.594   71.661   21.684   63.034   5.2289   53.398   10.218 9.636723 11.47840 
1 1 1   30    7   26 f   54.088   5.4704   64.369   11.372   59.457   13.611   75.727   20.696   51.710   6.3819   56.466   8.8868 -4.755768 10.94089 
1 1 1   30    7   27 o   19.312   6.3750  -9.7279   12.282 -12.9438   16.048  -5.1819   19.080   17.583   8.3240   21.042   9.6580 -3.459389 12.75009 
1 1 1   30    7   28 o   32.823   8.8657   30.583   17.607   16.518   27.981   39.803   22.654   28.925   12.577   36.721   12.499 -7.795782 17.73143 
1 1 1   30    7   29 o   24.449   8.5265 -18.1437   18.588   12.928   49.757 -23.1831   20.039   31.053   14.688   17.844   8.6641 13.20974 17.05299 
1 1 1   30    7   30 o   25.359   8.3942   1.6825   19.951 -25.4001   46.247   7.8755   22.115   25.927   12.712   24.791   10.966 1.135725 16.78848 
1 1 1   30    7   31 o   42.561   13.342   60.549   26.056   0.0000   0.0000   60.549   26.056  ?   ?    42.561   13.342      ?      ? 
1 1 1   30    8    0 o   81.819   2.5318  139.555   12.030  139.555   12.030  139.555   12.030   81.819   3.5805   81.819   3.5805 0.000000 0.000000 
1 1 1   30    8    1 o   63.929   2.8605   85.406   7.5416   84.518   10.700   86.282   10.631   63.591   4.0798   64.266   4.0107 -0.6746559 5.721042 
1 1 1   30    8    2 o   74.287   2.6301  115.091   8.0576  116.450   11.371  113.721   11.419   74.734   3.6892   73.840   3.7496 0.8940582 5.260139 
1 1 1   30    8    3 o   38.804   4.1268   32.362   6.3864   26.901   8.8877   38.192   9.1830   35.045   6.3842   42.564   5.2309 -7.518978 8.253528 
1 1 1   30    8    4 o   72.249   2.6674  108.884   7.9480  107.755   11.152  110.049   11.330   71.871   3.7622   72.627   3.7824 -0.7567062 5.334886 
1 1 1   30    8    5 o   96.413   2.3811  193.474   9.4631  202.169   13.466  184.989   13.302   98.568   3.3123   94.259   3.4215 4.309448 4.762128 
1 1 1   30    8    6 o   98.859   2.7648  199.794   10.838  189.212   13.425  219.603   18.368   95.326   3.4145  102.391   4.3494 -7.065292 5.529553 
1 1 1   30    8    7 o   97.767   2.6773  199.515   10.795  197.898   15.342  201.100   15.191   97.364   3.8205   98.170   3.7519 -0.8055344 5.354660 
1 1 1   30    8    8 o   18.998   5.5168   0.0272   7.6994   9.5368   10.525 -10.9198   11.293   22.887   8.4456   15.109   7.1001 7.778267 11.03356 
1 1 1   30    8    9 o   30.129   5.5179   20.257   6.8686   19.054   9.1306   21.826   10.425   29.155   7.5376   31.104   8.0605 -1.948599 11.03577 
1 1 1   30    8   10 o   30.704   5.5821   21.337   7.1167   22.956   9.6638   19.418   10.520   32.014   7.4575   29.395   8.3082 2.619488 11.16421 
1 1 1   30    8   11 o   86.321   2.6418  155.918   9.3326  151.872   13.996  159.157   12.523   85.241   3.9810   87.401   3.4739 -2.159767 5.283632 
1 1 1   30    8   12 o   99.429   2.5585  206.807   10.363  202.567   15.861  209.966   13.689   98.443   3.9065  100.416   3.3051 -1.973343 5.117067 
1 1 1   30    8   13 o   77.414   2.6064  125.410   8.2949  137.651   11.777  113.358   11.685   81.214   3.5158   73.614   3.8488 7.600433 5.212830 
1 1 1   30    8   14 o   61.681   3.0604   79.471   7.7269   83.917   11.791   76.124   10.230   63.128   4.5285   60.233   4.1177 2.894688 6.120727 
1 1 1   30    8   15 f   66.235   3.2482   91.893   8.5948   94.686   14.103   90.242   10.841   66.862   5.1140   65.608   4.0062 1.253319 6.496362 
1 1 1   30    8   16 o   30.164   6.2460   20.908   7.5609   18.161   15.861   21.716   8.6010   29.208   10.424   31.119   6.8839 -1.910072 12.49201 
1 1 1   30    8   17 f   79.048   2.9512  133.316   9.3550  122.447   14.724  140.674   12.114   76.103   4.6910   81.992   3.5823 -5.888855 5.902406 
1 1 1   30    8   18 o   54.853   3.9437   63.950   8.8894   71.969   13.127   57.158   12.081   58.042   5.4834   51.664   5.6695 6.377754 7.887456 
1 1 1   30    8   19 o   53.223   4.0369   60.764   8.7862   60.848   13.309   60.699   11.698   53.119   6.0746   53.327   5.3184 -0.2078247 8.073839 
1 1 1   30    8   20 o   48.968   4.0401   51.661   7.7110   51.619   13.226   51.683   9.4908   48.604   6.5978   49.333   4.6645 -0.7283516 8.080105 
1 1 1   30    8   21 o   72.546   3.8163  112.734   11.315  109.846   14.948  116.608   17.314   71.644   5.0588   73.449   5.7153 -1.804222 7.632580 
1 1 1   30    8   22 o   73.103   3.8902  118.154   11.284  128.284   14.561  102.923   17.854   77.640   4.5471   68.566   6.3134 9.074524 7.780441 
1 1 1   30    8   23 f   84.391   3.2807  150.921   11.363  141.018   15.179  163.546   17.138   81.336   4.5247   87.446   4.7518 -6.110138 6.561428 
1 1 1   30    8   24 o   27.728   7.0880   11.280   9.9942   2.7933   11.688   34.360   19.274   19.467   8.2906   35.988   11.499 -16.52147 14.17592 
1 1 1   30    8   25 o   63.294   4.8450   80.093   11.859   62.467   14.090  122.898   21.958   52.976   6.4487   73.612   7.2325 -20.63587 9.689904 
1 1 1   30    8   26 o   30.518   7.3360   21.081   10.275   16.732   12.213   31.618   19.011   26.620   9.1744   34.415   11.450 -7.795084 14.67205 
1 1 1   30    8   27 o   45.128   8.5775   60.053   16.591   47.537   27.819   66.962   20.669   39.133   13.822   51.124   10.160 -11.99078 17.15500 
1 1 1   30    8   28 o   31.159   8.5451   18.290   16.604   50.705   27.105  -1.1799   21.007   39.809   13.670   22.509   10.256 17.29999 17.09013 
1 1 1   30    8   29 o   30.340   9.3112   22.414   19.591   12.936   46.490   24.460   21.603   30.506   14.358   30.174   11.859 0.3321781 18.62242 
1 1 1   30    8   30 o   40.876   10.642   58.369   21.111   82.337   50.040   53.179   23.285   40.444   17.188   41.308   12.555 -0.8639908 21.28492 
1 1 1   30    8   31 o   34.554   12.715   39.554   23.833   0.0000   0.0000   39.554   23.833  ?   ?    34.554   12.715      ?      ? 
1 1 1   30    9    0 o   16.049   6.2246   7.7184   8.3731   7.7184   8.3731   7.7184   8.3731   16.049   8.8029   16.049   8.8029 0.000000 0.000000 
1 1 1   30    9    1 o   37.142   4.4007   30.364   6.4260   37.583   9.0054   22.874   9.1725   42.227   5.1707   32.057   7.1224 10.17011 8.801407 
1 1 1   30    9    3 o   54.170   3.6675   61.511   8.1612   58.093   10.962   65.761   12.224   52.520   5.0607   55.820   5.3095 -3.300468 7.334919 
1 1 1   30    9    4 o  101.736   2.5590  213.644   10.552  204.815   13.587  227.059   16.748   99.202   3.3209  104.271   3.8943 -5.069397 5.117961 
1 1 1   30    9    5 o   90.430   2.5282  169.256   9.3631  160.970   12.405  180.226   14.273   87.917   3.4211   92.943   3.7234 -5.026169 5.056456 
1 1 1   30    9    6 o   52.838   3.4411   59.242   7.4236   63.665   10.075   53.987   10.981   55.104   4.4329   50.572   5.2644 4.531586 6.882175 
1 1 1   30    9    7 o  124.697   2.3913  324.869   12.220  334.451   16.526  313.309   18.151  126.809   3.1597  122.585   3.5901 4.224411 4.782551 
1 1 1   30    9    8 o   40.134   4.1501   34.873   6.5357   26.059   9.0798   44.350   9.4150   34.376   6.6445   45.891   4.9742 -11.51571 8.300171 
1 1 1   30    9    9 o   44.273   4.2359   42.384   7.5830   49.370   10.427   34.544   11.047   48.370   5.2268   40.175   6.6671 8.194248 8.471704 
1 1 1   30    9   10 o  158.038   2.5768  520.721   16.790  513.070   23.385  528.863   24.122  156.854   3.6147  159.221   3.6733 -2.366989 5.153550 
1 1 1   30    9   11 o   32.109   4.9761   22.667   7.0693   7.7571   9.7885   38.921   10.220   21.416   8.0950   42.803   5.7894 -21.38715 9.952186 
1 1 1   30    9   12 o   46.525   3.7513   45.007   7.1182   37.084   9.4194   55.557   10.869   41.802   5.4634   51.248   5.1421 -9.445969 7.502638 
1 1 1   30    9   13 o   62.052   3.3529   83.015   8.2439   74.074   13.237   88.679   10.537   59.043   5.4359   65.062   3.9265 -6.019394 6.705717 
1 1 1   30    9   14 o   48.010   5.1085   61.670   8.1161   26.927   13.682   80.531   10.081   34.026   9.4255   61.994   3.9427 -27.96799 10.21692 
1 1 1   30    9   15 o   40.313   4.8023   37.537   7.3085   28.989   11.776   42.892   9.3209   35.616   8.1877   45.010   5.0209 -9.394650 9.604613 
1 1 1   30    9   16 o   31.880   5.5978   24.509   7.5212   15.264   12.832   29.347   9.2829   26.803   9.3944   36.958   6.0900 -10.15468 11.19567 
1 1 1   30    9   17 o   95.870   2.6879  189.665   10.322  205.717   17.014  180.316   12.984   98.862   4.1726   92.877   3.3895 5.984627 5.375856 
1 1 1   30    9   18 o   52.178   4.2142   58.872   8.9788   56.072   13.475   61.107   12.041   50.882   6.4211   53.473   5.4597 -2.590885 8.428452 
1 1 1   30    9   19 o   86.878   3.0558  158.242   10.898  172.469   16.412  147.020   14.576   90.302   4.4066   83.454   4.2347 6.848442 6.111558 
1 1 1   30    9   20 o   35.612   5.3411   30.587   7.3890   22.960   12.488   34.696   9.1658   31.084   9.1355   40.139   5.5365 -9.054960 10.68220 
1 1 1   30    9   21 o   29.527   6.1830   20.397   8.2176   25.682   11.789   15.402   11.461   32.888   8.5953   26.165   8.8905 6.723253 12.36609 
1 1 1   30    9   22 o   36.058   6.3478   30.803   9.3470   27.224   12.343   35.613   14.311   33.701   8.7890   38.415   9.1613 -4.714485 12.69550 
1 1 1   30    9   23 o   25.743   6.4058   14.662   8.6668   19.300   12.024   9.6459   12.504   28.416   9.0823   23.070   9.0359 5.346300 12.81153 
1 1 1   30    9   24 o   31.865   6.8996   26.713   10.451   32.648   12.857   15.154   17.944   36.651   8.6453   27.078   10.755 9.572477 13.79924 
1 1 1   30    9   25 o   44.455   6.5417   48.790   10.936   50.006   13.153   46.067   19.682   47.220   6.7538   41.690   11.206 5.530327 13.08348 
1 1 1   30    9   26 o   55.221   5.5116   68.285   11.612   64.377   13.875   77.422   21.215   53.760   6.2578   56.682   9.0748 -2.922504 11.02323 
1 1 1   30    9   27 o   25.234   7.8234   5.3906   16.599 -16.6338   27.612   17.853   20.771   22.398   10.692   28.071   11.423 -5.672680 15.64676 
1 1 1   30    9   28 o   61.218   8.1848  107.151   19.466   75.808   29.599  131.038   25.840   48.860   13.981   73.576   8.5152 -24.71663 16.36959 
1 1 1   30    9   29 o   30.736   9.6776   8.2776   18.938   70.709   45.060  -5.1153   20.870   40.125   16.629   21.346   9.9053 18.77864 19.35519 
1 1 1   30    9   30 o   32.437   9.9480   30.211   20.824   57.069   46.839   23.594   23.248   35.707   15.869   29.166   12.002 6.540619 19.89600 
1 1 1   30    9   31 o   53.776   12.017   86.551   25.982   0.0000   0.0000   86.551   25.982  ?   ?    53.776   12.017      ?      ? 
1 1 1   30   10    0 o   7.9606   4.0078 -11.2982   8.1250 -11.2982   8.1250 -11.2982   8.1250   7.9606   5.6679   7.9606   5.6679 0.000000 0.000000 
1 1 1   30   10    1 o  118.291   2.4729  292.922   11.922  281.939   18.120  301.307   15.832  116.224   3.7800  120.357   3.1893 -4.133331 4.945701 
1 1 1   30   10    2 o   54.666   3.3027   62.479   7.4219   59.406   10.014   66.225   11.055   53.203   4.5636   56.128   4.7755 -2.924225 6.605453 
1 1 1   30   10    3 o   59.881   3.1082   75.194   7.6397   75.478   10.326   74.850   11.356   60.055   4.1687   59.708   4.6114 0.3476295 6.216338 
1 1 1   30   10    4 o   20.383   4.8623   2.5540   6.1055  -9.2339   8.1155   17.926   9.2676   12.469   5.9077   28.296   7.7245 -15.82728 9.724654 
1 1 1   30   10    5 o   94.790   2.5107  187.021   9.7650  184.677   13.123  189.929   14.617   94.173   3.3787   95.406   3.7146 -1.233292 5.021328 
1 1 1   30   10    6 o   65.400   2.9364   89.263   7.8985   86.439   10.709   92.631   11.696   64.295   4.0385   66.506   4.2639 -2.210442 5.872876 
1 1 1   30   10    7 o   35.757   4.5166   27.555   6.4633   22.335   8.8144   33.626   9.5056   31.697   6.9351   39.817   5.7883 -8.119398 9.033220 
1 1 1   30   10    8 o   61.380   3.1486   80.172   7.8466   89.197   10.639   69.407   11.620   65.334   3.9480   57.427   4.9059 7.906551 6.297211 
1 1 1   30   10    9 o  112.933   2.6005  265.803   12.105  253.604   16.812  278.936   17.443  110.238   3.6976  115.627   3.6576 -5.389488 5.200980 
1 1 1   30   10   10 o   21.479   5.5897   8.3666   6.5233   7.3652   9.1644   9.3950   9.2873   20.806   7.8403   22.153   7.9692 -1.346264 11.17936 
1 1 1   30   10   11 o   59.241   3.1542   73.064   7.6380   79.190   11.775   68.615   10.036   61.312   4.6564   57.171   4.2561 4.141186 6.308460 
1 1 1   30   10   12 o   98.167   2.4051  201.080   9.7365  206.160   13.850  196.116   13.691   99.401   3.3782   96.934   3.4244 2.467216 4.810241 
1 1 1   30   10   13 o  104.662   2.3502  228.481   10.145  227.597   14.346  229.365   14.348  104.457   3.3298  104.867   3.3174 -0.4093170 4.700299 
1 1 1   30   10   14 o   32.548   5.1168   24.702   6.8664   15.897   10.454   31.383   9.1063   26.753   8.4600   38.344   5.7580 -11.59168 10.23358 
1 1 1   30   10   15 o   59.901   5.5992   84.217   9.7174   73.044   23.057   86.630   10.716   55.577   10.442   64.225   4.0452 -8.648067 11.19830 
1 1 1   30   10   16 o  136.526   2.9019  395.455   15.831  377.402   25.447  406.855   20.221  133.607   4.6178  139.445   3.5159 -5.837585 5.803885 
1 1 1   30   10   17 o   35.761   5.5667   28.795   7.8838   32.350   12.406   26.387   10.211   37.467   8.2512   34.055   7.4747 3.412796 11.13343 
1 1 1   30   10   18 o  114.021   2.8641  273.797   13.468  271.119   19.087  276.454   19.008  113.449   4.0791  114.593   4.0217 -1.144287 5.728238 
1 1 1   30   10   19 o   48.829   4.3175   50.853   8.5991   62.687   13.089   41.867   11.406   53.822   5.8965   43.836   6.3084 9.985363 8.635092 
1 1 1   30   10   20 o   85.360   2.9551  154.811   9.9732  151.889   16.553  156.476   12.496   84.404   4.7550   86.315   3.5101 -1.910606 5.910217 
1 1 1   30   10   21 o   71.041   3.5316  108.325   10.328  103.808   14.851  112.555   14.372   69.503   5.1808   72.579   4.8009 -3.076004 7.063258 
1 1 1   30   10   22 o   44.173   5.8434   44.994   9.9957   43.858   12.475   47.032   16.707   44.417   6.8094   43.928   9.4981 0.4894600 11.68681 
1 1 1   30   10   23 o   43.791   6.4660   45.369   10.632   43.778   12.686   49.125   19.486   44.110   6.9733   43.472   10.891 0.6376305 12.93195 
1 1 1   30   10   24 o   72.085   4.4225  107.632   12.149   96.476   14.352  135.845   22.824   66.689   5.2178   77.481   7.1420 -10.79257 8.844992 
1 1 1   30   10   25 o   22.704   6.4960   7.9595   9.9254   14.116   12.090  -4.7686   17.384   25.075   9.0822   20.333   9.2901 4.742392 12.99201 
1 1 1   30   10   26 o   69.419   4.9890  106.709   14.063   88.843   18.143  133.605   22.260   62.364   7.0534   76.473   7.0576 -14.10921 9.977942 
1 1 1   30   10   27 o   50.766   8.4663   76.619   18.581   50.577   28.008   97.093   24.833   39.479   13.877   62.054   9.7028 -22.57584 16.93257 
1 1 1   30   10   28 o   26.928   8.2270   13.497   16.631   5.7532   28.487   17.501   20.484   26.284   11.964   27.572   11.296 -1.287994 16.45408 
1 1 1   30   10   29 o   36.674   10.398   43.989   20.508   69.226   49.854   38.849   22.500   38.093   16.670   35.256   12.433 2.837753 20.79612 
1 1 1   30   10   30 o   22.312   7.8443 -19.9131   19.498 -22.7867   49.891 -19.3951   21.183   26.046   12.854   18.579   8.9944 7.466591 15.68857 
1 1 1   30   10   31 o   54.033   11.297   84.261   24.366   0.0000   0.0000   84.261   24.366  ?   ?    54.033   11.297      ?      ? 
1 1 1   30   11    0 o   34.474   5.0947   27.909   9.0277   27.909   9.0277   27.909   9.0277   34.474   7.2051   34.474   7.2051 0.000000 0.000000 
1 1 1   30   11    1 o   46.514   3.5221   45.546   6.7552   44.222   9.4565   46.926   9.6532   45.819   5.0040   47.208   4.9578 -1.389484 7.044137 
1 1 1   30   11    2 o   61.957   2.9285   80.444   7.4621   73.314   10.527   87.645   10.580   59.156   4.3144   64.759   3.9610 -5.603439 5.856955 
1 1 1   30   11    3 o   34.729   4.6942   26.238   6.5453   20.173   9.0110   33.011   9.5232   30.022   7.3390   39.436   5.8549 -9.414761 9.388345 
1 1 1   30   11    4 o  140.589   2.3521  411.118   13.558  408.454   18.183  414.453   20.346  140.146   3.1457  141.033   3.4978 -0.8862305 4.704266 
1 1 1   30   11    5 o   22.681   5.4532   10.494   6.1114   9.4144   8.6611   11.564   8.6247   21.923   7.7159   23.439   7.7079 -1.515636 10.90632 
1 1 1   30   11    6 o   39.884   4.7465   35.877   7.3387   25.263   10.727   45.215   10.062   33.491   7.8949   46.277   5.2716 -12.78563 9.493085 
1 1 1   30   11    7 o  102.762   2.4587  219.026   10.389  207.089   14.043  233.462   15.443   99.703   3.4149  105.822   3.5382 -6.119133 4.917324 
1 1 1   30   11    8 o   66.275   3.2107   92.323   8.7724   94.289   12.315   90.299   12.499   67.014   4.4556   65.536   4.6241 1.478180 6.421432 
1 1 1   30   11    9 o   92.971   2.7452  180.866   10.522  181.250   14.688  180.461   15.082   93.092   3.8254   92.850   3.9384 0.2416916 5.490400 
1 1 1   30   11   10 o   38.261   4.6197   31.778   7.0979   36.586   10.394   27.576   9.7166   41.347   6.0947   35.175   6.9441 6.172554 9.239383 
1 1 1   30   11   11 o   87.363   2.6240  159.286   9.3787  162.427   14.251  156.886   12.456   88.048   3.9243   86.678   3.4843 1.370560 5.247910 
1 1 1   30   11   12 o  101.901   2.3683  216.599   9.9529  219.894   14.168  213.389   13.985  102.668   3.3459  101.135   3.3527 1.532318 4.736600 
1 1 1   30   11   13 o   18.903   5.2772   4.7245   6.0267   6.5826   9.2539   3.3560   7.9418   20.302   7.8226   17.504   7.0853 2.797569 10.55435 
1 1 1   30   11   14 o   30.972   5.3278   22.198   6.7222   19.016   10.410   24.474   8.8036   28.847   8.3022   33.097   6.6794 -4.250626 10.65553 
1 1 1   30   11   15 o   53.058   4.1979   61.930   8.3660   56.657   14.974   64.322   10.087   50.906   7.1321   55.211   4.4297 -4.305710 8.395801 
1 1 1   30   11   16 o   39.463   5.0502   33.469   7.5433   38.054   13.428   31.355   9.1181   40.700   8.2809   38.227   5.7832 2.472595 10.10040 
1 1 1   30   11   17 o  110.671   2.5679  255.634   11.324  261.570   18.675  252.182   14.240  111.451   4.0627  109.891   3.1418 1.560265 5.135776 
1 1 1   30   11   18 o   92.074   2.9930  179.387   11.338  176.691   16.551  181.771   15.563   91.334   4.3937   92.814   4.0654 -1.480011 5.985985 
1 1 1   30   11   19 o   82.276   3.1768  143.645   10.725  145.230   16.028  142.360   14.433   82.570   4.7064   81.982   4.2684 0.5876694 6.353691 
1 1 1   30   11   20 o   20.673   5.4262   2.3027   6.6606   18.136   11.508  -5.6732   8.1677   27.868   8.8831   13.479   6.2341 14.38845 10.85234 
1 1 1   30   11   21 o   23.597   5.5907   12.389   7.0777   1.4342   12.110   18.073   8.7226   19.334   8.3399   27.859   7.4477 -8.524691 11.18137 
1 1 1   30   11   22 o  111.259   4.0586  262.953   18.624  262.953   18.624   0.0000   0.0000  111.259   4.0586  ?   ?       ?      ? 
1 1 1   30   11   23 o   35.088   7.4125   29.498   10.585   26.365   12.362   38.106   20.493   32.744   8.9141   37.433   11.846 -4.688736 14.82504 
1 1 1   30   11   24 o   63.559   5.0196   91.229   12.168   91.001   14.719   91.721   21.625   64.546   5.5291   62.572   8.3793 1.973255 10.03911 
1 1 1   30   11   25 o   22.234   6.1772   5.5745   10.153   18.214   12.104 -24.4301   18.649   27.370   9.1374   17.098   8.3149 10.27263 12.35433 
1 1 1   30   11   26 o   78.514   4.8003  139.281   15.367  131.897   20.077  149.727   23.878   76.482   6.3646   80.546   7.1878 -4.063919 9.600621 
1 1 1   30   11   27 o   24.758   7.8429   5.0919   16.419  -1.6775   27.008   9.0603   20.679   24.505   11.334   25.011   10.843 -0.5058689 15.68573 
1 1 1   30   11   28 o   19.724   6.7283 -18.7305   16.014 -23.5610   26.056 -15.7980   20.302   20.422   9.9074   19.026   9.1061 1.395275 13.45657 
1 1 1   30   11   29 o   25.447   8.0462   8.1590   16.815   19.420   27.202   1.1948   21.392   28.289   12.348   22.604   10.319 5.685116 16.09245 
1 1 1   30   11   30 o   30.287   8.9190   29.006   19.674 -14.1051   50.418   36.749   21.368   26.646   13.106   33.928   12.100 -7.281729 17.83792 
1 1 1   30   12    0 o   41.621   3.9138   37.999   9.0318   37.999   9.0318   37.999   9.0318   41.621   5.5350   41.621   5.5350 0.000000 0.000000 
1 1 1   30   12    1 o   44.025   3.7228   41.005   6.7279   41.899   9.1465   39.951   9.9314   44.605   4.9718   43.446   5.5423 1.158470 7.445522 
1 1 1   30   12    2 o   87.820   2.5478  160.606   9.1908  158.494   12.414  163.168   13.672   87.222   3.4508   88.418   3.7492 -1.195915 5.095576 
1 1 1   30   12    3 o   35.161   4.6160   26.921   6.4255   14.636   8.6636   41.941   9.5792   25.746   7.6212   44.576   5.2103 -18.83020 9.231982 
1 1 1   30   12    4 o   40.605   3.9846   34.798   6.6539   31.405   9.1080   38.682   9.7443   38.470   5.7403   42.739   5.5279 -4.268883 7.969177 
1 1 1   30   12    5 o   22.932   5.3943   10.850   6.1130   14.061   8.4445   7.3135   8.8608   25.251   7.5355   20.613   7.7207 4.637619 10.78856 
1 1 1   30   12    6 o   42.023   3.8848   37.749   6.5951   47.107   9.4454   28.848   9.2126   47.276   4.8441   36.770   6.0747 10.50616 7.769650 
1 1 1   30   12    7 o   30.190   5.2864   20.879   6.6024   16.744   9.8237   24.286   8.9165   27.341   8.1204   33.040   6.7708 -5.698822 10.57283 
1 1 1   30   12    8 o   30.403   5.2891   20.872   6.8831   12.196   9.6455   29.873   9.8252   24.087   8.1562   36.719   6.7359 -12.63141 10.57811 
1 1 1   30   12    9 o   41.906   4.6040   39.848   7.3398   53.908   10.275   25.198   10.488   50.495   4.9336   33.317   7.7747 17.17858 9.207945 
1 1 1   30   12   10 o   19.082   5.2852   4.6678   6.0863   8.2004   9.2297   1.9498   8.0960   21.291   7.8984   16.872   7.0250 4.418913 10.57046 
1 1 1   30   12   11 o  138.008   3.1724  396.914   18.057   0.0000   0.0000  396.914   18.057  ?   ?   138.008   3.1724      ?      ? 
1 1 1   30   12   12 o  106.756   2.4556  238.273   10.799  241.829   14.980  234.426   15.583  107.624   3.3747  105.888   3.5681 1.736450 4.911165 
1 1 1   30   12   13 o   86.162   2.8331  156.354   10.022  150.734   14.733  161.195   13.673   84.631   4.2208   87.693   3.7804 -3.062088 5.666257 
1 1 1   30   12   14 o  104.305   2.3764  226.967   10.214  240.416   14.787  214.696   14.124  107.262   3.3425  101.348   3.3790 5.914421 4.752873 
1 1 1   30   12   15 o   51.067   4.1409   49.763   8.0344   73.440   15.503   41.069   9.3943   58.220   6.4564   43.914   5.1867 14.30562 8.281751 
1 1 1   30   12   16 o   92.508   3.1138  183.378   10.935  174.212   19.479  187.596   13.214   90.335   5.2282   94.681   3.3838 -4.346375 6.227693 
1 1 1   30   12   17 o   36.948   5.6038   29.152   7.5655   37.739   14.645   26.026   8.8358   39.861   9.1072   34.034   6.5321 5.826843 11.20757 
1 1 1   30   12   18 o   44.891   4.6207   43.907   8.5166   47.189   12.804   41.303   11.406   46.316   6.7026   43.466   6.3622 2.849937 9.241327 
1 1 1   30   12   19 o   55.805   3.9343   66.105   8.9485   82.135   13.606   53.887   11.879   61.762   5.3414   49.848   5.7778 11.91436 7.868503 
1 1 1   30   12   20 o   71.501   3.2286  111.149   9.0752  101.103   14.904  117.069   11.441   68.489   5.2761   74.512   3.7228 -6.022408 6.457232 
1 1 1   30   12   21 o   51.917   4.5200   59.379   9.6364   67.481   14.093   52.265   13.206   55.347   6.1738   48.487   6.6035 6.860519 9.040031 
1 1 1   30   12   22 o   24.404   6.3775   7.0477   9.3636  -4.7983   11.966   25.757   15.038   16.914   7.7201   31.895   10.153 -14.98081 12.75500 
1 1 1   30   12   23 o   30.504   8.6469   19.760   11.757   20.103   12.233   15.592   42.598   28.725   9.1587   32.284   14.669 -3.558853 17.29380 
1 1 1   30   12   24 o   68.837   4.8505  111.028   12.395  118.055   15.004   95.926   21.997   73.859   4.9255   63.816   8.3575 10.04376 9.700922 
1 1 1   30   12   25 o   23.732   6.8042   10.213   10.652   15.205   12.958  -0.1865   18.703   25.560   9.3806   21.904   9.8587 3.655678 13.60837 
1 1 1   30   12   26 o   29.110   7.9983   20.525   13.436   15.846   17.019   28.263   21.889   26.435   10.483   31.784   12.083 -5.349426 15.99655 
1 1 1   30   12   27 o   75.516   6.5678  142.986   20.344  141.892   30.148  143.900   27.566   74.470   9.8155   76.563   8.7293 -2.093681 13.13565 
1 1 1   30   12   28 o   41.692   8.9492   57.120   18.008   38.768   27.325   71.208   23.942   34.110   13.358   49.274   11.912 -15.16408 17.89832 
1 1 1   30   12   29 o   26.288   8.2094   11.106   17.001   26.868   27.662   1.5387   21.551   29.981   12.761   22.595   10.331 7.385822 16.41880 
1 1 1   30   12   30 o   57.133   9.2777  136.202   24.541   71.840   53.229  153.575   27.655   36.254   16.445   78.011   8.5951 -41.75718 18.55532 
1 1 1   30   13    0 o   36.065   5.1956   30.465   9.6691   30.465   9.6691   30.465   9.6691   36.065   7.3476   36.065   7.3476 0.000000 0.000000 
1 1 1   30   13    1 o   66.481   3.0287   92.708   8.3010   89.057   11.644   96.481   11.837   65.136   4.3342   67.825   4.2316 -2.688232 6.057305 
1 1 1   30   13    2 o   58.909   3.1114   73.586   7.4840   81.014   10.271   65.177   10.928   62.201   4.0036   55.616   4.7638 6.584740 6.222754 
1 1 1   30   13    3 o   56.458   3.2014   66.881   7.4445   62.488   10.260   71.765   10.819   54.496   4.5647   58.420   4.4900 -3.923912 6.402872 
1 1 1   30   13    4 o   99.156   2.4693  203.818   10.051  191.508   13.445  219.412   15.133   95.816   3.4023  102.497   3.5796 -6.680946 4.938530 
1 1 1   30   13    5 o   31.762   4.8324   23.388   6.3149   13.737   9.3909   31.354   8.5319   25.092   8.0273   38.432   5.3825 -13.33961 9.664802 
1 1 1   30   13    6 o   55.820   3.2437   65.779   7.4263   64.312   11.026   66.997   10.047   55.181   4.8447   56.459   4.3145 -1.278210 6.487389 
1 1 1   30   13    7 o   50.585   3.7103   54.524   7.6272   43.444   10.638   66.243   10.941   45.141   5.7140   56.029   4.7346 -10.88853 7.420604 
1 1 1   30   13    8 o   33.867   5.0880   26.147   7.0678   35.049   9.8269   16.608   10.173   40.507   5.8819   27.228   8.3038 13.27964 10.17591 
1 1 1   30   13    9 o   39.468   4.7147   34.488   7.3256   43.977   10.472   25.394   10.252   45.444   5.5870   33.493   7.5959 11.95032 9.429379 
1 1 1   30   13   10 o   61.332   3.1063   78.424   7.7986   85.264   11.943   73.338   10.297   63.595   4.5532   59.069   4.2266 4.525669 6.212517 
1 1 1   30   13   11 f   74.193   2.6461  115.316   8.0967  115.249   11.517  115.382   11.385   74.165   3.7652   74.222   3.7190 -0.5714417E-01 5.292213 
1 1 1   30   13   12 o   65.811   3.0489   91.631   8.1452   89.061   12.584   93.485   10.686   64.880   4.7026   66.741   3.8819 -1.861397 6.097777 
1 1 1   30   13   13 o  124.554   2.4491  325.019   12.410  321.382   19.129  327.662   16.309  123.801   3.7463  125.306   3.1556 -1.504845 4.898205 
1 1 1   30   13   14 o   29.187   5.7877   19.814   7.1037   17.823   12.042   20.877   8.7973   28.057   9.1022   30.317   7.1513 -2.260347 11.57550 
1 1 1   30   13   15 o   76.257   3.0406  122.164   9.2860  125.689   15.134  120.035   11.760   76.926   4.7699   75.588   3.7721 1.337624 6.081189 
1 1 1   30   13   16 o   26.525   6.3135   16.895   7.9138  -1.3287   20.396   20.124   8.5866   23.407   10.433   29.643   7.1138 -6.235712 12.62710 
1 1 1   30   13   17 o  106.189   3.9692  251.192   13.139  230.656   30.525  255.862   14.556  101.827   7.2681  110.551   3.1924 -8.724030 7.938350 
1 1 1   30   13   18 o   62.715   3.9178   84.560   10.102   94.381   14.816   76.027   13.810   66.159   5.4298   59.272   5.6491 6.886917 7.835518 
1 1 1   30   13   19 o   88.419   3.1063  165.679   11.305  175.698   16.644  157.097   15.404   90.862   4.4414   85.976   4.3439 4.886452 6.212516 
1 1 1   30   13   20 o   16.795   5.2769  -3.0993   6.6138   4.4563   12.475  -6.0535   7.8004   20.675   8.6727   12.915   6.0138 7.760417 10.55371 
1 1 1   30   13   21 o   78.916   3.1508  134.792   9.8334  127.549   16.126  139.079   12.407   76.767   5.0930   81.064   3.7109 -4.296974 6.301552 
1 1 1   30   13   22 o   22.031   6.6691   4.9944   10.276   6.9641   12.207   0.2042   19.037   21.519   8.7572   22.543   10.061 -1.024185 13.33822 
1 1 1   30   13   23 o   34.972   8.6251   32.022   12.198   32.831   12.712   22.625   43.320   36.701   8.5558   33.242   14.979 3.458603 17.25013 
1 1 1   30   13   24 o   21.901   6.5268   0.5535   9.8650  -7.8968   11.962   18.517   17.441   15.883   7.4130   27.920   10.745 -12.03766 13.05367 
1 1 1   30   13   25 o   58.609   5.8251   81.942   13.874   80.600   18.150   83.828   21.520   58.735   7.4923   58.483   8.9215 0.2522697 11.65026 
1 1 1   30   13   26 o   40.470   6.8420   48.910   13.767   70.903   17.328   11.263   22.671   54.827   7.6627   26.114   11.337 28.71260 13.68399 
1 1 1   30   13   27 f   24.190   7.6827   5.3752   15.387   8.1111   25.764   3.8585   19.184   25.699   11.568   22.682   10.113 3.017061 15.36543 
1 1 1   30   13   28 f   32.765   8.1397   32.365   16.597   1.0699   26.771   51.901   21.152   24.133   11.206   41.397   11.809 -17.26332 16.27939 
1 1 1   30   13   29 o   38.254   9.0374   50.579   18.075   33.480   27.401   63.750   24.049   31.681   13.032   44.826   12.524 -13.14497 18.07482 
1 1 1   30   14    0 o   9.6215   4.6766  -5.7382   8.5621  -5.7382   8.5621  -5.7382   8.5621   9.6215   6.6137   9.6215   6.6137 0.000000 0.000000 
1 1 1   30   14    1 o   28.761   5.3278   18.591   6.5605   12.977   9.1635   24.495   9.3968   24.480   7.9398   33.042   7.1063 -8.561628 10.65553 
1 1 1   30   14    2 o   45.907   3.7282   44.730   7.0550   46.323   9.9644   43.130   9.9902   46.752   5.1676   45.062   5.3752 1.689636 7.456323 
1 1 1   30   14    3 o   52.070   3.5089   57.275   7.4973   65.333   10.827   49.851   10.392   55.648   4.7171   48.493   5.1960 7.154980 7.017846 
1 1 1   30   14    4 o   73.979   2.7925  115.554   8.4377  106.937   12.542  122.679   11.404   71.343   4.2623   76.615   3.6091 -5.271423 5.585045 
1 1 1   30   14    5 o   50.994   3.4065   54.603   7.1309   58.027   10.725   51.890   9.5468   52.381   4.9643   49.606   4.6662 2.775753 6.813005 
1 1 1   30   14    6 f  143.643   2.5055  431.097   14.841  420.605   20.952  441.663   21.025  141.869   3.5808  145.417   3.5055 -3.547913 5.011013 
1 1 1   30   14    7 o   28.629   5.5561   18.633   6.7958   20.828   9.4820   16.316   9.7449   30.298   7.6008   26.960   8.1062 3.337732 11.11221 
1 1 1   30   14    8 o   83.814   2.8359  147.462   9.7993  150.602   13.769  144.239   13.949   84.744   3.9394   82.884   4.0805 1.859642 5.671786 
1 1 1   30   14    9 o   53.540   3.3613   61.797   7.2691   51.906   10.808   69.967   9.8225   49.387   5.3061   57.693   4.1280 -8.305859 6.722688 
1 1 1   30   14   10 o   25.099   5.5212   13.988   6.2969   14.199   9.4553   13.821   8.4411   25.314   8.0501   24.885   7.5584 0.4293404 11.04241 
1 1 1   30   14   11 o   97.025   2.6254  200.317   10.322  176.516   15.515  219.217   13.826   91.600   4.1066  102.450   3.2720 -10.84975 5.250731 
1 1 1   30   14   12 o   69.803   2.9803  103.901   8.4288   94.663   12.832  110.913   11.179   66.880   4.6518   72.727   3.7268 -5.847221 5.960557 
1 1 1   30   14   13 o  146.109   2.2480  445.822   13.546  449.083   19.302  442.656   19.014  146.628   3.1917  145.589   3.1666 1.038452 4.496017 
1 1 1   30   14   14 o   43.042   4.8016   43.771   7.6361   32.491   12.482   50.518   9.6534   37.352   8.3159   48.733   4.8027 -11.38176 9.603150 
1 1 1   30   14   15 o   61.450   3.3663   79.784   8.2182   82.848   13.680   78.054   10.280   62.114   5.3400   60.786   4.1003 1.327148 6.732616 
1 1 1   30   14   16 o   21.533   5.8723   7.7004   6.8056   9.9876   12.792   6.7974   8.0375   23.592   9.1672   19.475   7.3417 4.116158 11.74467 
1 1 1   30   14   17 o   46.689   4.8298   49.530   7.9987   46.700   14.961   50.663   9.4650   44.647   8.4338   48.730   4.7093 -4.083199 9.659510 
1 1 1   30   14   18 o   42.672   5.2480   42.617   8.6795   35.775   13.545   47.384   11.306   38.710   8.6958   46.634   5.8780 -7.924160 10.49609 
1 1 1   30   14   19 o   36.887   5.8007   32.312   8.5507   32.949   12.892   31.812   11.425   36.982   8.6127   36.793   7.7726 0.1888237 11.60137 
1 1 1   30   14   20 o   66.867   3.5318   98.767   9.2257   88.919   15.274  104.424   11.576   63.639   5.8191   70.095   4.0041 -6.455704 7.063672 
1 1 1   30   14   21 o   53.754   4.2666   67.846   8.6407   50.526   14.257   77.903   10.863   47.134   7.3336   60.374   4.3626 -13.23982 8.533134 
1 1 1   30   14   22 o   54.970   6.0396   73.819   12.789   90.136   17.479   55.019   18.761   63.346   6.6901   46.594   10.057 16.75163 12.07925 
1 1 1   30   14   23 o   34.576   9.1988   32.043   14.927   31.971   15.926   32.565   42.816   34.823   10.339   34.329   15.218 0.4938507 18.39760 
1 1 1   30   14   24 o   64.318   5.1632   98.324   12.295  102.501   14.789   88.975   22.123   68.323   5.2480   60.313   8.8935 8.009098 10.32649 
1 1 1   30   14   25 o   24.653   7.2718   11.053   12.159   10.445   15.867   11.918   18.924   23.936   9.8893   25.370   10.664 -1.433073 14.54366 
1 1 1   30   14   26 o   28.978   7.8478   21.523   12.687   18.158   15.828   27.573   21.221   26.932   10.266   31.023   11.873 -4.091045 15.69566 
1 1 1   30   14   27 o   34.277   9.1208   37.556   17.266   47.374   27.261   30.979   22.312   36.813   13.591   31.741   12.168 5.071892 18.24166 
1 1 1   30   14   28 o   27.173   12.105   16.041   27.423   16.041   27.423   0.0000   0.0000   27.173   12.105  ?   ?       ?      ? 
1 1 1   30   15    0 o   88.727   2.7003  164.481   13.916  164.481   13.916  164.481   13.916   88.727   3.8188   88.727   3.8188 0.000000 0.000000 
1 1 1   30   15    1 o   45.808   3.7721   44.654   7.0821   50.862   10.109   38.670   9.9250   49.022   4.9997   42.594   5.6496 6.427891 7.544158 
1 1 1   30   15    2 o   35.835   4.6042   28.219   6.6098   33.003   9.4076   23.554   9.2890   39.311   5.8023   32.360   7.1503 6.951553 9.208356 
1 1 1   30   15    3 o   49.822   3.5174   53.538   7.0813   44.150   10.418   61.601   9.6549   45.528   5.5478   54.117   4.3257 -8.588440 7.034861 
1 1 1   30   15    4 o   42.787   3.8885   39.050   6.8334   38.238   10.070   39.744   9.3034   42.306   5.7710   43.269   5.2132 -0.9633369 7.777002 
1 1 1   30   15    5 f   56.295   3.1773   66.243   7.3419   72.799   11.063   61.084   9.8146   58.743   4.5663   53.848   4.4191 4.895073 6.354510 
1 1 1   30   15    6 o   22.526   5.1350   9.8404   6.1553   0.8831   8.9917   17.739   8.4439   17.062   7.2692   27.989   7.2548 -10.92686 10.26999 
1 1 1   30   15    7 o   21.476   5.5519   8.5562   6.4824   6.0533   9.1385   11.091   9.1969   19.868   7.7406   23.083   7.9610 -3.215202 11.10374 
1 1 1   30   15    8 o   63.574   3.2246   85.389   8.4548   84.515   11.884   86.284   12.031   63.246   4.5558   63.902   4.5648 -0.6557808 6.449219 
1 1 1   30   15    9 o   41.464   4.2001   38.378   6.7694   29.425   9.9183   46.186   9.2622   36.246   6.8863   46.683   4.8105 -10.43687 8.400172 
1 1 1   30   15   10 o   81.062   2.5861  137.813   8.6388  134.438   12.373  141.024   12.067   80.061   3.7469   82.064   3.5652 -2.002762 5.172101 
1 1 1   30   15   11 o   20.623   5.3143   5.6516   6.2801   14.772   9.7684  -0.7738   8.1990   25.703   8.1833   15.544   6.7823 10.15910 10.62851 
1 1 1   30   15   12 o   26.491   5.4614   15.355   6.3904   21.097   9.8404   11.167   8.4035   30.212   7.8321   22.769   7.6135 7.443205 10.92278 
1 1 1   30   15   13 o   39.485   5.0082   37.952   7.2292   26.861   12.373   43.700   8.9078   33.663   8.8095   45.308   4.7668 -11.64552 10.01649 
1 1 1   30   15   14 o   26.072   5.1558   16.438   7.0473  -1.9911   12.073   25.962   8.6794   18.157   8.0635   33.986   6.4273 -15.82907 10.31162 
1 1 1   30   15   15 o   91.475   2.7966  178.740   10.148  168.648   16.538  184.835   12.851   89.064   4.5021   93.886   3.3188 -4.822052 5.593127 
1 1 1   30   15   16 o   75.667   3.3238  122.120   9.5508  122.329   17.223  122.027   11.477   75.210   5.5522   76.125   3.6555 -0.9148712 6.647513 
1 1 1   30   15   17 o   22.814   5.9880   10.113   6.9467   11.269   13.203   9.6706   8.1688   24.215   9.3400   21.412   7.4961 2.802538 11.97610 
1 1 1   30   15   18 o   62.078   3.8114   83.514   9.6163   84.724   14.945   82.659   12.562   62.198   5.8258   61.958   4.9159 0.2398720 7.622738 
1 1 1   30   15   19 o   36.901   5.7559   31.548   8.7974   43.823   13.243   21.853   11.770   43.907   7.3128   29.895   8.8906 14.01146 11.51175 
1 1 1   30   15   20 o   90.656   2.9533  172.611   10.675  185.079   17.746  165.542   13.362   92.845   4.6341   88.466   3.6622 4.378304 5.906505 
1 1 1   30   15   21 o   46.974   4.8664   49.862   9.4134   48.559   13.561   51.074   13.077   46.245   7.1099   47.704   6.6466 -1.459415 9.732875 
1 1 1   30   15   22 o   90.774   3.8758  183.957   13.529  190.278   16.622  171.551   23.287   94.208   4.2780   87.341   6.4643 6.867096 7.751689 
1 1 1   30   15   23 o   45.856   8.3511   66.124   12.989   68.181   13.676   47.188   41.497   55.212   6.0058   36.501   15.585 18.71112 16.70220 
1 1 1   30   15   24 o   45.996   7.0638   56.406   13.113   63.283   17.149   46.725   20.348   51.489   8.0752   40.503   11.592 10.98544 14.12759 
1 1 1   30   15   25 o   56.172   7.6734   74.982   17.778   74.982   17.778   0.0000   0.0000   56.172   7.6734  ?   ?       ?      ? 
1 1 1   30   15   26 o   22.477   7.0468   4.0409   13.258   10.596   17.934  -3.8599   19.689   24.116   10.270   20.837   9.6520 3.278465 14.09369 
1 1 1   30   15   27 o   43.119   9.1586   60.934   17.510   62.137   27.159   60.079   22.906   42.217   13.667   44.020   12.196 -1.803146 18.31725 
1 1 1   30   16    0 o   80.429   2.7538  135.495   12.850  135.495   12.850  135.495   12.850   80.429   3.8944   80.429   3.8944 0.000000 0.000000 
1 1 1   30   16    1 o   78.713   2.6463  129.968   8.5605  128.275   12.602  131.418   11.665   78.180   3.9083   79.246   3.5688 -1.066582 5.292615 
1 1 1   30   16    2 o  112.156   2.4260  263.340   11.162  259.079   16.594  266.861   15.084  111.242   3.6167  113.070   3.2345 -1.828224 4.852091 
1 1 1   30   16    3 o   18.783   4.9511   4.0252   5.8701  -4.7120   8.5631   11.771   8.0626   14.329   6.5364   23.238   7.4383 -8.909013 9.902170 
1 1 1   30   16    4 o   75.641   2.7749  120.549   8.6099  115.554   12.695  124.802   11.716   74.104   4.1537   77.178   3.6806 -3.074249 5.549811 
1 1 1   30   16    5 o   22.436   4.9209   9.4592   6.0606  -2.0061   8.9402   19.208   8.2440   15.727   6.9636   29.146   6.9549 -13.41938 9.841821 
1 1 1   30   16    6 o   62.709   3.2521   83.140   8.4105   82.494   11.793   83.807   11.997   62.469   4.5773   62.949   4.6210 -0.4805145 6.504268 
1 1 1   30   16    7 o   87.154   2.8012  159.685   10.057  169.360   14.276  150.152   14.171   89.819   3.8535   84.488   4.0665 5.331223 5.602343 
1 1 1   30   16    8 o   99.979   2.5228  208.880   10.346  214.002   15.542  204.805   13.864  101.005   3.7308   98.953   3.3969 2.051331 5.045548 
1 1 1   30   16    9 o   66.719   2.8385   93.972   7.7813   85.450   11.071  102.291   10.939   63.651   4.2173   69.787   3.8003 -6.136734 5.676949 
1 1 1   30   16   10 o   81.890   2.7936  142.120   9.2543  136.181   14.396  146.302   12.081   80.243   4.3500   83.537   3.5064 -3.294006 5.587224 
1 1 1   30   16   11 o   57.545   3.3008   70.776   7.6962   68.214   11.925   72.605   10.075   56.472   5.1199   58.618   4.1674 -2.145042 6.601586 
1 1 1   30   16   12 o   70.962   3.0834  107.709   8.6327  103.258   14.300  110.261   10.828   69.500   4.9888   72.425   3.6250 -2.924507 6.166786 
1 1 1   30   16   13 o   27.590   5.3950   19.245   6.9703   5.9108   12.258   25.617   8.4735   21.399   8.7497   33.781   6.3139 -12.38137 10.78991 
1 1 1   30   16   14 o   91.867   2.8084  174.691   10.263  191.985   17.251  165.216   12.769   95.064   4.3998   88.669   3.4915 6.394493 5.616841 
1 1 1   30   16   15 o   55.116   3.7181   63.457   8.0128   71.781   14.058   59.451   9.7520   57.386   5.9395   52.845   4.4743 4.541153 7.436196 
1 1 1   30   16   16 o   74.111   3.6859  128.176   9.8091   96.493   17.705  142.209   11.783   66.034   6.5007   82.188   3.4760 -16.15388 7.371703 
1 1 1   30   16   17 o   25.870   6.2010   14.802   7.2058   16.967   14.248   14.058   8.3527   27.143   9.8554   24.598   7.5286 2.544516 12.40195 
1 1 1   30   16   18 o   44.674   5.3296   46.875   9.3176   41.589   14.348   50.731   12.253   41.480   8.6661   47.868   6.2062 -6.387917 10.65914 
1 1 1   30   16   19 o   61.579   4.0387   83.207   10.238   77.841   14.509   88.528   14.449   59.467   5.9154   63.691   5.5002 -4.223995 8.077387 
1 1 1   30   16   20 o   28.159   5.9703   19.689   7.3803   15.770   13.223   21.462   8.8946   26.154   9.4945   30.164   7.2411 -4.010609 11.94067 
1 1 1   30   16   21 o   26.081   7.9859   11.558   12.172   13.477   12.811  -6.2384   39.021   24.677   9.2756   27.485   13.002 -2.808468 15.97185 
1 1 1   30   16   22 o   78.007   4.4821  141.497   13.695  155.703   17.557  119.418   21.888   84.403   5.0434   71.610   7.4109 12.79268 8.964185 
1 1 1   30   16   23 o   39.709   6.8607   57.732   12.852   66.136   13.413 -36.4411   44.898   54.327   5.9860   25.092   12.347 29.23552 13.72138 
1 1 1   30   16   24 o   33.474   8.4018   35.630   15.473   41.027   16.639   1.1329   42.070   38.919   10.231   28.030   13.330 10.88821 16.80362 
1 1 1   30   16   25 f   53.344   6.3043   71.037   13.331   66.283   17.182   78.226   21.128   52.223   7.9771   54.465   9.7643 -2.241432 12.60858 
1 1 1   30   16   26 o   29.445   7.5535   20.039   12.344   6.8768   15.587   42.182   20.216   21.953   9.4657   36.937   11.774 -14.98346 15.10695 
1 1 1   30   16   27 o   29.005   7.7441   19.482   16.641 -27.1102   28.132   44.560   20.639   20.273   9.9349   37.736   11.882 -17.46305 15.48823 
1 1 1   30   17    0 o   19.882   6.4937   12.391   8.2964   12.391   8.2964   12.391   8.2964   19.882   9.1834   19.882   9.1834 0.000000 0.000000 
1 1 1   30   17    1 o   25.518   4.2835   11.951   5.9088   28.918   8.5090  -3.8495   8.2115   36.751   5.6137   14.286   6.4714 22.46502 8.566955 
1 1 1   30   17    2 o   64.506   2.9514   87.882   7.8180   84.403   11.462   90.909   10.691   63.236   4.3947   65.776   3.9407 -2.540424 5.902792 
1 1 1   30   17    3 o   42.256   3.8431   37.779   6.6616   43.536   9.9646   33.127   8.9575   45.161   5.3497   39.351   5.5190 5.809429 7.686266 
1 1 1   30   17    4 o   71.591   2.8454  109.035   8.3000   96.229   12.216  120.015   11.312   67.509   4.3874   75.673   3.6244 -8.164055 5.690765 
1 1 1   30   17    5 o   18.870   5.2192   4.7629   5.9503   8.3334   8.9381   1.9211   7.9741   21.081   7.7821   16.658   6.9568 4.423342 10.43832 
1 1 1   30   17    6 o   15.902   4.8354  -1.7963   6.1219   4.7067   8.4956  -8.8204   8.8294   18.586   7.3948   13.218   6.2321 5.368080 9.670715 
1 1 1   30   17    7 o   17.644   5.1125   1.5850   6.2929   7.7059   8.9317  -4.4485   8.8677   20.628   7.7465   14.661   6.6739 5.966506 10.22499 
1 1 1   30   17    8 o   19.635   5.2315   6.5689   5.8319   9.1769   8.4585   4.2057   8.0516   21.339   7.6128   17.932   7.1776 3.407362 10.46293 
1 1 1   30   17    9 o   34.897   4.8249   25.993   6.8004   44.262   10.678   13.526   8.8208   45.270   5.7186   24.523   7.7729 20.74730 9.649887 
1 1 1   30   17   10 o   68.957   3.0430  100.125   8.5012  104.085   13.441   97.484   10.975   69.927   4.6605   67.986   3.9140 1.940323 6.086022 
1 1 1   30   17   11 f   45.695   3.5705   44.930   6.6938   41.663   9.7186   47.879   9.2330   44.001   5.3553   47.388   4.7239 -3.387798 7.141031 
1 1 1   30   17   12 o   24.406   5.4199   13.992   6.8594   0.9368   12.191   20.040   8.2974   19.258   8.3373   29.554   6.9276 -10.29617 10.83988 
1 1 1   30   17   13 o   19.436   5.6258   4.1591   6.6830   7.1563   12.126   2.8515   8.0092   21.828   8.7832   17.044   7.0325 4.784615 11.25169 
1 1 1   30   17   14 o   63.317   3.4936   88.922   8.4913   77.395   14.403   95.062   10.512   59.554   5.8639   67.080   3.7997 -7.526447 6.987294 
1 1 1   30   17   15 o   47.323   5.0831   59.939   8.0569   30.220   13.694   75.672   9.9640   34.956   9.3258   59.691   4.0472 -24.73499 10.16620 
1 1 1   30   17   16 o   39.321   5.1285   34.562   7.4655   38.214   13.742   33.032   8.8922   39.743   8.6304   38.898   5.5427 0.8452721 10.25698 
1 1 1   30   17   17 o   41.355   5.6119   44.701   8.0410   30.423   15.471   49.985   9.4121   34.497   10.177   48.213   4.7332 -13.71577 11.22374 
1 1 1   30   17   18 f   43.491   6.1773   45.831   10.695   42.553   15.048   49.176   15.203   41.671   9.0172   45.312   8.4454 -3.641045 12.35452 
1 1 1   30   17   19 o   21.375   6.2326   3.9976   9.0472   14.094   14.256  -2.8116   11.707   25.475   9.7353   17.274   7.7850 8.200663 12.46525 
1 1 1   30   17   20 f   44.828   4.8585   47.444   8.1197   42.067   13.712   50.348   10.076   41.613   8.2803   48.044   5.0852 -6.431007 9.717084 
1 1 1   30   17   21 o   72.847   4.6659  126.751   12.976  144.271   16.474   98.119   21.060   81.350   4.9100   64.345   7.9356 17.00574 9.331769 
1 1 1   30   17   22 o   53.755   5.7305   71.453   11.347   76.269   14.035   62.362   19.283   58.457   5.8210   49.054   9.8727 9.403275 11.46102 
1 1 1   30   17   23 o   28.055   7.8677   19.881   15.500   30.166   16.545 -53.8540   44.300   32.899   10.669   23.210   11.566 9.689465 15.73539 
1 1 1   30   17   24 o   39.488   9.9702   42.405   16.241   42.405   16.241   0.0000   0.0000   39.488   9.9702  ?   ?       ?      ? 
1 1 1   30   17   25 o   24.381   7.1985   12.534   12.025   13.064   15.963   11.838   18.283   24.338   9.9719   24.423   10.384 -0.8406639E-01 14.39691 
1 1 1   30   17   26 o   34.608   7.9242   36.272   12.962   37.952   17.299   34.121   19.572   36.012   10.794   33.204   11.604 2.807884 15.84845 
1 1 1   30   18    0 o   32.613   5.3283   25.788   8.8205   25.788   8.8205   25.788   8.8205   32.613   7.5353   32.613   7.5353 0.000000 0.000000 
1 1 1   30   18    1 o   75.907   2.6239  121.011   8.2007  111.648   11.454  130.858   11.746   72.857   3.8118   78.957   3.6070 -6.100029 5.247845 
1 1 1   30   18    2 o   43.080   3.7149   39.764   6.5938   38.752   9.4587   40.721   9.1968   42.503   5.3957   43.657   5.1076 -1.153961 7.429774 
1 1 1   30   18    3 o   96.426   2.4026  194.905   9.5502  188.116   13.522  201.661   13.490   94.721   3.4613   98.131   3.3330 -3.409409 4.805167 
1 1 1   30   18    4 o   66.780   2.8112   94.143   7.7319   90.997   11.106   97.102   10.771   65.649   4.1017   67.911   3.8455 -2.262451 5.622398 
1 1 1   30   18    5 o   19.763   5.3680   6.3715   6.2792   9.1723   8.5152   3.0334   9.2964   21.334   7.6354   18.193   7.5473 3.140471 10.73597 
1 1 1   30   18    6 f   18.794   5.2819   4.9607   6.1225   4.0492   8.4387   5.9738   8.8965   18.092   7.3105   19.496   7.6258 -1.403761 10.56390 
1 1 1   30   18    7 o   55.922   3.3601   65.986   7.6955   56.202   10.369   77.979   11.481   51.296   4.9013   60.548   4.5976 -9.251747 6.720120 
1 1 1   30   18    8 o   34.213   4.9159   25.022   6.7438   35.018   10.868   18.762   8.6000   39.914   6.6014   28.511   7.2861 11.40313 9.831878 
1 1 1   30   18    9 o   27.866   5.4151   18.550   6.5166   13.769   10.329   21.711   8.3991   24.888   8.4403   30.845   6.7864 -5.957336 10.83025 
1 1 1   30   18   10 o   57.391   3.0822   70.292   7.2564   63.754   10.435   76.413   10.097   54.689   4.6264   60.093   4.0739 -5.403847 6.164436 
1 1 1   30   18   11 o   18.057   5.3836   2.5913   6.5400   1.6369   11.468   3.0513   7.9617   19.002   8.1552   17.112   7.0303 1.890266 10.76719 
1 1 1   30   18   12 o   28.641   5.8042   19.731   7.0604   17.133   12.314   21.004   8.6175   27.156   9.2156   30.127   7.0588 -2.970461 11.60833 
1 1 1   30   18   13 o   37.874   5.1733   30.963   7.4062   41.158   13.199   26.278   8.9475   41.853   7.9366   33.895   6.6379 7.958435 10.34656 
1 1 1   30   18   14 o   69.312   3.3862  102.861   9.5086  106.216   15.002  100.609   12.293   69.996   5.1966   68.629   4.3430 1.366158 6.772455 
1 1 1   30   18   15 o   22.611   6.0117   10.234   7.0989   9.3903   13.695   10.544   8.3012   23.283   9.3464   21.939   7.5636 1.344322 12.02339 
1 1 1   30   18   16 o   33.666   5.4814   29.720   7.4157   17.094   13.309   35.404   8.9302   27.002   9.5583   40.330   5.3687 -13.32807 10.96285 
1 1 1   30   18   17 o   43.053   5.4229   41.459   9.2618   52.998   15.025   34.388   11.762   48.005   7.5886   38.102   7.7488 9.903606 10.84576 
1 1 1   30   18   18 o   49.106   4.9982   53.257   9.9295   64.686   16.075   46.207   12.626   53.036   7.3490   45.175   6.7764 7.860195 9.996391 
1 1 1   30   18   19 o   36.013   5.4908   29.241   7.6297   39.551   13.164   24.026   9.3625   40.306   8.1980   31.720   7.3068 8.585531 10.98164 
1 1 1   30   18   20 o   20.936   5.9714   7.4544   8.0051   3.4671   12.858   9.9781   10.229   20.018   8.6143   21.855   8.2719 -1.836847 11.94280 
1 1 1   30   18   21 o   23.362   6.5806   10.401   10.091   16.645   12.588  -0.8298   16.881   26.070   9.2884   20.654   9.3243 5.416342 13.16121 
1 1 1   30   18   22 o   18.788   6.1067  -6.3166   11.230   3.0588   15.352 -17.1067   16.470   20.903   9.1962   16.674   8.0373 4.228170 12.21348 
1 1 1   30   18   23 o   26.793   7.2849   16.508   12.430   29.605   17.154   2.0320   18.035   32.029   10.877   21.558   9.6940 10.47092 14.56990 
1 1 1   30   18   24 o   36.155   13.789   47.770   28.566   47.770   28.566   0.0000   0.0000   36.155   13.789  ?   ?       ?      ? 
1 1 1   30   18   25 o   22.934   7.0042   8.4366   12.161   11.630   15.653   3.5736   19.315   23.635   9.7981   22.233   10.012 1.401669 14.00835 
1 1 1   30   19    0 o   9.2970   4.5105  -4.9126   7.8782  -4.9126   7.8782  -4.9126   7.8782   9.2970   6.3788   9.2970   6.3788 0.000000 0.000000 
1 1 1   30   19    1 o   54.234   3.1984   62.579   7.1387   57.729   10.064   67.490   10.127   52.057   4.6875   56.411   4.3528 -4.353565 6.396837 
1 1 1   30   19    2 o   44.195   3.6801   42.005   6.6381   49.737   9.5358   34.735   9.2462   48.283   4.7885   40.108   5.5895 8.175293 7.360158 
1 1 1   30   19    3 f   78.416   2.6004  129.391   8.4097  131.221   11.964  127.604   11.824   78.966   3.6733   77.867   3.6817 1.099442 5.200735 
1 1 1   30   19    4 o   28.565   5.1728   18.632   6.2426   24.515   9.1191   13.444   8.5639   32.757   6.9642   24.372   7.6505 8.384014 10.34557 
1 1 1   30   19    5 o   24.047   5.5243   12.959   6.3076   14.490   8.7224   11.281   9.1322   25.167   7.6919   22.927   7.9314 2.240801 11.04864 
1 1 1   30   19    6 o   21.049   5.4438   8.6704   6.2389   10.722   8.3971   6.1425   9.3216   22.305   7.6098   19.793   7.7867 2.511545 10.88770 
1 1 1   30   19    7 o   75.412   2.9088  120.288   8.9062  121.177   13.882  119.666   11.611   75.477   4.4593   75.348   3.7362 0.1285629 5.817568 
1 1 1   30   19    8 o   21.213   5.2528   5.9389   6.2739   17.858   9.9852  -1.8361   8.0646   27.600   8.1845   14.825   6.5866 12.77547 10.50567 
1 1 1   30   19    9 o   26.167   5.6325   16.097   6.6605   13.530   10.354   17.909   8.6995   24.622   8.4495   27.711   7.4504 -3.088776 11.26507 
1 1 1   30   19   10 o   26.482   6.1040   15.278   7.6707   22.462   12.177   10.552   9.8767   30.422   9.0421   22.542   8.2022 7.880255 12.20802 
1 1 1   30   19   11 f   39.850   5.5261   42.186   7.7816   26.002   14.705   48.481   9.1709   32.167   10.013   47.533   4.6779 -15.36585 11.05211 
1 1 1   30   19   12 o   69.790   3.2308  102.645   8.8987  110.695   15.159   98.412   10.992   71.486   5.1414   68.093   3.9139 3.392273 6.461576 
1 1 1   30   19   13 o   28.897   5.7151   20.708   6.9657   16.171   12.515   22.744   8.3845   26.389   9.2760   31.404   6.6787 -5.014860 11.43020 
1 1 1   30   19   14 o   46.919   4.3882   49.710   7.7509   46.027   13.796   51.409   9.3695   44.911   7.4477   48.926   4.6431 -4.015144 8.776499 
1 1 1   30   19   15 o   83.144   3.2407  148.555   11.029  147.824   16.607  149.133   14.752   82.749   4.8659   83.538   4.2816 -0.7884674 6.481473 
1 1 1   30   19   16 o   58.550   3.7349   74.729   8.4431   74.961   14.741   74.616   10.300   58.039   6.1578   59.061   4.2284 -1.021683 7.469849 
1 1 1   30   19   17 o   18.486   5.6478  -0.3481   8.5685 -13.9227   13.927   7.9198   10.869   15.867   7.5800   21.105   8.3745 -5.237471 11.29555 
1 1 1   30   19   18 o   33.036   6.5723   27.893   9.2120   29.005   14.572   27.153   11.889   33.182   9.8980   32.889   8.6492 0.2922630 13.14456 
1 1 1   30   19   19 o   39.448   5.3477   37.843   7.8852   34.307   13.816   39.551   9.6027   36.617   9.1688   42.278   5.5069 -5.661118 10.69545 
1 1 1   30   19   20 o   15.764   5.1359  -5.2468   7.7820 -11.5437   12.562  -1.3255   9.9132   15.279   7.2711   16.249   7.2553 -0.9698734 10.27175 
1 1 1   30   19   21 o   93.623   4.4262  199.692   17.025  196.915   23.042  203.030   25.263   93.288   5.9888   93.958   6.5191 -0.6707077 8.852355 
1 1 1   30   19   22 o   33.619   7.7929   32.276   12.388   26.664   16.207   40.162   19.212   30.659   10.568   36.579   11.455 -5.919579 15.58573 
1 1 1   30   19   23 o   31.147   7.5364   28.449   12.464   37.238   16.542   16.904   18.959   36.056   10.491   26.239   10.823 9.816292 15.07276 
1 1 1   30   20    0 o   69.575   2.7494  101.953   11.078  101.953   11.078  101.953   11.078   69.575   3.8883   69.575   3.8883 0.000000 0.000000 
1 1 1   30   20    1 o   86.803   2.4766  158.449   8.8661  155.934   12.512  160.986   12.565   86.101   3.5233   87.505   3.4815 -1.403870 4.953260 
1 1 1   30   20    2 o   91.014   2.4822  174.153   9.3158  178.374   13.336  170.129   13.019   92.091   3.5110   89.938   3.5097 2.152977 4.964423 
1 1 1   30   20    3 o  104.810   2.3744  230.709   10.262  236.047   14.546  225.418   14.481  106.035   3.3259  103.585   3.3894 2.450180 4.748703 
1 1 1   30   20    4 o   26.070   5.5811   15.777   6.4981   15.849   8.7519   15.689   9.7004   26.123   7.6395   26.016   8.1384 0.1068668 11.16223 
1 1 1   30   20    5 o  103.001   3.0188  223.164   11.941  219.074   14.415  232.108   21.317  102.062   3.4243  103.940   4.9726 -1.877762 6.037637 
1 1 1   30   20    6 o   33.441   5.1306   25.762   6.8636   22.940   9.3086   29.124   10.161   31.371   7.3269   35.512   7.1839 -4.140673 10.26116 
1 1 1   30   20    7 o   94.190   3.5164  187.022   13.661   0.0000   0.0000  187.022   13.661  ?   ?    94.190   3.5164      ?      ? 
1 1 1   30   20    8 o   76.608   2.9525  125.792   9.1619  120.033   14.165  129.934   12.013   74.840   4.5890   78.376   3.7162 -3.535652 5.905030 
1 1 1   30   20    9 o   41.719   4.9841   42.371   7.4957   32.765   13.078   47.071   9.1473   36.651   8.7688   46.786   4.7403 -10.13525 9.968102 
1 1 1   30   20   10 o   38.613   5.1459   34.114   7.4826   34.935   13.204   33.725   9.0817   37.949   8.6308   39.277   5.6062 -1.327343 10.29175 
1 1 1   30   20   11 o   18.905   5.5363   4.2801   6.6708   3.0881   12.117   4.7985   7.9908   19.806   8.4383   18.004   7.1691 1.801722 11.07251 
1 1 1   30   20   12 o   45.075   4.6887   47.803   7.8363   39.578   13.069   52.420   9.7917   40.824   8.0479   49.326   4.8131 -8.501419 9.377327 
1 1 1   30   20   13 o   26.974   5.9844   16.136   7.0077   22.188   12.555   13.398   8.4456   29.927   9.2421   24.020   7.6050 5.907394 11.96883 
1 1 1   30   20   14 o   23.724   5.9101   10.209   6.9059   20.617   12.513   5.6503   8.2812   28.840   9.2704   18.609   7.3334 10.23126 11.82028 
1 1 1   30   20   15 o   18.000   5.3621   3.2549   6.6365  -1.7760   12.042   5.4494   7.9533   17.768   7.9606   18.231   7.1860 -0.4630737 10.72429 
1 1 1   30   20   16 o   58.349   3.9724   80.319   8.6473   60.688   14.586   90.957   10.738   51.488   6.8688   65.211   3.9923 -13.72334 7.944714 
1 1 1   30   20   17 o   31.166   6.8138   27.096   10.156   13.994   19.333   32.089   11.935   26.231   10.883   36.102   8.2020 -9.871407 13.62761 
1 1 1   30   20   18 o   45.850   5.4752   51.119   9.5956   46.080   15.600   54.186   12.170   42.573   9.1561   49.126   6.0065 -6.553169 10.95047 
1 1 1   30   20   19 o   22.123   5.9923   10.192   7.2761   11.129   12.979   9.7632   8.7867   23.132   9.1601   21.115   7.7282 2.017632 11.98465 
1 1 1   30   20   20 o   29.357   6.1936   23.136   8.4735   15.157   13.424   28.421   10.925   25.006   9.4730   33.709   7.9816 -8.703012 12.38727 
1 1 1   30   20   21 o   20.190   6.4163   0.8282   11.097  -0.7916   14.946   2.8183   16.566   19.295   8.7365   21.085   9.3994 -1.790001 12.83260 
1 1 1   30   20   22 o   42.683   7.2717   50.712   12.588   50.046   16.806   51.562   18.998   43.035   9.7006   42.331   10.835 0.7037735 14.54334 
1 1 1   30   21    0 o   14.211   6.2903   3.5219   10.754   3.5219   10.754   3.5219   10.754   14.211   8.8958   14.211   8.8958 0.000000 0.000000 
1 1 1   30   21    2 o   63.464   3.1237   86.948   8.0819   77.978   11.935   94.545   10.983   60.205   4.8065   66.723   3.9911 -6.518097 6.247483 
1 1 1   30   21    3 o   43.017   3.7947   40.261   6.7248   39.380   9.6724   41.085   9.3560   42.498   5.5183   43.536   5.2105 -1.038151 7.589499 
1 1 1   30   21    4 o   57.225   3.3622   71.263   7.8186   77.345   10.527   63.779   11.677   60.224   4.2379   54.227   5.2210 5.996895 6.724475 
1 1 1   30   21    5 o   25.284   5.3477   14.524   6.7049   23.011   9.2297   5.0407   9.7567   31.313   7.2839   19.254   7.8316 12.05891 10.69531 
1 1 1   30   21    6 o   30.433   5.2880   20.055   6.7818   33.776   10.960   11.541   8.6331   38.135   7.2326   22.731   7.7162 15.40372 10.57598 
1 1 1   30   21    7 o   71.067   3.0482  107.225   8.8120  111.572   13.744  104.192   11.482   72.101   4.6219   70.033   3.9753 2.067917 6.096317 
1 1 1   30   21    8 o   42.752   4.1048   41.661   6.6275   26.496   9.3302   57.106   9.4157   33.836   6.9192   51.667   4.4185 -17.83138 8.209606 
1 1 1   30   21    9 o   60.108   3.5045   79.028   8.2333   74.635   13.819   81.445   10.251   58.329   5.7442   61.887   4.0162 -3.558105 7.008924 
1 1 1   30   21   10 o   57.398   3.5935   70.012   8.0973   76.029   13.962   66.962   9.9396   58.828   5.7545   55.969   4.3058 2.858967 7.187075 
1 1 1   30   21   11 o   29.720   5.6217   22.485   7.1348   15.200   12.184   26.286   8.8016   25.642   9.1381   33.799   6.5504 -8.157324 11.24331 
1 1 1   30   21   12 o   98.221   2.7414  204.667   10.723  207.878   17.655  202.790   13.498   98.436   4.3486   98.006   3.3392 0.4295349 5.482723 
1 1 1   30   21   13 o   43.279   5.8072   44.530   9.4531   46.248   16.724   43.724   11.459   42.435   9.7592   44.123   6.2970 -1.688095 11.61439 
1 1 1   30   21   14 f   57.495   4.0931   74.153   9.5733   68.285   14.362   78.846   12.843   55.020   6.3288   59.969   5.1923 -4.948593 8.186209 
1 1 1   30   21   15 o   42.531   4.9611   43.100   7.8361   38.867   13.446   45.277   9.6427   39.623   8.4840   45.440   5.1451 -5.817287 9.922191 
1 1 1   30   21   16 o   18.760   5.5703   3.4866   6.9636   7.1228   11.902   1.5938   8.5868   21.023   8.6115   16.497   7.0678 4.526049 11.14054 
1 1 1   30   21   17 o   31.376   6.5154   25.600   8.9523   25.977   13.446   25.301   11.998   31.374   9.5421   31.379   8.8741 -0.5010605E-02 13.03077 
1 1 1   30   21   18 o   82.528   3.7022  150.698   12.461  153.026   19.119  148.978   16.431   82.656   5.6081   82.399   4.8347 0.2574615 7.404428 
1 1 1   30   21   19 o   63.382   4.1040   88.516   10.486  102.402   17.121   80.181   13.264   66.849   6.2096   59.916   5.3676 6.933582 8.207927 
1 1 1   30   21   20 f   42.346   5.2552   43.707   8.8406   41.072   13.323   45.780   11.817   40.251   8.3007   44.440   6.4473 -4.189041 10.51045 
1 1 1   30   21   21 o   32.982   7.6317   31.200   12.051   24.200   16.066   40.206   18.224   29.209   10.484   36.755   11.093 -7.545639 15.26337 
1 1 1   30   22    0 f   99.505   2.4080  207.156   13.939  207.156   13.939  207.156   13.939   99.505   3.4054   99.505   3.4054 0.000000 0.000000 
1 1 1   30   22    1 o   80.163   2.6128  135.976   8.6371  132.516   12.163  139.495   12.267   79.116   3.7276   81.209   3.6623 -2.093208 5.225601 
1 1 1   30   22    2 o   99.265   2.4395  207.828   9.9871  204.865   14.068  210.838   14.180   98.545   3.4613   99.986   3.4386 -1.440903 4.879005 
1 1 1   30   22    4 o   86.356   2.7428  157.286   9.7060  150.120   12.899  166.638   14.736   84.204   3.7143   88.508   4.0367 -4.303490 5.485506 
1 1 1   30   22    5 o   49.138   4.0700   52.877   8.2188   59.263   11.917   47.084   11.350   52.066   5.5494   46.211   5.9550 5.855530 8.139921 
1 1 1   30   22    6 o   70.110   4.1024  111.770   10.117  100.199   19.810  115.853   11.767   66.350   7.2390   73.870   3.8621 -7.520409 8.204859 
1 1 1   30   22    7 o   94.034   2.6503  187.678   10.225  185.986   15.209  189.073   13.813   93.508   3.9436   94.560   3.5418 -1.052193 5.300577 
1 1 1   30   22    8 o   30.043   5.6047   23.272   7.2234   14.526   12.365   27.802   8.8998   25.261   9.1796   34.825   6.4332 -9.563978 11.20944 
1 1 1   30   22    9 o   61.446   4.1372   80.028   10.171   98.744   17.101   69.786   12.651   66.480   6.2369   56.412   5.4374 10.06850 8.274329 
1 1 1   30   22   10 o   83.562   3.3174  145.192   10.261  164.871   19.872  138.038   11.982   86.468   5.5720   80.656   3.6018 5.812836 6.634736 
1 1 1   30   22   11 o   44.155   4.8242   46.093   7.8678   41.293   13.545   48.538   9.6658   41.126   8.2718   47.184   4.9668 -6.058304 9.648429 
1 1 1   30   22   12 o   69.999   3.3229  106.818   9.0533  104.719   15.478  107.910   11.162   68.873   5.4488   71.125   3.8049 -2.251808 6.645788 
1 1 1   30   22   13 o   45.913   5.1039   55.979   8.0461   32.368   13.711   68.381   9.9371   35.467   9.2696   56.360   4.2749 -20.89322 10.20787 
1 1 1   30   22   14 o   15.345   4.9954  -4.0881   6.9546  -8.2231   12.388  -2.1851   8.4038   15.983   7.4871   14.707   6.6150 1.275465 9.990722 
1 1 1   30   22   15 o   23.176   5.8889   12.483   7.0342   10.853   12.114   13.313   8.6401   22.773   8.9010   23.579   7.7129 -0.8060493 11.77779 
1 1 1   30   22   16 o   34.602   6.1344   30.390   8.9278   40.385   13.179   21.913   12.137   40.249   8.2170   28.956   9.1107 11.29314 12.26885 
1 1 1   30   22   17 o   23.015   6.2049   11.466   8.5726   4.7000   12.564   17.360   11.726   19.988   8.5560   26.042   8.9889 -6.053717 12.40989 
1 1 1   30   22   18 o   38.498   6.3047   39.795   10.049   31.062   15.595   45.997   13.141   33.068   10.315   43.928   7.2529 -10.86050 12.60950 
1 1 1   30   22   19 o   16.241   5.2803  -5.0755   8.4045 -16.9935   14.150   1.4207   10.447   15.051   7.3017   17.432   7.6296 -2.381178 10.56055 
1 1 1   30   23    0 o   8.9409   4.3840  -6.0676   7.9370  -6.0676   7.9370  -6.0676   7.9370   8.9409   6.1998   8.9409   6.1998 0.000000 0.000000 
1 1 1   30   23    1 o   26.452   5.3719   16.670   6.1906   18.351   8.7834   15.011   8.7266   27.733   7.4989   25.172   7.6939 2.561558 10.74379 
1 1 1   30   23    2 o   18.877   5.3294   4.8500   6.3990   1.1000   8.7828   9.0928   9.3422   16.556   7.1221   21.197   7.9300 -4.641075 10.65872 
1 1 1   30   23    3 o   86.352   2.7763  158.252   9.8374  153.348   13.178  164.423   14.784   84.961   3.7608   87.744   4.0852 -2.783508 5.552691 
1 1 1   30   23    4 o   39.549   5.8039   37.444   9.1412   31.694   12.306   44.523   13.654   35.944   8.4445   43.155   7.9644 -7.211052 11.60782 
1 1 1   30   23    5 o   61.462   3.8273   83.066   9.6826   86.442   13.488   79.476   13.908   62.897   5.1995   60.028   5.6176 2.869255 7.654502 
1 1 1   30   23    6 o   24.669   5.5188   14.492   6.3307   16.223   8.8079   12.642   9.1054   25.976   7.6831   23.362   7.9245 2.614136 11.03756 
1 1 1   30   23    7 o   17.576   5.3506   2.0198   6.7137   0.4330   11.817   2.7761   8.1584   18.332   8.0667   16.820   7.0316 1.512672 10.70121 
1 1 1   30   23    8 o   71.278   3.2426  110.465   9.1250  107.990   15.143  111.876   11.434   70.138   5.2348   72.417   3.8281 -2.278442 6.485219 
1 1 1   30   23    9 o   38.949   5.1570   34.500   7.7747   40.043   13.268   31.602   9.5946   40.436   8.2350   37.462   6.2098 2.974873 10.31393 
1 1 1   30   23   10 o   67.804   3.6669  102.906   10.011   86.434   14.962  116.258   13.471   62.250   5.8276   73.357   4.4524 -11.10640 7.333867 
1 1 1   30   23   11 f   39.567   5.3617   36.146   8.4933   46.911   13.269   28.674   11.055   44.964   7.1548   34.169   7.9874 10.79447 10.72331 
1 1 1   30   23   12 o   22.910   5.9303   10.495   6.9588   17.271   12.321   7.3215   8.4327   26.343   9.2069   19.477   7.4770 6.865339 11.86055 
1 1 1   30   23   13 o   27.776   4.9775   20.485   7.3499  -1.7627   12.644   31.839   9.0329   17.906   8.0782   37.645   5.8177 -19.73882 9.955029 
1 1 1   30   23   14 o   14.926   4.8968  -4.5360   6.7092  -6.4151   12.130  -3.7078   8.0531   16.131   7.5076   13.721   6.2890 2.410882 9.793628 
1 1 1   30   23   15 o   25.740   5.9000   12.474   7.5864   30.359   13.073   3.3916   9.3155   33.835   9.1483   17.646   7.4530 16.18898 11.79993 
1 1 1   30   23   16 o   83.294   3.4716  153.365   11.858  133.867   16.561  173.880   16.988   77.545   5.1781   89.042   4.6257 -11.49721 6.943272 
1 1 1   30   23   17 o   31.795   5.4944   25.563   9.1931   2.0070   13.457   46.180   12.589   19.340   8.5544   44.250   6.8977 -24.91031 10.98885 
1 1 1   30   24    0 o   57.903   3.1761   71.989   10.579   71.989   10.579   71.989   10.579   57.903   4.4917   57.903   4.4917 0.000000 0.000000 
1 1 1   30   24    1 o   46.669   4.1791   49.062   7.9315   45.111   11.900   52.220   10.639   44.610   6.4679   48.728   5.2937 -4.117985 8.358104 
1 1 1   30   24    2 o   33.701   4.9187   27.447   6.7528   16.916   9.6927   37.379   9.4132   26.307   8.1198   41.095   5.5538 -14.78776 9.837471 
1 1 1   30   24    3 o   80.463   3.1264  140.025   10.340  135.410   15.090  144.111   14.197   79.038   4.6290   81.887   4.2036 -2.849792 6.252777 
1 1 1   30   24    4 o   40.401   4.9300   37.646   8.0227   41.825   11.977   34.245   10.805   42.738   6.7947   38.064   7.1450 4.674145 9.859910 
1 1 1   30   24    5 o   50.250   3.5172   55.452   7.2438   50.315   10.457   60.192   10.045   47.808   5.3030   52.692   4.6219 -4.884304 7.034420 
1 1 1   30   24    6 o   50.881   4.4985   62.950   8.1519   47.598   13.996   70.833   10.029   44.386   7.9364   57.376   4.2379 -12.99001 8.996999 
1 1 1   30   24    7 o   46.267   4.8383   54.039   7.8563   37.237   13.405   62.829   9.6958   38.575   8.6403   53.958   4.3567 -15.38323 9.676579 
1 1 1   30   24    8 o   55.829   3.9059   71.319   8.3647   62.133   14.128   76.276   10.379   52.154   6.5681   59.504   4.2292 -7.349804 7.811883 
1 1 1   30   24    9 o   33.911   5.5972   28.505   7.3643   27.549   12.846   28.973   8.9880   32.548   9.1745   35.273   6.4143 -2.724922 11.19438 
1 1 1   30   24   10 o   68.557   3.4205  105.667   9.1899   92.497   14.942  113.680   11.655   64.313   5.6331   72.801   3.8816 -8.488571 6.840903 
1 1 1   30   24   11 o   37.571   5.2465   34.520   7.4656   32.110   12.938   35.724   9.1411   35.181   8.9075   39.961   5.5462 -4.780025 10.49307 
1 1 1   30   24   12 o   17.385   5.3522   1.5900   6.8077   2.9921   11.838   0.8972   8.3214   18.962   8.2124   15.808   6.8659 3.154135 10.70435 
1 1 1   30   24   13 o   37.379   5.2931   33.143   7.5605   36.562   13.255   31.495   9.2046   37.592   8.7183   37.165   6.0049 0.4269028 10.58623 
1 1 1   30   24   14 o   22.438   5.9680   10.731   7.2265   15.752   12.274   8.0675   8.9406   24.993   9.1358   19.884   7.6813 5.108562 11.93593 
1 1 1   30   24   15 o   17.842   5.4572  -1.7210   8.3138 -16.1176   12.429   9.9379   11.185   14.027   6.8136   21.658   8.5264 -7.630917 10.91445 
1 1 1   30   25    0 o   17.333   6.5039   10.109   8.8564   10.109   8.8564   10.109   8.8564   17.333   9.1979   17.333   9.1979 0.000000 0.000000 
1 1 1   30   25    1 o   37.875   4.9957   34.793   7.3787   28.512   11.475   39.221   9.6348   33.763   8.2989   41.987   5.5636 -8.224094 9.991323 
1 1 1   30   25    2 o   62.799   3.5270   86.621   9.1009   84.903   13.367   88.106   12.426   62.035   5.2243   63.562   4.7397 -1.527397 7.053995 
1 1 1   30   25    3 o   16.666   5.1796   0.1919   6.8165   0.9000   10.340  -0.3525   9.0656   17.383   7.5997   15.950   7.0398 1.433249 10.35927 
1 1 1   30   25    4 o   63.042   3.2171   85.821   8.3351   79.312   11.231   93.803   12.437   60.429   4.5060   65.654   4.5928 -5.224640 6.434115 
1 1 1   30   25    5 o   26.621   5.7913   18.426   7.1749   12.121   12.446   21.563   8.7808   23.424   9.0590   29.818   7.2174 -6.394213 11.58261 
1 1 1   30   25    6 o   45.586   4.4135   44.743   7.8981   56.506   13.962   39.207   9.5779   49.283   6.8689   41.890   5.5437 7.393215 8.826930 
1 1 1   30   25    7 o   24.680   6.5124   13.938   7.8557   15.250   17.282   13.597   8.8195   25.699   10.435   23.661   7.7951 2.038622 13.02482 
1 1 1   30   25    8 o   79.007   3.1864  133.270   10.033  147.381   16.782  125.421   12.517   81.718   4.9792   76.295   3.9776 5.422691 6.372879 
1 1 1   30   25    9 o   40.953   5.3446   46.072   7.9836   26.308   13.526   56.639   9.8902   31.113   9.5903   50.794   4.7209 -19.68163 10.68923 
1 1 1   30   25   10 o   33.460   5.7050   26.426   7.4064   35.258   13.125   22.300   8.9712   36.829   8.7670   30.091   7.3024 6.737673 11.40991 
1 1 1   30   25   11 o  101.252   2.8489  227.819   11.472  191.057   17.783  254.025   15.014   93.318   4.6204  109.185   3.3341 -15.86734 5.697752 
1 1 1   30   25   12 o   12.769   4.3643 -10.8148   6.5768 -17.3879   11.934  -7.9479   7.8816   13.424   6.5556   12.113   5.7632 1.311141 8.728699 
1 1 1   30   26    0 o   15.220   6.4653   6.6051   10.343   6.6051   10.343   6.6051   10.343   15.220   9.1434   15.220   9.1434 0.000000 0.000000 
1 1 1   30   26    1 o   17.245   5.2074   1.5590   6.6014   6.7148   10.095  -2.2925   8.7254   19.693   7.9823   14.796   6.6897 4.896194 10.41487 
1 1 1   30   26    2 o   58.674   3.7092   77.670   8.8220   65.187   12.845   88.816   12.137   53.663   5.8036   63.684   4.6209 -10.02097 7.418478 
1 1 1   30   26    3 o   23.469   5.5661   13.468   6.3649   14.344   8.8484   12.529   9.1626   24.104   7.8005   22.835   7.9421 1.268522 11.13211 
1 1 1   30   26    4 o   47.683   4.2539   51.627   7.9854   52.600   13.415   51.092   9.9380   47.333   6.8715   48.034   5.0163 -0.7009239 8.507714 
1 1 1   30   26    5 o   40.739   5.3040   59.651   8.9323   2.6024   18.320   77.442   10.231   21.700   9.7628   59.778   4.1495 -38.07848 10.60806 
1 1 1   30   26    6 f   32.485   5.8006   25.341   7.3419   32.373   13.205   22.194   8.8330   34.917   9.0830   30.052   7.2172 4.864830 11.60118 
1 1 1   30   26    7 o   45.964   4.4491   43.386   7.7599   71.530   13.949   30.772   9.3385   55.902   6.0497   36.025   6.5252 19.87712 8.898170 
1 1 1   30   26    8 o   33.663   5.6802   28.634   7.3707   28.827   13.264   28.548   8.8657   32.596   9.3681   34.729   6.4262 -2.132698 11.36031 
1 1 1   30   26    9 o   20.206   5.7527   7.7059   7.2211   5.6240   12.324   8.7942   8.9109   20.120   8.5392   20.292   7.7107 -0.1727009 11.50541 
1 1 1   30   27    0 o   53.942   4.1708   65.101   12.724   65.101   12.724   65.101   12.724   53.942   5.8984   53.942   5.8984 0.000000 0.000000 
1 1 1   30   27    1 o   39.747   5.2812   39.085   8.3262   52.330   11.891   26.344   11.662   47.811   6.0301   31.684   8.6718 16.12730 10.56234 
1 1 1   31    0    1 o   65.436   3.6628   90.889   13.778   90.889   13.778   90.889   13.778   65.436   5.1800   65.436   5.1800 0.000000 0.000000 
1 1 1   31    0    2 o   9.7601   4.8156  -9.2608   9.9833  -9.2608   9.9833  -9.2608   9.9833   9.7601   6.8103   9.7601   6.8103 0.000000 0.000000 
1 1 1   31    0    3 o  136.275   2.9763  386.839   23.607  386.839   23.607  386.839   23.607  136.275   4.2092  136.275   4.2092 0.000000 0.000000 
1 1 1   31    0    4 o   13.820   6.1936   1.8544   10.790   1.8544   10.790   1.8544   10.790   13.820   8.7591   13.820   8.7591 0.000000 0.000000 
1 1 1   31    0    5 o  120.183   3.0081  301.214   21.027  301.214   21.027  301.214   21.027  120.183   4.2540  120.183   4.2540 0.000000 0.000000 
1 1 1   31    0    6 o   83.005   3.2943  144.700   15.835  144.700   15.835  144.700   15.835   83.005   4.6588   83.005   4.6588 0.000000 0.000000 
1 1 1   31    0    7 o   14.548   6.1420   4.9764   9.2193   4.9764   9.2193   4.9764   9.2193   14.548   8.6861   14.548   8.6861 0.000000 0.000000 
1 1 1   31    0    8 o   22.315   6.5886   14.849   8.5813   14.849   8.5813   14.849   8.5813   22.315   9.3177   22.315   9.3177 0.000000 0.000000 
1 1 1   31    0    9 o   61.881   2.9782   80.647   10.635   80.647   10.635   80.647   10.635   61.881   4.2119   61.881   4.2119 0.000000 0.000000 
1 1 1   31    0   10 o   46.458   3.5879   46.539   9.4279   46.539   9.4279   46.539   9.4279   46.458   5.0741   46.458   5.0741 0.000000 0.000000 
1 1 1   31    0   11 o   62.732   2.9068   82.780   10.532   82.780   10.532   82.780   10.532   62.732   4.1109   62.732   4.1109 0.000000 0.000000 
1 1 1   31    0   12 o   48.117   3.4888   49.748   9.5557   49.748   9.5557   49.748   9.5557   48.117   4.9339   48.117   4.9339 0.000000 0.000000 
1 1 1   31    0   13 o   80.386   2.5780  134.961   12.031  134.961   12.031  134.961   12.031   80.386   3.6458   80.386   3.6458 0.000000 0.000000 
1 1 1   31    0   14 o   16.163   6.7153   6.8762   10.709   6.8762   10.709   6.8762   10.709   16.163   9.4968   16.163   9.4968 0.000000 0.000000 
1 1 1   31    0   15 o   28.242   8.6461   24.859   14.690   24.859   14.690   24.859   14.690   28.242   12.227   28.242   12.227 0.000000 0.000000 
1 1 1   31    0   16 o   51.650   4.0289   57.910   11.761   57.910   11.761   57.910   11.761   51.650   5.6978   51.650   5.6978 0.000000 0.000000 
1 1 1   31    0   17 o   58.666   3.0581   72.882   10.334   72.882   10.334   72.882   10.334   58.666   4.3248   58.666   4.3248 0.000000 0.000000 
1 1 1   31    0   18 o   11.838   5.3567   0.8673   8.3079   0.8673   8.3079   0.8673   8.3079   11.838   7.5755   11.838   7.5755 0.000000 0.000000 
1 1 1   31    0   19 o   71.566   2.7994  107.621   11.604  107.621   11.604  107.621   11.604   71.566   3.9589   71.566   3.9589 0.000000 0.000000 
1 1 1   31    0   20 o   53.721   4.1061   62.901   12.486   62.901   12.486   62.901   12.486   53.721   5.8070   53.721   5.8070 0.000000 0.000000 
1 1 1   31    0   21 o   16.347   6.8420   7.1960   11.263   7.1960   11.263   7.1960   11.263   16.347   9.6760   16.347   9.6760 0.000000 0.000000 
1 1 1   31    0   22 o   68.108   3.4911   98.943   13.701   98.943   13.701   98.943   13.701   68.108   4.9372   68.108   4.9372 0.000000 0.000000 
1 1 1   31    0   23 o   15.012   7.0074  -1.0731   15.846  -1.0731   15.846  -1.0731   15.846   15.012   9.9100   15.012   9.9100 0.000000 0.000000 
1 1 1   31    0   24 o   39.615   9.7092   46.882   20.240   46.882   20.240   46.882   20.240   39.615   13.731   39.615   13.731 0.000000 0.000000 
1 1 1   31    0   25 o   66.667   6.0763  102.007   22.549  102.007   22.549  102.007   22.549   66.667   8.5932   66.667   8.5932 0.000000 0.000000 
1 1 1   31    0   26 o   26.530   12.106   21.964   43.579   21.964   43.579   21.964   43.579   26.530   17.121   26.530   17.121 0.000000 0.000000 
1 1 1   31    0   27 o   47.591   15.481   97.768   47.135   97.768   47.135   97.768   47.135   47.591   21.894   47.591   21.894 0.000000 0.000000 
1 1 1   31    1    0 o   8.3999   4.2625 -16.0756   9.9363 -16.0756   9.9363 -16.0756   9.9363   8.3999   6.0280   8.3999   6.0280 0.000000 0.000000 
1 1 1   31    1    1 o   92.643   3.1605  179.876   12.076  178.844   17.002  180.927   17.155   92.377   4.4625   92.909   4.4768 -0.5317612 6.321011 
1 1 1   31    1    2 o   61.148   3.6872   78.836   9.2843   84.657   13.235   73.195   13.028   63.410   5.0604   58.887   5.3640 4.523579 7.374341 
1 1 1   31    1    3 o   24.398   6.0009   11.636   7.5307   7.8178   10.503   15.676   10.803   21.912   8.3605   26.884   8.6107 -4.972773 12.00174 
1 1 1   31    1    4 o   79.414   3.3398  131.765   10.852  110.227   14.818  156.671   15.935   72.377   4.9641   86.451   4.4692 -14.07459 6.679508 
1 1 1   31    1    5 o   32.696   5.8951   24.176   7.9817   25.709   11.319   22.661   11.257   33.736   8.2121   31.656   8.4599 2.079771 11.79017 
1 1 1   31    1    6 o   73.148   3.2354  113.268   9.6467  120.368   12.965  104.464   14.439   75.852   4.1442   70.444   4.9696 5.408264 6.470798 
1 1 1   31    1    7 o   14.089   4.5437  -5.5348   5.9839 -10.4135   8.9694  -1.6217   8.0329   13.030   6.1844   15.148   6.6585 -2.117696 9.087493 
1 1 1   31    1    8 o   20.246   5.1223   5.8332   6.0329   13.623   8.5924  -1.7408   8.4724   24.967   7.6350   15.525   6.8309 9.442417 10.24470 
1 1 1   31    1    9 o   63.038   2.9161   83.377   7.5556   76.234   10.757   90.333   10.615   60.320   4.3236   65.755   3.9142 -5.434841 5.832156 
1 1 1   31    1   10 o  137.900   2.2476  395.519   12.783  401.802   18.135  389.317   18.020  138.994   3.1635  136.807   3.1936 2.187546 4.495200 
1 1 1   31    1   11 o   82.379   2.5206  141.434   8.5580  134.182   11.975  149.005   12.235   80.207   3.6199   84.551   3.5084 -4.343094 5.041109 
1 1 1   31    1   12 o   70.045   2.7047  102.543   7.8131  101.075   10.968  104.055   11.133   69.536   3.8243   70.553   3.8258 -1.017220 5.409406 
1 1 1   31    1   13 o   56.111   3.1170   66.230   7.2045   70.320   10.225   62.198   10.152   57.862   4.2846   54.361   4.5282 3.501720 6.233969 
1 1 1   31    1   14 o  104.438   2.8437  228.807   12.242  224.935   17.513  232.507   17.120  103.540   4.1009  105.337   3.9407 -1.797478 5.687387 
1 1 1   31    1   15 o   71.501   3.8917  106.816   11.120  116.576   18.451  101.250   13.934   73.787   6.0629   69.216   4.8810 4.570808 7.783493 
1 1 1   31    1   16 o  137.634   2.6165  396.356   14.850  407.784   21.216  385.381   20.791  139.586   3.6851  135.681   3.7153 3.904755 5.232950 
1 1 1   31    1   17 o   30.247   5.0248   20.741   6.1736   22.743   8.6941   18.705   8.7680   31.808   6.8310   28.686   7.3711 3.122208 10.04961 
1 1 1   31    1   18 o   16.127   4.8873   0.2131   5.8307   2.0079   8.4156  -1.4438   8.0859   17.099   7.1445   15.155   6.6707 1.944270 9.774550 
1 1 1   31    1   19 o   96.856   2.4443  196.193   9.7571  185.889   13.576  207.201   14.032   94.213   3.4939   99.499   3.4194 -5.286240 4.888666 
1 1 1   31    1   20 o   61.704   3.5654   81.322   9.0733   80.299   12.753   82.371   12.911   61.310   5.0434   62.097   5.0412 -0.7870293 7.130888 
1 1 1   31    1   21 o   51.139   4.2128   56.767   8.8796   53.969   12.421   59.691   12.699   49.813   6.0457   52.466   5.8686 -2.652687 8.425562 
1 1 1   31    1   22 o   28.298   6.2502   18.759   8.1021   17.068   11.217   20.603   11.716   27.138   8.7826   29.458   8.8952 -2.319876 12.50033 
1 1 1   31    1   23 o   29.440   6.7290   22.944   10.513   30.124   11.576 -10.8717   25.121   35.725   8.0493   23.155   10.785 12.57049 13.45800 
1 1 1   31    1   24 o   51.605   7.2686   67.162   14.915   64.011   21.405   70.136   20.795   50.001   10.702   53.209   9.8381 -3.208115 14.53719 
1 1 1   31    1   25 o   63.735   5.9001   94.896   15.499   90.767   21.814   99.105   22.024   62.189   8.5047   65.280   8.1800 -3.090935 11.80015 
1 1 1   31    1   26 o   21.160   6.7754  -4.3840   13.014   4.5748   18.228 -13.6995   18.587   23.328   10.147   18.992   8.9812 4.336460 13.55080 
1 1 1   31    1   27 f   64.680   6.4396  101.647   17.134   95.224   23.233  109.309   25.371   62.564   9.0036   66.797   9.2092 -4.233021 12.87921 
1 1 1   31    1   28 o   39.009   12.756   46.219   23.633   0.0000   0.0000   46.219   23.633  ?   ?    39.009   12.756      ?      ? 
1 1 1   31    2    0 o   22.842   7.6022   16.399   11.404   16.399   11.404   16.399   11.404   22.842   10.751   22.842   10.751 0.000000 0.000000 
1 1 1   31    2    1 o   82.897   3.2601  144.183   11.147  144.017   15.772  144.349   15.755   82.847   4.6158   82.946   4.6052 -0.9880829E-01 6.520284 
1 1 1   31    2    2 o   36.412   5.4187   29.592   7.8825   32.492   11.295   26.839   11.006   38.256   7.4260   34.567   7.8932 3.689491 10.83733 
1 1 1   31    2    3 o   24.419   5.7828   10.904   7.6278   1.1172   10.948   20.138   10.634   18.909   8.0376   29.930   8.3161 -11.02037 11.56551 
1 1 1   31    2    4 o   18.394   5.5155   0.8880   7.2779  -1.1965   9.9614   3.2747   10.659   17.128   7.4746   19.659   8.1125 -2.531109 11.03096 
1 1 1   31    2    5 o   30.425   5.9525   20.856   7.7458   22.894   10.966   18.826   10.943   31.832   8.2754   29.017   8.5586 2.815434 11.90510 
1 1 1   31    2    6 o   32.739   5.3032   23.986   7.0272   20.686   9.8253   27.442   10.055   30.335   7.8073   35.143   7.1794 -4.808285 10.60648 
1 1 1   31    2    7 o   64.791   3.0456   88.133   8.0811   86.219   12.095   89.676   10.861   64.090   4.5755   65.493   4.0208 -1.403168 6.091192 
1 1 1   31    2    8 o   72.924   2.7922  111.503   8.3490  107.220   12.353  115.104   11.328   71.571   4.1848   74.276   3.6977 -2.704857 5.584406 
1 1 1   31    2    9 o   96.004   2.3904  191.926   9.4648  190.608   13.385  193.244   13.386   95.671   3.3921   96.337   3.3688 -0.6655731 4.780733 
1 1 1   31    2   10 o   82.043   2.5490  140.333   8.6228  139.725   12.033  140.975   12.362   81.871   3.5635   82.216   3.6457 -0.3447342 5.098063 
1 1 1   31    2   11 o   81.958   2.5258  139.969   8.5325  147.173   12.237  133.153   11.903   84.019   3.5314   79.897   3.6122 4.122116 5.051584 
1 1 1   31    2   12 o   40.704   4.1945   36.672   6.4681   22.519   8.9865   51.885   9.3170   31.733   7.0494   49.674   4.5476 -17.94114 8.388992 
1 1 1   31    2   13 o   77.795   2.5945  126.392   8.3190  120.100   11.586  133.089   11.953   75.787   3.7065   79.802   3.6314 -4.015007 5.188974 
1 1 1   31    2   14 o   67.121   3.9370   94.059   10.663  104.644   17.286   87.557   13.547   69.946   5.9918   64.297   5.1086 5.649437 7.873947 
1 1 1   31    2   15 o   59.447   4.3893   76.310   10.375   73.790   16.909   77.832   13.139   58.330   7.0283   60.564   5.2598 -2.234222 8.778534 
1 1 1   31    2   16 o   37.278   4.6298   30.042   6.9141   25.087   9.2559   36.298   10.400   33.451   6.9365   41.106   6.1341 -7.655621 9.259669 
1 1 1   31    2   17 o   40.872   4.2048   36.237   6.9951   38.849   9.4092   33.010   10.459   42.692   5.3437   39.052   6.4936 3.640335 8.409675 
1 1 1   31    2   18 o   50.159   3.4442   53.397   7.1103   57.756   10.122   49.150   9.9903   52.230   4.6987   48.089   5.0370 4.141121 6.888319 
1 1 1   31    2   19 o   19.309   5.5001   1.1709   7.1581   11.771   11.168  -6.2209   9.3257   24.109   8.7295   14.509   6.6932 9.599404 11.00016 
1 1 1   31    2   20 o   19.707   5.6233   3.1738   6.6633   10.950   12.097  -0.2132   7.9837   23.874   9.0051   15.541   6.7374 8.333538 11.24657 
1 1 1   31    2   21 o   35.553   5.8684   29.863   8.4862   34.072   11.900   25.506   12.105   38.383   7.7831   32.723   8.7848 5.660191 11.73671 
1 1 1   31    2   22 o  101.492   2.8605  217.874   11.973  221.427   17.041  214.409   16.826  102.314   4.0384  100.671   4.0525 1.643311 5.721077 
1 1 1   31    2   23 o   38.262   5.9694   39.731   9.7434   53.873   12.232   15.184   16.115   49.617   5.9774   26.908   10.335 22.70879 11.93885 
1 1 1   31    2   24 o   41.445   6.8216   38.436   12.655   16.384   16.152   73.481   20.362   27.199   10.370   55.690   8.8652 -28.49044 13.64312 
1 1 1   31    2   25 f   36.172   7.8729   33.787   13.857   18.449   19.333   49.994   19.873   28.684   11.235   43.660   11.032 -14.97666 15.74579 
1 1 1   31    2   26 f   33.934   8.1797   28.623   14.327   45.932   21.832   15.532   18.987   40.565   12.119   27.303   10.989 13.26165 16.35934 
1 1 1   31    2   27 o   48.351   8.0173   63.253   15.656   59.877   21.114   67.376   23.334   47.189   11.044   49.513   11.625 -2.323730 16.03452 
1 1 1   31    2   28 o   38.134   12.889   44.575   24.087   0.0000   0.0000   44.575   24.087  ?   ?    38.134   12.889      ?      ? 
1 1 1   31    3    0 o   98.789   3.1321  204.079   17.965  204.079   17.965  204.079   17.965   98.789   4.4294   98.789   4.4294 0.000000 0.000000 
1 1 1   31    3    1 o   49.738   4.2918   52.713   8.7486   59.770   12.437   45.801   12.309   53.135   5.6751   46.341   6.4399 6.793934 8.583667 
1 1 1   31    3    2 o  134.182   2.9976  376.805   16.588  377.701   23.612  375.931   23.310  134.329   4.2618  134.035   4.2165 0.2941132 5.995191 
1 1 1   31    3    3 o   71.634   3.4472  107.829   10.169  116.233   14.589   99.886   14.182   74.380   4.7555   68.887   4.9917 5.493042 6.894322 
1 1 1   31    3    4 o   32.338   5.8312   23.629   7.8014   23.793   11.038   23.465   11.027   32.451   8.2340   32.224   8.2590 0.2263145 11.66231 
1 1 1   31    3    5 o   91.757   2.9867  175.378   11.194  182.301   17.196  170.286   14.746   93.238   4.4717   90.275   3.9605 2.963173 5.973374 
1 1 1   31    3    6 o   90.685   2.7381  171.702   10.239  166.829   14.353  176.751   14.610   89.368   3.8939   92.001   3.8504 -2.632103 5.476165 
1 1 1   31    3    7 o   67.032   2.9671   93.951   8.1602   95.089   12.209   93.032   10.971   67.350   4.3951   66.714   3.9871 0.6364822 5.934154 
1 1 1   31    3    8 o  117.294   2.4305  286.417   11.671  287.989   17.630  285.191   15.571  117.510   3.6375  117.078   3.2246 0.4318771 4.860997 
1 1 1   31    3    9 o   99.832   2.6715  211.156   10.750  191.093   16.609  225.619   14.102   95.543   4.2148  104.121   3.2837 -8.577873 5.342958 
1 1 1   31    3   10 o  120.717   2.2678  303.138   11.289  311.859   16.058  294.616   15.874  122.443   3.1797  118.992   3.2344 3.451035 4.535615 
1 1 1   31    3   11 o   68.641   2.7654   98.656   7.8160  103.038   10.922   94.057   11.189   70.238   3.7703   67.043   4.0466 3.195122 5.530847 
1 1 1   31    3   12 o   84.864   2.5009  150.166   8.7457  141.511   12.171  159.405   12.575   82.324   3.5847   87.403   3.4884 -5.078781 5.001847 
1 1 1   31    3   13 o   61.265   2.9325   78.791   7.4076   80.870   10.461   76.699   10.491   62.092   4.0849   60.438   4.2085 1.653717 5.864960 
1 1 1   31    3   14 o   58.544   4.9306   74.828   11.793   83.112   16.327   65.789   17.053   62.194   6.3648   54.894   7.5322 7.300251 9.861274 
1 1 1   31    3   15 o   44.575   5.0458   41.816   8.9859   38.006   11.191   48.728   15.076   42.015   6.4581   47.136   7.7546 -5.121235 10.09162 
1 1 1   31    3   16 f   74.929   3.0428  119.072   9.3302  130.527   12.886  106.451   13.527   78.862   3.9619   70.997   4.6194 7.865288 6.085636 
1 1 1   31    3   17 o   67.876   2.9747   96.683   8.2938   93.618   11.165  100.456   12.389   66.729   4.0566   69.024   4.3518 -2.294449 5.949335 
1 1 1   31    3   18 o   49.912   3.4508   53.174   7.0494   46.316   10.050   59.815   9.8902   46.622   5.2266   53.202   4.5072 -6.579998 6.901651 
1 1 1   31    3   19 o   65.478   3.2532   91.623   8.4705   87.897   13.786   93.882   10.736   64.149   5.2107   66.807   3.8963 -2.658455 6.506333 
1 1 1   31    3   20 o   37.610   4.8652   28.739   7.1162   44.582   12.321   20.809   8.7169   45.090   6.6255   30.131   7.1262 14.95894 9.730360 
1 1 1   31    3   21 o   27.961   6.1550   18.265   7.8915   16.326   11.367   20.069   10.964   26.730   8.8518   29.192   8.5546 -2.461861 12.30999 
1 1 1   31    3   22 o   51.102   4.3092   57.128   9.0632   60.468   12.721   53.685   12.916   52.734   5.8486   49.471   6.3302 3.263725 8.618464 
1 1 1   31    3   23 o   66.001   4.6787   93.027   11.886   86.765   14.251  107.341   21.545   63.237   5.4641   68.766   7.5964 -5.528980 9.357412 
1 1 1   31    3   24 o   51.445   6.6539   66.787   13.332   80.709   17.874   49.328   20.016   59.627   7.2680   43.264   11.148 16.36261 13.30777 
1 1 1   31    3   25 o   31.850   8.0734   24.846   13.667   34.926   20.505   16.787   18.333   35.893   11.889   27.806   10.926 8.086384 16.14684 
1 1 1   31    3   26 o   24.395   7.3872   6.8806   13.555  -1.8441   20.869   13.248   17.829   22.692   10.294   26.097   10.598 -3.404406 14.77440 
1 1 1   31    3   27 o   33.561   9.3313   33.740   20.759 -10.0528   47.867   43.885   23.039   28.621   13.772   38.502   12.595 -9.880953 18.66267 
1 1 1   31    3   28 o   42.273   12.692   53.737   23.903   0.0000   0.0000   53.737   23.903  ?   ?    42.273   12.692      ?      ? 
1 1 1   31    4    0 f   15.333   6.3694   6.0126   9.6314   6.0126   9.6314   6.0126   9.6314   15.333   9.0077   15.333   9.0077 0.000000 0.000000 
1 1 1   31    4    1 o   40.674   4.7319   35.501   7.7382   31.458   10.408   40.500   11.572   37.777   6.9353   43.570   6.4393 -5.792717 9.463803 
1 1 1   31    4    2 o  113.154   2.8434  269.006   13.151  279.694   17.680  255.768   19.677  115.798   3.7019  110.510   4.3170 5.288559 5.686891 
1 1 1   31    4    3 o   55.971   3.6921   65.417   8.4801   58.625   11.353   73.988   12.754   52.718   5.2215   59.224   5.2213 -6.506134 7.384164 
1 1 1   31    4    4 o   87.752   3.0237  161.175   10.830  161.785   16.559  160.720   14.315   87.801   4.5727   87.703   3.9576 0.9819794E-01 6.047472 
1 1 1   31    4    5 o   47.858   4.1823   49.416   8.1031   43.053   12.144   54.522   10.879   44.877   6.5613   50.839   5.1882 -5.962318 8.364636 
1 1 1   31    4    6 o   75.940   2.7734  120.682   8.6410  118.516   12.829  122.479   11.690   75.261   4.1330   76.619   3.6993 -1.357788 5.546777 
1 1 1   31    4    7 f  106.070   2.4703  234.710   10.745  231.840   16.022  237.057   14.487  105.419   3.6849  106.722   3.2912 -1.303497 4.940666 
1 1 1   31    4    8 o   51.302   3.5019   56.567   7.2402   44.918   10.550   66.937   9.9544   46.069   5.5523   56.535   4.2690 -10.46605 7.003799 
1 1 1   31    4    9 o   28.214   5.3585   17.796   6.3645   18.324   9.1814   17.307   8.8305   28.600   7.6389   27.828   7.5166 0.7723999 10.71693 
1 1 1   31    4   10 o   58.162   3.3001   69.913   7.8215   63.941   10.154   78.628   12.266   55.205   4.4594   61.118   4.8658 -5.913132 6.600216 
1 1 1   31    4   11 o  163.958   2.4018  561.301   16.156  550.451   23.988  570.308   21.855  162.408   3.5812  165.508   3.2017 -3.100006 4.803693 
1 1 1   31    4   12 o   76.790   2.7425  123.280   8.6714  126.064   12.690  120.841   11.877   77.577   3.9660   76.004   3.7889 1.572334 5.484962 
1 1 1   31    4   13 o   32.317   5.4156   24.531   7.0503   19.227   11.393   27.823   8.9752   29.115   8.7673   35.519   6.3601 -6.404734 10.83130 
1 1 1   31    4   14 o   50.708   4.9568   54.378   10.367   0.0000   0.0000   54.378   10.367  ?   ?    50.708   4.9568      ?      ? 
1 1 1   31    4   15 o   30.165   5.6737   20.611   7.0760   20.049   9.1113   21.466   11.232   29.746   7.4444   30.584   8.5643 -0.8376789 11.34749 
1 1 1   31    4   16 o   55.680   3.2090   65.767   7.3055   75.734   10.353   55.884   10.310   59.998   4.1839   51.361   4.8669 8.637890 6.418089 
1 1 1   31    4   17 f   58.419   3.2605   71.936   7.8337   69.265   10.614   75.132   11.610   57.268   4.4937   59.570   4.7254 -2.301949 6.520959 
1 1 1   31    4   18 o   43.818   3.7834   41.095   6.8022   36.289   9.5843   45.973   9.6557   41.144   5.6479   46.491   5.0355 -5.347157 7.566727 
1 1 1   31    4   19 o   27.680   5.8421   17.135   6.9504   19.817   11.671   15.662   8.6519   29.168   8.8939   26.191   7.5775 2.977097 11.68419 
1 1 1   31    4   20 o   75.885   3.2926  122.607   10.294  120.472   14.825  124.595   14.304   75.183   4.7811   76.586   4.5284 -1.403450 6.585231 
1 1 1   31    4   21 o   36.251   5.7622   30.540   8.4963   40.274   12.514   22.214   11.573   41.928   7.5122   30.575   8.7394 11.35350 11.52434 
1 1 1   31    4   22 o   25.152   5.6075   10.239   7.9331   27.478   11.761  -4.1509   10.746   33.988   8.4308   16.316   7.3959 17.67228 11.21509 
1 1 1   31    4   23 o   20.230   6.1379   1.1321   9.8197   9.2671   11.624 -19.1423   18.351   22.467   8.7364   17.993   8.6237 4.474409 12.27575 
1 1 1   31    4   24 o   27.344   7.2368   11.229   12.009  -3.2812   15.592   32.390   18.829   19.762   8.9379   34.926   11.384 -15.16339 14.47351 
1 1 1   31    4   25 o   30.110   7.7603   22.430   12.503   23.831   16.485   20.532   19.183   30.759   10.656   29.461   11.285 1.298128 15.52067 
1 1 1   31    4   26 o   38.605   8.1433   40.056   14.300   53.636   21.241   28.798   19.340   44.428   11.502   32.782   11.531 11.64592 16.28659 
1 1 1   31    4   27 o   32.143   9.1694   29.114   19.822  -1.5548   42.263   37.762   22.444   28.455   13.482   35.831   12.432 -7.376156 18.33885 
1 1 1   31    4   28 o   84.982   8.0039  171.928   28.054   0.0000   0.0000  171.928   28.054  ?   ?    84.982   8.0039      ?      ? 
1 1 1   31    4   29 o   91.781   8.3928  205.697   31.770   0.0000   0.0000  205.697   31.770  ?   ?    91.781   8.3928      ?      ? 
1 1 1   31    5    0 o   95.769   2.7145  191.217   15.108  191.217   15.108  191.217   15.108   95.769   3.8388   95.769   3.8388 0.000000 0.000000 
1 1 1   31    5    1 o   38.716   4.9064   32.306   7.6149   26.769   10.262   39.092   11.360   34.635   7.4077   42.797   6.4357 -8.161812 9.812858 
1 1 1   31    5    2 o   88.752   3.0350  166.252   10.960  174.059   14.578  156.102   16.623   91.294   3.8717   86.210   4.6750 5.084541 6.070039 
1 1 1   31    5    3 o   54.535   3.5978   62.689   8.0888   60.444   11.413   64.954   11.466   53.535   5.1688   55.534   5.0059 -1.999870 7.195525 
1 1 1   31    5    4 o   94.585   2.9330  187.250   11.344  186.825   17.187  187.578   15.101   94.400   4.4142   94.771   3.8634 -0.3715134 5.866063 
1 1 1   31    5    5 o   88.813   2.7980  164.008   10.220  148.652   13.938  181.863   15.030   84.325   4.0076   93.301   3.9058 -8.976860 5.596076 
1 1 1   31    5    6 o   27.466   5.5780   16.779   7.1587   24.203   9.7210   7.9828   10.582   32.909   7.3478   22.022   8.3943 10.88628 11.15596 
1 1 1   31    5    7 o   29.553   5.3427   19.564   6.5207   19.807   9.6453   19.359   8.8493   29.692   7.7817   29.414   7.3228 0.2779598 10.68541 
1 1 1   31    5    8 o   37.062   4.5715   29.651   6.8127   33.730   9.9343   26.029   9.3605   39.828   6.0476   34.296   6.8571 5.531658 9.142970 
1 1 1   31    5    9 o   85.531   2.6956  154.469   9.3964  131.979   13.601  175.005   12.997   79.409   4.1527   91.653   3.4381 -12.24454 5.391258 
1 1 1   31    5   10 o  119.263   2.2759  296.006   11.189  282.555   15.690  309.927   15.961  116.490   3.2656  122.036   3.1711 -5.545486 4.551898 
1 1 1   31    5   11 o   77.361   2.5858  124.966   8.2482  121.929   11.510  128.174   11.826   76.396   3.6528   78.326   3.6608 -1.929825 5.171499 
1 1 1   31    5   12 o  101.146   2.3710  213.422   9.8888  212.846   14.129  213.975   13.845  100.998   3.3917  101.293   3.3141 -0.2942047 4.742033 
1 1 1   31    5   13 o   40.384   5.5535   35.473   8.0980   38.464   15.682   34.385   9.4564   40.607   9.5276   40.162   5.7088 0.4446030 11.10702 
1 1 1   31    5   14 o   65.847   4.0825   98.236   9.6510   80.047   17.943  105.641   11.448   60.688   7.1684   71.006   3.9091 -10.31813 8.164976 
1 1 1   31    5   15 o   39.912   4.6725   35.361   7.3199   37.415   9.5732   32.468   11.358   41.886   5.5414   37.937   7.5246 3.949192 9.344901 
1 1 1   31    5   16 o   70.600   2.7604  104.629   8.0374  104.606   11.429  104.651   11.305   70.585   3.9259   70.614   3.8816 -0.2938843E-01 5.520844 
1 1 1   31    5   17 f   31.461   5.1721   21.884   6.6208   16.220   8.7600   29.431   10.111   26.733   7.5906   36.188   7.0276 -9.455217 10.34428 
1 1 1   31    5   18 o   69.965   3.3870  104.077   9.7310  101.721   14.347  106.085   13.243   69.127   5.0321   70.803   4.5348 -1.675194 6.773955 
1 1 1   31    5   19 o   93.229   2.7749  182.686   10.341  184.859   16.870  181.378   13.088   93.431   4.3777   93.027   3.4113 0.4043274 5.549888 
1 1 1   31    5   20 o   21.554   6.1765   6.8215   7.6471   3.9320   16.103   7.6630   8.6895   22.714   9.7036   20.393   7.6442 2.320969 12.35293 
1 1 1   31    5   21 o   62.935   3.6523   84.982   9.4714   87.144   13.757   83.033   13.059   63.659   5.2397   62.211   5.0897 1.447739 7.304699 
1 1 1   31    5   22 o   30.565   6.5893   24.230   9.8452   31.010   11.713   7.9132   18.171   36.296   8.0366   24.833   10.445 11.46342 13.17864 
1 1 1   31    5   23 o   45.734   6.2762   55.161   10.593   64.296   12.942   36.618   18.438   54.175   5.7921   37.293   11.136 16.88197 12.55239 
1 1 1   31    5   24 o   32.335   7.3429   23.640   12.033   9.3426   15.877   42.940   18.446   24.127   9.9219   40.543   10.827 -16.41586 14.68575 
1 1 1   31    5   25 o   42.490   7.4003   45.752   12.749   40.744   16.618   52.915   19.876   39.939   10.086   45.040   10.832 -5.100555 14.80067 
1 1 1   31    5   26 o   28.740   7.8155   18.859   13.851   29.119   18.701   6.3926   20.614   32.869   11.351   24.611   10.746 8.258028 15.63099 
1 1 1   31    5   27 o   27.792   8.8494   11.424   18.328   7.5804   42.577   12.298   20.305   29.613   13.875   25.971   10.988 3.642149 17.69873 
1 1 1   31    5   28 o   37.714   12.814   43.738   23.807   0.0000   0.0000   43.738   23.807  ?   ?    37.714   12.814      ?      ? 
1 1 1   31    5   29 o   53.541   11.371   80.605   24.334   0.0000   0.0000   80.605   24.334  ?   ?    53.541   11.371      ?      ? 
1 1 1   31    6    0 o   76.873   2.9114  123.781   12.969  123.781   12.969  123.781   12.969   76.873   4.1173   76.873   4.1173 0.000000 0.000000 
1 1 1   31    6    1 o   61.560   4.3418   74.294   10.002   66.469   11.639   96.388   19.557   56.171   5.0238   66.948   7.0827 -10.77720 8.683522 
1 1 1   31    6    2 o   63.974   3.3607   86.039   8.8584   91.111   12.604   81.088   12.452   65.866   4.6398   62.082   4.8632 3.783821 6.721464 
1 1 1   31    6    3 o  136.973   2.7852  390.805   15.515  399.431   24.144  384.737   20.250  138.115   4.2383  135.831   3.6145 2.283630 5.570321 
1 1 1   31    6    4 o   95.109   2.6104  188.575   10.195  187.206   13.769  190.238   15.169   94.776   3.5223   95.441   3.8536 -0.6655807 5.220809 
1 1 1   31    6    5 o   88.098   2.7914  162.157   10.142  158.986   14.240  165.420   14.447   87.221   3.9585   88.975   3.9368 -1.753952 5.582823 
1 1 1   31    6    6 f   62.173   3.0855   80.333   7.8711   87.608   11.896   74.668   10.498   64.633   4.4624   59.712   4.2626 4.920517 6.171085 
1 1 1   31    6    7 o   59.716   3.1732   73.831   7.7335   90.706   11.618   60.406   10.363   65.809   4.2804   53.622   4.6857 12.18668 6.346449 
1 1 1   31    6    8 o   70.021   2.8643  102.703   8.2380  100.637   12.142  104.465   11.214   69.318   4.2469   70.723   3.8445 -1.404114 5.728546 
1 1 1   31    6    9 o   90.344   2.5800  170.884   9.5455  165.381   14.241  175.372   12.863   88.949   3.8819   91.740   3.3994 -2.791077 5.159930 
1 1 1   31    6   10 o   37.309   4.3972   30.838   6.4312   38.594   9.0144   22.799   9.1781   42.724   5.1156   31.893   7.1535 10.83079 8.794477 
1 1 1   31    6   11 o   47.645   3.5207   48.006   6.8124   37.681   9.3861   59.498   9.9031   42.125   5.4023   53.165   4.5163 -11.03967 7.041447 
1 1 1   31    6   12 o   62.262   3.2315   83.188   8.1186   72.136   12.289   91.747   10.814   58.360   5.1056   66.164   3.9629 -7.803638 6.463093 
1 1 1   31    6   13 o   31.200   6.1607   22.835   7.6697   18.803   15.484   24.145   8.8290   29.486   10.320   32.914   6.7308 -3.427763 12.32134 
1 1 1   31    6   14 f   84.571   3.1744  151.743   10.976  130.773   15.662  171.985   15.387   78.648   4.8283   90.495   4.1226 -11.84706 6.348836 
1 1 1   31    6   15 o   82.886   2.8768  145.151   9.7356  150.661   13.038  138.206   14.637   84.798   3.7278   80.974   4.3827 3.824074 5.753670 
1 1 1   31    6   16 o   96.762   2.8601  197.017   11.389  213.087   16.182  181.240   16.033  100.743   3.8944   92.780   4.1899 7.962692 5.720299 
1 1 1   31    6   17 o   28.189   6.1579   16.168   7.3174   12.912   8.6455   24.391   13.740   24.187   7.6983   32.190   9.6133 -8.002783 12.31582 
1 1 1   31    6   18 o   31.706   5.3900   24.715   7.5365   11.052   12.015   33.577   9.6769   23.983   8.9890   39.430   5.9504 -15.44707 10.78006 
1 1 1   31    6   19 o   49.640   3.8767   50.951   7.7185   62.171   12.875   44.655   9.6437   53.606   5.8232   45.675   5.1192 7.930939 7.753416 
1 1 1   31    6   20 o   41.929   4.5393   37.793   7.5650   41.309   12.702   35.860   9.4175   43.118   7.1422   40.740   5.6046 2.377636 9.078667 
1 1 1   31    6   21 o   18.472   5.5086  -0.4905   7.7825  -9.9650   11.071   8.7665   10.943   14.873   7.0020   22.071   8.5059 -7.198212 11.01715 
1 1 1   31    6   22 o   18.336   5.9553  -5.6546   9.0627  -7.2865   10.625  -1.2975   17.362   15.182   7.0525   21.490   9.5981 -6.308075 11.91057 
1 1 1   31    6   23 o   29.012   6.7119   21.262   10.047   28.102   12.324   7.7009   17.352   33.908   8.7523   24.117   10.178 9.791754 13.42380 
1 1 1   31    6   24 o   57.595   5.9799   76.935   14.129   68.914   18.881   87.144   21.301   54.232   8.4410   60.957   8.4726 -6.725235 11.95974 
1 1 1   31    6   25 f   39.131   7.3379   42.181   13.059   55.957   17.094   22.870   20.239   47.877   8.9866   30.386   11.603 17.49178 14.67587 
1 1 1   31    6   26 o   24.371   8.1126  -4.8685   18.823 -29.8928   41.995   1.4231   21.057   25.400   12.380   23.342   10.487 2.058342 16.22519 
1 1 1   31    6   27 o   23.679   8.0265  -6.7867   17.688 -28.4833   45.899  -3.0025   19.169   26.101   12.769   21.258   9.7287 4.843121 16.05308 
1 1 1   31    6   28 o   78.920   8.3758  150.932   27.264   0.0000   0.0000  150.932   27.264  ?   ?    78.920   8.3758      ?      ? 
1 1 1   31    6   29 o   24.397   10.858   7.3367   22.011   0.0000   0.0000   7.3367   22.011  ?   ?    24.397   10.858      ?      ? 
1 1 1   31    7    0 o  120.642   2.3266  302.201   16.344  302.201   16.344  302.201   16.344  120.642   3.2903  120.642   3.2903 0.000000 0.000000 
1 1 1   31    7    1 o   77.321   2.8483  125.779   9.0144  133.202   12.262  117.049   13.297   79.897   3.7211   74.746   4.3133 5.150963 5.696618 
1 1 1   31    7    2 o  132.447   2.4192  365.146   13.128  363.345   17.568  367.424   19.756  132.151   3.2232  132.742   3.6085 -0.5915222 4.838420 
1 1 1   31    7    3 o   18.186   5.4248   1.4431   6.8839   2.3289   10.625   0.8022   9.0374   19.180   8.0219   17.191   7.3050 1.988640 10.84964 
1 1 1   31    7    4 o   40.588   4.9463   34.920   7.8647   51.420   12.156   23.042   10.314   49.188   5.9922   31.988   7.8712 17.20025 9.892555 
1 1 1   31    7    5 o   14.635   4.5944  -6.8931   6.0433 -15.9019   8.2948   3.2988   8.8227   10.997   5.3904   18.273   7.4417 -7.276020 9.188861 
1 1 1   31    7    6 o   30.758   5.1938   21.140   6.4950   22.184   9.4091   20.190   8.9769   31.480   7.3758   30.036   7.3144 1.444057 10.38759 
1 1 1   31    7    7 o   24.658   5.4545   12.647   6.3289   17.908   9.3405   8.1814   8.6054   28.267   7.7707   21.049   7.6565 7.217854 10.90900 
1 1 1   31    7    8 o   41.783   4.1644   37.184   6.8238   49.596   10.210   27.166   9.1734   48.468   5.1077   35.098   6.5788 13.37019 8.328773 
1 1 1   31    7    9 o   49.356   3.6029   50.791   7.2766   60.484   10.991   43.229   9.7088   53.518   4.9795   45.194   5.2085 8.323345 7.205877 
1 1 1   31    7   10 o   73.102   2.8221  110.968   8.4663  122.588   12.774  101.865   11.306   76.466   4.0504   69.737   3.9308 6.728882 5.644185 
1 1 1   31    7   11 o   44.675   4.1078   43.596   7.3401   37.412   11.335   48.062   9.6326   41.663   6.5962   47.687   4.8975 -6.023609 8.215569 
1 1 1   31    7   12 o  141.325   2.9509  416.986   16.894  431.635   26.707  407.216   21.812  143.164   4.5231  139.486   3.7913 3.677231 5.901876 
1 1 1   31    7   13 o   52.638   5.1862   63.724   10.066   52.952   17.042   69.496   12.474   48.073   8.9237   57.204   5.2870 -9.131836 10.37234 
1 1 1   31    7   14 f   59.047   3.8965   75.530   9.3274   63.628   13.683   85.863   12.748   54.412   6.0970   63.682   4.8538 -9.269321 7.793093 
1 1 1   31    7   15 o   34.559   5.3226   27.067   7.2894   26.695   9.5301   27.591   11.316   34.473   6.9429   34.646   8.0694 -0.1728249 10.64517 
1 1 1   31    7   16 f   22.404   5.1308   9.1371   6.1763   18.341   8.8042   0.2187   8.6667   28.370   7.4344   16.438   7.0731 11.93225 10.26155 
1 1 1   31    7   17 o   18.034   4.8587   2.7230   5.8346   10.947   7.9107  -7.0875   8.6402   22.503   7.3811   13.564   6.3205 8.939622 9.717424 
1 1 1   31    7   18 o   39.175   5.0494   33.534   7.9093   42.010   12.255   27.483   10.355   43.741   6.7927   34.608   7.4730 9.133083 10.09884 
1 1 1   31    7   19 o   62.330   3.4128   78.633   8.4263   98.566   14.587   68.651   10.323   67.776   5.2184   56.884   4.3998 10.89168 6.825693 
1 1 1   31    7   20 o   27.766   5.9252   17.651   7.0779   19.021   12.231   16.962   8.6786   28.467   9.1669   27.065   7.5101 1.401876 11.85048 
1 1 1   31    7   21 o   46.621   4.8254   48.134   9.2553   46.680   12.582   49.849   13.663   45.944   6.6397   47.298   7.0038 -1.354404 9.650831 
1 1 1   31    7   22 o   40.121   6.8167   38.728   10.285   37.072   12.093   43.055   19.549   39.838   7.6379   40.403   11.293 -0.5647011 13.63347 
1 1 1   31    7   23 o   21.496   6.5215   3.3470   9.8548   1.0281   12.118   7.8767   16.936   18.999   8.2686   23.993   10.087 -4.994106 13.04291 
1 1 1   31    7   24 o   19.502   6.2844  -5.6699   11.459   1.8186   14.743 -17.0962   18.211   20.826   9.0906   18.178   8.6796 2.647093 12.56873 
1 1 1   31    7   25 o   19.101   6.2512 -13.8402   11.763 -27.3120   15.284   5.7314   18.423   14.536   7.1628   23.666   10.247 -9.129123 12.50239 
1 1 1   31    7   26 f   27.697   8.6871   12.097   19.145 -23.9612   45.368   19.909   21.117   26.603   12.945   28.791   11.589 -2.188051 17.37424 
1 1 1   31    7   27 o   34.360   10.279   21.381   19.823   83.923   46.842   7.7375   21.878   43.717   17.373   25.004   10.990 18.71353 20.55754 
1 1 1   31    7   28 o   26.014   8.5884   4.7047   18.534  -3.8849   46.848   6.2986   20.181   28.211   13.587   23.817   10.508 4.394295 17.17670 
1 1 1   31    7   29 o   18.825   9.0825 -18.1618   21.146   0.0000   0.0000 -18.1618   21.146  ?   ?    18.825   9.0825      ?      ? 
1 1 1   31    8    0 o  134.579   2.2710  375.774   17.804  375.774   17.804  375.774   17.804  134.579   3.2117  134.579   3.2117 0.000000 0.000000 
1 1 1   31    8    1 o   52.719   3.4743   57.772   7.4811   47.660   10.037   70.413   11.222   47.547   5.1179   57.892   4.6999 -10.34438 6.948573 
1 1 1   31    8    2 o   67.319   3.0112   95.701   8.2811  103.019   11.264   87.094   12.216   70.228   3.8888   64.410   4.5986 5.818863 6.022440 
1 1 1   31    8    3 o   93.623   2.5653  181.173   9.8482  168.487   13.096  197.685   14.941   89.912   3.5315   97.334   3.7217 -7.422653 5.130511 
1 1 1   31    8    4 o   71.027   2.9324  104.926   8.5377  100.069   11.358  111.235   12.945   69.190   3.9801   72.865   4.3074 -3.674423 5.864783 
1 1 1   31    8    5 o   97.637   2.5678  197.638   10.276  188.672   13.664  209.308   15.590   95.148   3.4818  100.125   3.7751 -4.976501 5.135633 
1 1 1   31    8    6 o   20.955   5.5095   7.6431   6.3619   9.0040   9.2699   6.4313   8.7470   21.911   7.9502   19.998   7.6298 1.912870 11.01908 
1 1 1   31    8    7 o   98.309   2.9946  203.555   12.011  196.068   18.180  209.354   16.001   96.566   4.5646  100.052   3.8776 -3.486221 5.989271 
1 1 1   31    8    8 o   16.715   5.3387  -5.6419   8.0456 -12.8215   12.316  -0.2965   10.627   15.459   7.3106   17.971   7.7821 -2.512010 10.67735 
1 1 1   31    8    9 o   58.851   3.7220   73.099   8.5142   74.504   14.785   72.403   10.415   59.003   6.0753   58.700   4.3017 0.3029938 7.444080 
1 1 1   31    8   10 o  111.839   2.4636  262.835   11.265  246.137   16.742  276.651   15.229  108.465   3.7424  115.212   3.2048 -6.746933 4.927103 
1 1 1   31    8   11 o   60.020   3.3937   76.888   8.1299   72.547   13.056   79.637   10.390   58.429   5.4178   61.611   4.0887 -3.181561 6.787478 
1 1 1   31    8   12 o  138.528   2.4599  399.372   13.848  409.301   21.618  392.462   18.035  139.841   3.7482  137.214   3.1867 2.626678 4.919738 
1 1 1   31    8   13 o   26.069   5.8852   14.843   6.9049   15.461   11.804   14.521   8.5134   26.671   9.0228   25.466   7.5586 1.205412 11.77047 
1 1 1   31    8   14 o  102.783   2.6112  218.617   10.902  206.512   14.079  236.743   17.229   99.384   3.4348  106.183   3.9340 -6.799652 5.222476 
1 1 1   31    8   15 o   33.842   5.3413   26.405   7.1578   27.838   9.2245   24.235   11.347   35.347   6.5691   32.336   8.4240 3.011444 10.68260 
1 1 1   31    8   16 o  115.345   2.3282  278.063   11.073  278.990   15.863  277.182   15.463  115.515   3.3296  115.175   3.2552 0.3401642 4.656450 
1 1 1   31    8   17 o   81.514   2.9554  141.159   9.5873  136.839   15.627  143.766   12.140   80.245   4.7217   82.783   3.5557 -2.537430 5.910823 
1 1 1   31    8   18 o   69.333   3.4114  101.500   9.6386  108.904   15.025   96.322   12.565   71.323   5.1075   67.344   4.5237 3.979416 6.822787 
1 1 1   31    8   19 o   27.461   5.8696   14.821   7.5713   28.692   12.398   6.5712   9.5613   34.727   8.6798   20.195   7.9038 14.53210 11.73924 
1 1 1   31    8   20 o   73.360   3.1747  117.233   9.1463  104.686   14.968  124.709   11.554   69.762   5.2022   76.957   3.6402 -7.194794 6.349307 
1 1 1   31    8   21 o   27.801   5.5024   18.890   7.6220   3.7596   12.148   28.715   9.7886   20.231   8.5261   35.371   6.9576 -15.13939 11.00470 
1 1 1   31    8   22 f   52.451   6.3245   75.094   11.269   88.124   13.515   45.353   20.417   63.795   5.1363   41.107   11.559 22.68759 12.64895 
1 1 1   31    8   23 o   19.035   6.0679  -2.2841   9.4641  -2.4121   11.500  -2.0156   16.660   17.342   7.7738   20.728   9.3192 -3.385849 12.13587 
1 1 1   31    8   24 o   77.844   4.6348  133.830   14.641  125.769   18.870  146.022   23.207   75.377   6.0697   80.312   7.0061 -4.934990 9.269609 
1 1 1   31    8   25 o   76.862   6.1727  144.518   18.653  129.679   29.973  153.898   23.829   71.662   10.141   82.061   7.0406 -10.39893 12.34532 
1 1 1   31    8   26 o   55.232   8.0735   80.463   18.063  110.737   28.161   59.301   23.544   65.313   10.454   45.152   12.306 20.16171 16.14704 
1 1 1   31    8   27 o   64.120   9.0737  155.625   24.723   59.125   46.627  193.364   29.159   37.965   16.371   90.274   7.8314 -52.30870 18.14747 
1 1 1   31    8   28 o   63.439   9.3465  153.142   24.738   76.230   46.898  182.792   29.119   40.149   16.827   86.729   8.1403 -46.57955 18.69291 
1 1 1   31    8   29 o   33.169   12.125   34.650   21.619   0.0000   0.0000   34.650   21.619  ?   ?    33.169   12.125      ?      ? 
1 1 1   31    9    0 o  130.323   2.5689  353.077   19.493  353.077   19.493  353.077   19.493  130.323   3.6329  130.323   3.6329 0.000000 0.000000 
1 1 1   31    9    1 o   39.183   4.2758   32.697   6.8785   32.923   9.3186   32.427   10.196   39.392   5.7355   38.973   6.3431 0.4191856 8.551641 
1 1 1   31    9    2 o   44.282   4.0884   41.693   7.4528   44.291   10.496   39.050   10.584   45.722   5.5658   42.842   5.9901 2.880280 8.176744 
1 1 1   31    9    3 o   99.807   3.0479  205.542   12.196  195.461   15.364  222.711   20.052   96.716   3.8517  102.898   4.7247 -6.182243 6.095739 
1 1 1   31    9    4 o   64.944   3.5095   85.704   8.9003   79.445   10.790   99.024   15.742   61.561   4.2498   68.327   5.5861 -6.765385 7.018908 
1 1 1   31    9    5 o   90.993   2.4790  172.735   9.3036  172.617   13.137  172.853   13.178   90.963   3.5015   91.023   3.5102 -0.5949402E-01 4.958046 
1 1 1   31    9    6 o   72.002   2.8784  108.706   8.4975  108.107   12.702  109.191   11.432   71.758   4.2919   72.246   3.8366 -0.4876404 5.756752 
1 1 1   31    9    7 o   86.122   2.6529  156.154   9.3474  144.981   13.807  165.609   12.701   83.168   4.0250   89.076   3.4571 -5.908379 5.305851 
1 1 1   31    9    8 f   34.681   4.8625   27.123   6.7477   21.051   9.9373   32.318   9.1916   30.429   7.8620   38.933   5.7241 -8.504372 9.725016 
1 1 1   31    9    9 o  170.088   2.4019  604.062   16.728  600.793   25.175  606.646   22.383  169.552   3.6000  170.623   3.1807 -1.071732 4.803788 
1 1 1   31    9   10 o   81.599   3.1062  141.299   9.8857  136.118   16.815  144.036   12.221   80.173   5.0851   83.025   3.5688 -2.852394 6.212460 
1 1 1   31    9   11 o  105.505   3.1468  238.330   12.336  225.047   22.765  243.852   14.678  102.893   5.3642  108.117   3.2915 -5.223740 6.293573 
1 1 1   31    9   12 o   58.655   3.8182   74.692   9.0428   62.152   13.388   85.213   12.263   53.807   6.0328   63.503   4.6820 -9.695362 7.636469 
1 1 1   31    9   13 o   87.835   3.0179  162.619   10.908  160.627   15.913  164.385   14.982   87.260   4.4215   88.410   4.1087 -1.150566 6.035834 
1 1 1   31    9   14 o   23.334   6.0111   9.9454   7.6755   15.252   11.284   5.3765   10.471   26.349   8.8224   20.319   8.1668 6.029734 12.02214 
1 1 1   31    9   15 o   46.586   4.0521   45.591   7.6724   41.090   9.8798   52.429   12.178   43.833   5.4649   49.338   5.9844 -5.505177 8.104202 
1 1 1   31    9   16 o   50.963   3.3927   55.193   7.1300   56.527   10.197   53.917   9.9735   51.567   4.7944   50.360   4.8017 1.206848 6.785458 
1 1 1   31    9   17 o   77.896   3.0254  130.831   9.3250  119.068   15.113  138.064   11.850   74.700   4.9051   81.091   3.5430 -6.391357 6.050865 
1 1 1   31    9   18 o   26.614   5.9740   16.619   7.5246   11.329   12.265   19.812   9.5283   24.061   9.0695   29.167   7.7780 -5.105747 11.94796 
1 1 1   31    9   19 o   21.778   5.7945   8.3479   7.5331   0.5133   11.800   13.738   9.7872   18.818   8.1746   24.738   8.2146 -5.919800 11.58897 
1 1 1   31    9   20 o   75.043   3.2765  122.731   9.7744  109.744   15.560  131.197   12.563   71.301   5.2910   78.784   3.8661 -7.482956 6.552979 
1 1 1   31    9   21 o   47.284   5.9309   58.837   9.9851   37.095   17.329   69.643   12.217   37.869   10.649   56.699   5.2243 -18.82999 11.86188 
1 1 1   31    9   22 o   42.854   6.4628   45.720   10.530   47.821   12.726   41.159   18.751   46.228   6.6745   39.480   11.069 6.748459 12.92552 
1 1 1   31    9   23 o   95.095   3.8515  197.300   13.973  197.564   16.884  196.726   24.890   96.204   4.2553   93.986   6.4209 2.218201 7.702909 
1 1 1   31    9   24 f   48.035   6.6913   57.563   12.850   60.965   17.148   53.205   19.407   50.950   8.1603   45.121   10.607 5.828213 13.38266 
1 1 1   31    9   25 o   36.290   8.9068   39.417   16.431   34.693   26.248   42.461   21.069   34.180   13.173   38.400   11.991 -4.220257 17.81363 
1 1 1   31    9   26 o   24.497   7.7783  -1.3944   15.753   21.577   26.746 -13.5956   19.493   29.825   12.615   19.169   9.1036 10.65611 15.55653 
1 1 1   31    9   27 o   34.403   9.4096   39.397   20.142   8.9282   48.038   45.896   22.187   29.882   14.220   38.924   12.327 -9.041441 18.81922 
1 1 1   31    9   28 o   30.891   8.9257   29.368   19.975 -16.7964   47.121   39.480   22.054   26.393   12.918   35.388   12.321 -8.994787 17.85149 
1 1 1   31    9   29 o   48.398   12.660   73.675   25.560   0.0000   0.0000   73.675   25.560  ?   ?    48.398   12.660      ?      ? 
1 1 1   31   10    0 f   29.661   6.6033   23.393   10.036   23.393   10.036   23.393   10.036   29.661   9.3385   29.661   9.3385 0.000000 0.000000 
1 1 1   31   10    1 o   32.756   5.5954   24.554   7.4857   21.507   11.113   27.085   10.128   30.734   8.4873   34.778   7.2937 -4.043873 11.19073 
1 1 1   31   10    2 o   62.995   3.6056   83.752   9.3594   79.752   12.921   88.168   13.576   61.415   5.1010   64.575   5.0973 -3.160252 7.211288 
1 1 1   31   10    3 o   87.840   2.9195  165.592   10.194  178.768   13.128  145.585   16.177   92.567   3.4385   83.112   4.7192 9.454491 5.839008 
1 1 1   31   10    4 o   49.409   3.7219   52.874   7.4075   61.045   10.049   43.152   10.962   53.856   4.5241   44.961   5.9112 8.895199 7.443798 
1 1 1   31   10    5 o   48.050   3.4426   48.772   6.8203   48.524   9.7560   49.008   9.5385   47.915   4.9367   48.185   4.7995 -0.2706299 6.885244 
1 1 1   31   10    6 o   77.367   2.6495  125.172   8.4449  117.214   11.808  133.504   12.082   74.827   3.8262   79.906   3.6661 -5.079155 5.299016 
1 1 1   31   10    7 o  120.899   2.4025  303.875   11.877  313.665   18.139  296.528   15.714  122.514   3.5897  119.284   3.1940 3.230042 4.804920 
1 1 1   31   10    8 o   22.891   5.1080   10.436   6.0781   1.7274   8.8807   18.111   8.3367   17.420   7.3130   28.361   7.1336 -10.94092 10.21606 
1 1 1   31   10    9 o  108.596   2.4573  246.106   10.915  247.665   16.552  244.906   14.520  108.814   3.6880  108.378   3.2484 0.4366913 4.914590 
1 1 1   31   10   10 o   89.434   2.9014  169.496   10.213  162.605   17.028  173.368   12.765   87.748   4.7050   91.120   3.3965 -3.371429 5.802808 
1 1 1   31   10   11 o   60.355   3.5090   76.890   8.3441   78.396   14.094   76.077   10.354   60.567   5.6420   60.143   4.1738 0.4235001 7.018069 
1 1 1   31   10   12 o   52.775   3.7047   59.817   7.7632   57.226   12.664   61.378   9.8261   51.611   5.9491   53.938   4.4169 -2.326778 7.409486 
1 1 1   31   10   13 o   32.119   5.1857   20.434   7.0824   37.995   11.742   10.392   8.8793   41.775   6.8151   22.464   7.8180 19.31124 10.37146 
1 1 1   31   10   14 o   79.741   3.2237  134.807   10.572  129.404   15.338  139.697   14.592   78.125   4.7600   81.356   4.3487 -3.231720 6.447364 
1 1 1   31   10   15 o   61.054   3.3986   80.026   8.4407   85.369   11.306   73.298   12.687   63.557   4.3131   58.551   5.2535 5.006184 6.797218 
1 1 1   31   10   16 o   69.176   3.2084  101.020   8.8793  103.996   14.507   99.238   11.228   69.753   5.0425   68.599   3.9685 1.153603 6.416840 
1 1 1   31   10   17 o   31.838   5.7284   22.851   7.3219   27.848   12.230   20.060   9.1411   34.250   8.6545   29.426   7.5074 4.823366 11.45689 
1 1 1   31   10   18 o   79.485   3.5464  136.453   11.500  144.964   15.511  126.064   17.137   82.520   4.5573   76.450   5.4349 6.070412 7.092748 
1 1 1   31   10   19 o   99.215   2.9102  207.297   11.839  220.514   17.930  197.081   15.764  101.902   4.2662   96.529   3.9595 5.372864 5.820478 
1 1 1   31   10   20 o   44.344   4.4195   40.190   7.7771   57.841   13.312   31.044   9.5825   51.161   6.3086   37.527   6.1911 13.63396 8.839000 
1 1 1   31   10   21 o   30.438   6.1097   20.978   8.1990   32.514   13.014   13.386   10.558   36.502   8.7565   24.374   8.5226 12.12793 12.21934 
1 1 1   31   10   22 o   26.396   6.7891   15.849   10.331   22.512   12.487   1.3887   18.395   30.227   9.1957   22.566   9.9904 7.661236 13.57826 
1 1 1   31   10   23 o   52.954   5.5514   62.195   11.338   57.203   13.604   73.544   20.512   50.536   6.5270   55.373   8.9816 -4.836975 11.10277 
1 1 1   31   10   24 o   22.130   7.2117  -3.6724   14.482  -5.3747   25.315  -2.8442   17.657   23.517   10.911   20.743   9.4328 2.773846 14.42340 
1 1 1   31   10   25 o   45.416   7.6022   48.195   17.149  109.561   27.757   10.307   21.810   65.090   10.339   25.742   11.148 39.34826 15.20437 
1 1 1   31   10   26 o   33.281   8.9666   29.519   16.682   48.911   27.930   18.764   20.800   38.519   13.824   28.044   11.424 10.47483 17.93326 
1 1 1   31   10   27 o   29.529   8.9725   22.862   18.899  -1.2055   46.835   27.544   20.656   28.171   13.573   30.886   11.739 -2.714756 17.94490 
1 1 1   31   10   28 o   23.759   8.2360 -13.0268   19.398   8.5626   46.567 -17.5598   21.338   28.573   13.706   18.945   9.1361 9.628286 16.47190 
1 1 1   31   10   29 o   77.255   9.0341  153.428   28.786   0.0000   0.0000  153.428   28.786  ?   ?    77.255   9.0341      ?      ? 
1 1 1   31   11    0 o  103.507   2.6341  223.371   15.856  223.371   15.856  223.371   15.856  103.507   3.7252  103.507   3.7252 0.000000 0.000000 
1 1 1   31   11    1 o   53.055   3.4246   59.306   7.4659   57.807   10.079   61.128   11.114   52.359   4.6672   53.751   5.0130 -1.392303 6.849289 
1 1 1   31   11    2 o   76.840   2.7961  123.589   8.8174  122.318   11.866  125.155   13.176   76.457   3.7629   77.223   4.1368 -0.7653122 5.592235 
1 1 1   31   11    3 o   40.887   4.1501   35.688   6.9477   35.547   9.2820   35.868   10.477   40.880   5.5051   40.894   6.2118 -0.1422882E-01 8.300160 
1 1 1   31   11    4 f   45.184   3.8061   43.025   7.0635   38.453   9.5412   48.569   10.507   42.535   5.4386   47.833   5.3260 -5.297791 7.612148 
1 1 1   31   11    5 o   90.830   2.4464  172.240   9.1549  161.757   12.849  183.049   13.047   87.997   3.5402   93.663   3.3774 -5.666405 4.892876 
1 1 1   31   11    6 o   17.942   5.2688   2.5017   6.3941   0.5429   9.9731   3.8688   8.3318   17.768   7.6149   18.116   7.2838 -0.3479881 10.53754 
1 1 1   31   11    7 o   41.858   4.5587   36.586   7.7370   44.201   12.412   31.747   9.8946   45.258   6.6494   38.458   6.2380 6.799828 9.117389 
1 1 1   31   11    8 o   47.728   3.8239   48.370   7.5200   50.514   10.931   46.444   10.361   48.721   5.4399   46.734   5.3754 1.986668 7.647748 
1 1 1   31   11    9 o   57.486   3.5979   68.755   8.2087   75.173   13.856   65.285   10.189   59.319   5.6635   55.654   4.4389 3.664860 7.195804 
1 1 1   31   11   10 o   20.069   5.5488   6.1153   6.6856   2.0176   11.085   8.4579   8.3815   19.187   8.1185   20.951   7.5661 -1.763554 11.09762 
1 1 1   31   11   11 o   26.195   5.5163   15.400   6.3560   16.126   9.7290   14.859   8.3952   26.713   8.1148   25.676   7.4745 1.036564 11.03262 
1 1 1   31   11   12 o  106.437   2.6455  238.482   11.307  233.455   18.078  241.711   14.491  105.302   4.1625  107.573   3.2662 -2.270226 5.291014 
1 1 1   31   11   13 o   71.207   2.7831  106.411   8.1595  115.511   11.781   98.020   11.312   74.157   3.8517   68.257   4.0183 5.899963 5.566137 
1 1 1   31   11   14 o  148.382   2.4890  461.713   15.035  462.226   19.753  461.008   23.180  148.677   3.2213  148.086   3.7952 0.5916138 4.978022 
1 1 1   31   11   15 o   71.894   3.0406  109.250   8.8755  108.438   11.564  110.413   13.845   71.731   3.9089   72.056   4.6586 -0.3255234 6.081269 
1 1 1   31   11   16 f   76.296   3.0136  124.440   9.1975  118.285   14.716  128.386   11.782   74.468   4.7914   78.125   3.6565 -3.657738 6.027241 
1 1 1   31   11   17 o   44.861   4.2993   43.295   7.6843   46.182   12.765   41.654   9.6235   45.727   6.7681   43.994   5.3036 1.733109 8.598553 
1 1 1   31   11   18 o   93.340   2.8682  185.539   10.672  179.981   17.326  188.937   13.547   91.879   4.5720   94.800   3.4646 -2.921501 5.736482 
1 1 1   31   11   19 o   55.501   3.9851   66.277   9.0658   76.651   13.681   58.155   12.105   59.351   5.5887   51.651   5.6824 7.700199 7.970157 
1 1 1   31   11   20 o   26.449   5.7813   12.560   7.4374   29.591   12.614   3.4829   9.2084   34.782   8.7890   18.116   7.5131 16.66640 11.56257 
1 1 1   31   11   21 f   39.897   5.4528   35.583   8.6964   54.936   13.616   22.249   11.302   49.557   6.6616   30.237   8.6345 19.32026 10.90557 
1 1 1   31   11   22 o   47.385   6.5738   57.030   11.218   60.075   13.278   49.435   20.972   52.038   6.1864   42.731   11.601 9.307091 13.14752 
1 1 1   31   11   23 o   23.073   6.7170   8.7461   10.270   12.595   12.232  -0.4516   18.908   24.108   9.0630   22.039   9.9164 2.069038 13.43402 
1 1 1   31   11   24 f   60.348   7.2692   93.837   16.875   93.705   27.729   93.915   21.266   57.986   11.990   62.711   8.2220 -4.725471 14.53839 
1 1 1   31   11   25 o   25.339   7.9363   2.4816   16.097   23.990   26.623  -9.9119   20.209   30.460   12.715   20.218   9.5003 10.24139 15.87253 
1 1 1   31   11   26 o   41.351   9.2858   54.886   17.853   52.234   27.937   56.717   23.211   39.301   13.855   43.400   12.367 -4.099247 18.57161 
1 1 1   31   11   27 o   66.567   9.8065  164.230   24.787  108.721   48.397  183.967   28.859   46.337   17.880   86.797   8.0615 -40.45944 19.61295 
1 1 1   31   11   28 o   43.005   7.7978   71.564   21.906 -36.7494   48.168   99.809   24.597   24.556   12.208   61.453   9.7047 -36.89681 15.59568 
1 1 1   31   12    0 o   18.380   6.6973   10.700   9.1893   10.700   9.1893   10.700   9.1893   18.380   9.4714   18.380   9.4714 0.000000 0.000000 
1 1 1   31   12    1 o   18.094   5.2135   3.2755   6.1472   4.6326   8.7481   1.9517   8.6399   18.857   7.5035   17.331   7.2400 1.525806 10.42691 
1 1 1   31   12    2 o   38.226   4.4398   31.425   6.7050   23.469   9.0012   41.344   10.050   32.372   6.9493   44.080   5.5277 -11.70773 8.879674 
1 1 1   31   12    3 o   81.243   2.7220  138.778   9.0416  142.922   12.128  133.592   13.566   82.705   3.5555   79.781   4.1227 2.924194 5.444074 
1 1 1   31   12    4 o   51.574   3.3140   56.118   7.0490   55.616   9.9070   56.633   10.032   51.343   4.6784   51.806   4.6949 -0.4631271 6.627944 
1 1 1   31   12    5 o   80.400   2.5728  135.174   8.5305  138.213   12.145  132.214   11.984   81.297   3.6222   79.503   3.6547 1.793953 5.145617 
1 1 1   31   12    6 o   55.578   3.1886   65.119   7.3089   65.714   10.335   64.523   10.337   55.838   4.4878   55.318   4.5308 0.5198631 6.377182 
1 1 1   31   12    7 o   85.480   2.6588  153.933   9.3155  142.855   13.625  163.657   12.765   82.485   4.0049   88.474   3.4982 -5.988632 5.317629 
1 1 1   31   12    8 o   86.102   3.0443  157.708   10.243  151.150   17.326  161.233   12.701   84.408   4.9769   87.797   3.5074 -3.389702 6.088659 
1 1 1   31   12    9 o   89.282   3.0202  171.659   10.477  156.060   17.654  180.141   13.018   85.734   4.9925   92.829   3.4002 -7.094566 6.040345 
1 1 1   31   12   10 o   17.929   5.0731   3.2471   5.9918  -2.3796   9.0357   7.6634   8.0050   15.659   6.9638   20.199   7.3790 -4.540319 10.14614 
1 1 1   31   12   11 o   44.725   6.3344   42.104   8.5799   52.474   21.884   40.220   9.3266   46.004   11.550   43.447   5.2047 2.556862 12.66879 
1 1 1   31   12   12 o   44.745   5.6206   45.709   8.8264   44.208   17.142   46.251   10.296   42.983   9.8768   46.506   5.3679 -3.522526 11.24124 
1 1 1   31   12   13 o   88.411   2.6243  163.891   9.5548  158.016   13.081  170.611   13.990   86.740   3.6563   90.082   3.7656 -3.341301 5.248600 
1 1 1   31   12   14 o   66.758   3.2398   95.279   8.7840   98.396   11.584   91.063   13.473   68.241   4.1159   65.275   5.0045 2.965965 6.479642 
1 1 1   31   12   15 o   39.115   5.3610   34.432   8.4307   44.500   12.542   26.132   11.387   44.931   6.7678   33.299   8.3161 11.63246 10.72197 
1 1 1   31   12   16 o   51.515   4.0996   59.939   8.0519   50.418   13.648   65.022   9.9723   47.694   6.9381   55.337   4.3694 -7.643112 8.199265 
1 1 1   31   12   17 o   79.413   3.0318  133.618   9.4046  134.878   16.129  132.970   11.576   79.326   4.9297   79.500   3.5305 -0.1740799 6.063528 
1 1 1   31   12   18 o  145.587   2.5225  442.934   14.637  462.291   24.227  431.807   18.368  147.683   3.9775  143.492   3.1036 4.190384 5.045067 
1 1 1   31   12   19 o   21.193   5.9886   7.3371   7.8948   4.5157   12.668   9.1286   10.095   20.715   8.7172   21.671   8.2136 -0.9554939 11.97719 
1 1 1   31   12   20 o   83.886   3.3629  151.299   11.618  162.666   16.632  140.470   16.235   87.050   4.6325   80.722   4.8762 6.328003 6.725853 
1 1 1   31   12   21 o  109.207   3.0913  254.453   13.905  239.333   19.106  271.480   20.275  105.760   4.3801  112.655   4.3635 -6.894524 6.182673 
1 1 1   31   12   22 o   67.348   4.6028  100.023   12.091   96.172   14.780  107.815   21.024   66.280   5.4067   68.417   7.4506 -2.136581 9.205676 
1 1 1   31   12   23 o   44.269   7.3988   51.008   13.142   45.953   17.097   58.309   20.549   41.971   10.016   46.566   10.893 -4.594681 14.79760 
1 1 1   31   12   24 o   32.000   8.7314   28.394   15.891   31.617   26.596   26.604   19.818   32.852   13.080   31.149   11.570 1.703257 17.46277 
1 1 1   31   12   25 o   38.297   8.9537   46.355   17.164   34.781   26.500   54.720   22.529   33.546   13.150   43.049   12.155 -9.503857 17.90740 
1 1 1   31   12   26 o   34.921   9.1844   39.492   17.388   41.964   28.590   38.041   21.906   34.923   13.668   34.919   12.272 0.3738403E-02 18.36886 
1 1 1   31   12   27 o   20.942   6.9700  -6.9253   15.400 -13.8313   24.774  -2.5767   19.659   20.906   10.020   20.977   9.6914 -0.7101631E-01 13.93999 
1 1 1   31   12   28 o   31.437   8.7038   32.732   20.308 -33.8570   47.268   47.805   22.489   24.530   12.178   38.344   12.439 -13.81423 17.40758 
1 1 1   31   13    0 o   43.195   4.4349   41.571   10.488   41.571   10.488   41.571   10.488   43.195   6.2719   43.195   6.2719 0.000000 0.000000 
1 1 1   31   13    1 o   62.588   3.2664   82.918   8.4049   76.628   12.009   88.957   11.767   60.185   4.8381   64.991   4.3898 -4.806087 6.532811 
1 1 1   31   13    2 o   51.208   3.5048   55.281   7.3701   52.786   9.8885   58.399   11.054   49.957   4.7992   52.459   5.1092 -2.501839 7.009699 
1 1 1   31   13    3 o   60.882   3.1483   78.220   7.8299   78.708   10.404   77.583   11.891   61.196   4.1220   60.568   4.7600 0.6282883 6.296666 
1 1 1   31   13    4 o   86.016   2.5027  154.778   8.8728  147.495   12.488  162.202   12.609   83.949   3.6068   88.083   3.4707 -4.133667 5.005441 
1 1 1   31   13    5 o   41.215   3.9173   36.460   6.6144   32.115   9.4285   40.670   9.2817   38.688   5.9089   43.743   5.1446 -5.055199 7.834650 
1 1 1   31   13    6 o   37.901   4.2438   31.355   6.4611   28.765   9.2379   33.835   9.0401   36.002   6.4586   39.801   5.5070 -3.798916 8.487685 
1 1 1   31   13    7 f   61.395   3.5714   80.447   8.5619   78.937   14.585   81.241   10.576   60.652   5.8301   62.138   4.1267 -1.485546 7.142849 
1 1 1   31   13    8 o   30.333   5.3965   22.210   7.2175   11.226   11.816   28.748   9.1158   24.124   8.9392   36.542   6.0483 -12.41779 10.79310 
1 1 1   31   13    9 o   24.338   5.8418   10.521   6.9074   20.039   11.923   5.7118   8.4744   29.470   8.9902   19.207   7.4620 10.26298 11.68355 
1 1 1   31   13   10 f   20.158   5.4302   6.6989   6.2582   8.9202   9.3501   4.8962   8.4231   21.651   7.9648   18.665   7.3831 2.985445 10.86041 
1 1 1   31   13   11 o   28.816   5.9282   19.407   7.2302   17.403   12.903   20.324   8.7294   27.806   9.4334   29.825   7.1822 -2.018230 11.85636 
1 1 1   31   13   12 o   15.054   4.8868  -5.2116   6.5259  -4.1948   11.170  -5.7385   8.0411   16.744   7.5696   13.364   6.1825 3.379819 9.773517 
1 1 1   31   13   13 o   21.993   5.4844   7.5934   6.6701   0.4670   8.7437   17.513   10.316   16.507   7.1035   27.479   8.3579 -10.97221 10.96880 
1 1 1   31   13   14 o   70.031   3.1862  104.082   9.0850  103.154   11.916  105.371   14.040   69.823   4.1378   70.240   4.8463 -0.4163284 6.372434 
1 1 1   31   13   15 o   78.839   3.2651  133.212   10.547  118.639   15.132  146.980   14.708   74.444   4.9283   83.234   4.2843 -8.789787 6.530161 
1 1 1   31   13   16 o   90.392   2.8368  171.559   10.249  178.597   16.832  167.411   12.921   91.582   4.4561   89.202   3.5119 2.379898 5.673625 
1 1 1   31   13   17 o   54.575   5.1852   71.841   9.1665   59.650   18.578   75.764   10.539   49.500   9.4443   59.650   4.2836 -10.14979 10.37040 
1 1 1   31   13   18 o   79.291   3.1863  131.217   10.084  148.291   16.885  121.751   12.572   82.901   4.9382   75.680   4.0278 7.221329 6.372561 
1 1 1   31   13   19 f   58.721   3.9382   75.511   9.3874   74.064   14.510   76.553   12.311   57.926   6.0734   59.517   5.0151 -1.590710 7.876393 
1 1 1   31   13   20 o   90.880   3.6384  180.702   13.415  189.865   17.774  168.572   20.451   94.043   4.5823   87.716   5.6529 6.327057 7.276850 
1 1 1   31   13   21 o   23.700   6.2187   12.153   7.9770   10.983   13.082   12.846   10.065   23.610   9.2438   23.789   8.3210 -0.1794453 12.43735 
1 1 1   31   13   22 o   31.803   7.0512   27.000   10.392   29.939   12.969   21.727   17.371   34.405   9.0267   29.201   10.835 5.204786 14.10247 
1 1 1   31   13   23 o   27.388   7.4643   16.743   12.055   9.4655   15.958   26.414   18.397   23.637   9.8538   31.138   11.215 -7.501326 14.92861 
1 1 1   31   13   24 o   43.271   8.6460   57.769   16.713   44.616   26.869   66.070   21.345   37.114   13.525   49.427   10.775 -12.31278 17.29198 
1 1 1   31   13   25 o   26.197   8.1062   10.696   16.310   22.733   26.158   3.0392   20.862   29.363   12.450   23.030   10.384 6.332342 16.21244 
1 1 1   31   13   26 o   35.345   8.0123   40.031   16.753   3.1308   28.051   60.490   20.888   24.830   11.508   45.859   11.151 -21.02929 16.02453 
1 1 1   31   13   27 o   48.501   8.0977   76.730   17.979   41.030   27.862  102.202   23.535   33.963   13.430   63.039   9.0517 -29.07660 16.19545 
1 1 1   31   14    0 o   22.129   6.8908   15.138   9.3249   15.138   9.3249   15.138   9.3249   22.129   9.7451   22.129   9.7451 0.000000 0.000000 
1 1 1   31   14    1 o   26.733   5.6594   16.105   6.7965   19.021   9.6236   13.204   9.5998   28.834   7.8715   24.633   8.1335 4.201361 11.31873 
1 1 1   31   14    2 f   43.653   4.1366   41.026   7.3795   34.546   10.346   47.737   10.529   40.005   6.2704   47.301   5.3969 -7.296150 8.273112 
1 1 1   31   14    3 o   51.484   3.5020   56.229   7.3913   55.977   9.9184   56.543   11.084   51.434   4.6755   51.534   5.2149 -0.9979630E-01 7.003975 
1 1 1   31   14    4 o   38.361   4.1239   31.623   6.5149   30.043   9.2838   33.156   9.1448   37.366   6.0240   39.357   5.6336 -1.991203 8.247764 
1 1 1   31   14    5 o   54.648   3.1587   63.120   7.1085   61.904   10.281   64.234   9.8395   54.102   4.6073   55.193   4.3223 -1.091469 6.317452 
1 1 1   31   14    6 o   20.079   5.3769   6.6348   6.3865   0.5343   10.308   10.436   8.1365   17.934   7.7151   22.224   7.4913 -4.289885 10.75371 
1 1 1   31   14    7 o   68.213   3.2723   96.195   8.8023  106.414   15.115   90.951   10.828   70.664   5.1860   65.763   3.9921 4.901443 6.544535 
1 1 1   31   14    8 o   68.642   3.2606   99.765   8.8238   99.987   14.819   99.643   10.983   68.431   5.2505   68.854   3.8675 -0.4222488 6.521171 
1 1 1   31   14    9 o   48.896   3.5827   50.642   7.1803   54.256   10.904   47.875   9.5410   50.366   5.2491   47.427   4.8775 2.938190 7.165440 
1 1 1   31   14   10 o  143.965   2.8031  431.976   15.521  450.632   27.675  423.414   18.747  145.660   4.6066  142.269   3.1950 3.390549 5.606151 
1 1 1   31   14   11 o   35.526   5.5051   29.576   7.5288   26.442   13.300   31.054   9.1329   33.180   9.3293   37.871   5.8471 -4.690502 11.01019 
1 1 1   31   14   12 o   16.995   4.7213  -1.4996   5.8499   11.093   8.5417 -12.6240   8.0282   22.651   7.6753   11.338   5.5003 11.31329 9.442677 
1 1 1   31   14   13 o   49.745   3.8678   53.505   7.7431   53.970   9.9613   52.795   12.308   50.270   4.8044   49.221   6.0629 1.049267 7.735694 
1 1 1   31   14   14 o   63.153   3.7087   85.508   9.6406   91.587   14.183   80.287   13.144   65.217   5.2727   61.089   5.2168 4.128384 7.417316 
1 1 1   31   14   15 o   16.156   5.1800  -5.5553   7.4613   0.8002   11.485 -10.1961   9.8144   18.642   8.0815   13.669   6.4822 4.973505 10.36002 
1 1 1   31   14   16 f  107.862   2.6486  243.990   11.425  254.421   18.745  237.825   14.410  109.371   4.1555  106.352   3.2852 3.019089 5.297262 
1 1 1   31   14   17 o   42.407   4.7416   40.108   7.6768   42.608   13.158   38.818   9.4522   42.600   7.7755   42.215   5.4288 0.3847961 9.483130 
1 1 1   31   14   18 o   93.128   2.9358  184.775   10.966  184.517   17.660  184.936   13.989   92.723   4.6179   93.532   3.6263 -0.8088989 5.871509 
1 1 1   31   14   19 o   82.141   3.3045  145.293   11.137  142.916   16.524  147.272   15.074   81.337   4.9257   82.944   4.4064 -1.606949 6.609009 
1 1 1   31   14   20 o   38.355   6.2358   36.337   9.6640   34.388   13.811   38.206   13.528   37.122   9.0924   39.587   8.5363 -2.464600 12.47155 
1 1 1   31   14   21 o   29.583   6.2802   22.427   8.3854   17.778   13.523   25.332   10.688   26.989   9.6261   32.176   8.0686 -5.186541 12.56041 
1 1 1   31   14   22 o   41.517   7.1776   45.285   12.125   42.807   16.207   48.435   18.272   40.511   9.8055   42.523   10.484 -2.011646 14.35518 
1 1 1   31   14   23 o   23.700   7.1046   8.6724   11.950   6.5976   15.881   11.380   18.142   22.488   9.6227   24.912   10.455 -2.423830 14.20919 
1 1 1   31   14   24 o   22.664   7.0840   0.5261   14.563 -30.1923   25.239   15.857   17.830   19.152   9.3905   26.176   10.609 -7.023834 14.16803 
1 1 1   31   14   25 o   33.884   9.0645   35.828   16.932   48.696   27.710   28.160   21.389   37.073   13.699   30.695   11.875 6.377838 18.12909 
1 1 1   31   14   26 o   43.501   9.3295   62.477   17.990   69.135   28.093   57.848   23.423   44.463   13.840   42.540   12.514 1.923050 18.65897 
1 1 1   31   15    0 o   52.324   3.7265   59.081   11.108   59.081   11.108   59.081   11.108   52.324   5.2700   52.324   5.2700 0.000000 0.000000 
1 1 1   31   15    1 o   59.703   3.3663   75.581   8.2871   76.863   11.660   74.272   11.780   60.237   4.6932   59.168   4.8273 1.069397 6.732674 
1 1 1   31   15    2 o   39.871   4.4297   34.382   7.2839   34.002   10.324   34.759   10.278   39.636   6.3155   40.106   6.2133 -0.4695816 8.859452 
1 1 1   31   15    3 o   59.511   3.1660   74.953   7.7323   73.951   11.473   75.786   10.466   59.069   4.7094   59.953   4.2326 -0.8840141 6.331903 
1 1 1   31   15    4 o   87.374   2.5056  159.975   9.0276  157.152   12.807  162.764   12.728   86.591   3.5859   88.157   3.5005 -1.565933 5.011209 
1 1 1   31   15    5 o   16.085   4.8839  -3.6490   6.1050   6.4935   9.7150 -10.2680   7.8482   20.380   7.9696   11.790   5.6477 8.590215 9.767844 
1 1 1   31   15    6 o   54.929   3.4422   63.220   7.6630   69.451   12.226   59.187   9.8347   57.004   5.2000   52.853   4.5115 4.150612 6.884355 
1 1 1   31   15    7 o   39.918   4.8115   36.013   7.3111   33.510   12.214   37.410   9.1269   38.050   8.0345   41.785   5.2959 -3.734344 9.622911 
1 1 1   31   15    8 o   74.161   2.8362  116.374   8.6096  113.004   12.880  119.097   11.575   73.074   4.2737   75.247   3.7298 -2.173378 5.672358 
1 1 1   31   15    9 o   43.929   3.9713   42.446   7.0375   35.474   10.456   48.220   9.5156   40.319   6.2876   47.539   4.8531 -7.219749 7.942650 
1 1 1   31   15   10 o   91.958   3.1245  181.593   10.950  173.729   19.397  185.272   13.266   89.956   5.2280   93.961   3.4231 -4.005150 6.248932 
1 1 1   31   15   11 o   46.159   4.4654   42.727   8.0144   59.201   14.629   35.663   9.5799   51.743   6.8550   40.575   5.7244 11.16715 8.930846 
1 1 1   31   15   12 o  123.152   2.4541  318.317   12.380  322.005   18.670  315.423   16.540  123.659   3.6605  122.645   3.2697 1.013771 4.908242 
1 1 1   31   15   13 o   40.966   5.0911   37.333   8.3565   44.754   12.771   31.776   11.051   44.870   6.9007   37.061   7.4873 7.808693 10.18227 
1 1 1   31   15   14 f   60.016   3.8006   77.772   9.3412   80.077   14.147   75.991   12.438   60.647   5.6558   59.384   5.0783 1.263065 7.601140 
1 1 1   31   15   15 o   45.248   4.3453   45.315   7.6479   44.750   13.091   45.609   9.4234   44.517   7.1298   45.979   4.9691 -1.462498 8.690551 
1 1 1   31   15   16 o   65.880   3.3377   92.910   8.6142   94.639   14.701   92.006   10.630   65.924   5.4069   65.836   3.9149 0.8847809E-01 6.675358 
1 1 1   31   15   17 o   43.094   5.1487   48.681   7.9175   25.975   12.989   62.105   9.9874   32.342   9.2635   53.845   4.4972 -21.50264 10.29741 
1 1 1   31   15   18 o   69.352   3.4185  104.677   9.3638  100.318   15.443  107.212   11.775   67.728   5.5284   70.976   4.0225 -3.247780 6.836919 
1 1 1   31   15   19 o   61.929   4.3349   86.372   10.903   94.802   14.767   76.268   16.166   65.774   5.4433   58.084   6.7480 7.690033 8.669779 
1 1 1   31   15   20 o   26.805   6.7558   17.438   9.4492   15.304   13.292   19.617   13.435   25.624   9.4840   27.986   9.6237 -2.361725 13.51156 
1 1 1   31   15   21 o   53.736   4.3470   64.934   9.5794   64.758   14.284   65.078   12.914   53.421   6.4832   54.052   5.7925 -0.6313324 8.693985 
1 1 1   31   15   22 o   36.054   7.6899   35.214   12.260   29.956   15.930   42.854   19.201   33.182   10.437   38.926   11.296 -5.743950 15.37989 
1 1 1   31   15   23 o   59.095   5.9154   83.576   13.927   78.302   17.414   92.938   23.201   57.646   7.3242   60.543   9.2912 -2.897060 11.83089 
1 1 1   31   15   24 o   43.669   13.941   66.212   28.336   66.212   28.336   0.0000   0.0000   43.669   13.941  ?   ?       ?      ? 
1 1 1   31   15   25 o   45.699   7.3161   82.745   20.793 -38.4378   46.587  112.891   23.236   24.130   11.998   67.267   8.3751 -43.13631 14.63218 
1 1 1   31   16    0 o   73.961   3.0536  115.393   13.071  115.393   13.071  115.393   13.071   73.961   4.3185   73.961   4.3185 0.000000 0.000000 
1 1 1   31   16    1 o   53.796   3.5842   61.800   7.9496   59.510   11.161   64.158   11.326   52.763   5.1287   54.830   5.0082 -2.066566 7.168382 
1 1 1   31   16    2 o   58.638   3.3805   73.324   8.1515   79.236   11.489   67.330   11.568   61.106   4.5585   56.170   4.9931 4.935921 6.761010 
1 1 1   31   16    3 o   16.542   4.9986   0.5689   6.0588   2.7575   8.9134  -1.3109   8.2607   17.781   7.3845   15.304   6.7391 2.477321 9.997296 
1 1 1   31   16    4 o   20.682   5.6190   6.1678   6.6047   11.907   11.010   2.9415   8.2550   24.006   8.6713   17.359   7.1484 6.646786 11.23796 
1 1 1   31   16    5 o   42.327   4.4728   40.837   7.2695   33.502   11.334   45.963   9.4751   38.263   7.4500   46.390   4.9521 -8.127056 8.945683 
1 1 1   31   16    6 o   76.268   3.1707  120.931   9.4420  131.602   16.498  115.733   11.514   78.393   5.1024   74.142   3.7654 4.250969 6.341363 
1 1 1   31   16    7 o   19.843   5.1526   4.0402   6.2100   14.922   9.4962  -4.0902   8.2083   25.581   8.0604   14.105   6.4207 11.47682 10.30513 
1 1 1   31   16    8 o  101.169   2.5519  213.158   10.551  230.380   16.274  200.670   13.858  104.568   3.7734   97.770   3.4367 6.798393 5.103813 
1 1 1   31   16    9 o   56.166   3.4059   68.180   7.7654   61.744   11.703   73.243   10.380   53.566   5.2973   58.767   4.2823 -5.201126 6.811726 
1 1 1   31   16   10 o   79.636   3.2831  130.677   10.071  148.234   18.225  122.958   12.084   82.940   5.3276   76.332   3.8382 6.608192 6.566244 
1 1 1   31   16   11 o   23.201   4.8725   9.9606   6.3958  -4.5345   9.3538   22.689   8.7651   14.981   6.8331   31.422   6.9479 -16.44030 9.744946 
1 1 1   31   16   12 o   25.971   5.6628   13.528   7.1239   5.4748   9.2115   25.514   11.237   19.260   7.6884   32.682   8.3162 -13.42157 11.32568 
1 1 1   31   16   13 o   35.705   5.5304   28.358   8.4841   49.069   13.101   13.401   11.134   46.837   6.7821   24.573   8.7376 22.26374 11.06084 
1 1 1   31   16   14 o   38.824   5.6033   35.725   8.5800   35.430   13.189   35.942   11.297   38.270   8.5690   39.377   7.2223 -1.107124 11.20663 
1 1 1   31   16   15 o   74.559   3.0892  113.813   9.1632  138.019   15.632  101.141   11.310   80.117   4.7306   69.000   3.9742 11.11705 6.178472 
1 1 1   31   16   16 o   48.839   4.2269   53.338   8.0436   49.932   13.512   55.207   10.010   47.051   6.9631   50.628   4.7940 -3.576977 8.453849 
1 1 1   31   16   17 o   63.252   3.6419   85.046   9.2478   95.194   15.218   79.103   11.645   65.885   5.6001   60.619   4.6575 5.266190 7.283733 
1 1 1   31   16   18 o   20.931   5.6805   8.2974   7.1651  -0.2093   12.786   12.192   8.6511   18.820   8.3307   23.043   7.7247 -4.222895 11.36097 
1 1 1   31   16   19 o   35.844   5.9572   31.498   8.6151   34.705   13.004   28.988   11.501   37.367   8.6141   34.321   8.2311 3.045761 11.91442 
1 1 1   31   16   20 o   48.874   5.3293   57.431   10.168   64.923   13.656   48.112   15.231   53.720   6.1634   44.028   8.6959 9.692780 10.65860 
1 1 1   31   16   21 o   47.009   6.4119   47.930   10.464   72.354   22.480   41.174   11.823   51.676   10.891   42.342   6.7703 9.334351 12.82375 
1 1 1   31   16   22 o   48.469   6.6564   59.502   12.981   47.486   17.355   74.762   19.557   41.939   10.144   54.998   8.6216 -13.05906 13.31275 
1 1 1   31   16   23 o   29.393   7.6881   23.924   12.065   22.730   15.123   26.017   20.012   28.819   10.190   29.968   11.515 -1.149719 15.37630 
1 1 1   31   16   24 o   41.353   8.4627   56.961   16.384   39.788   27.407   66.510   20.438   33.725   13.325   48.980   10.436 -15.25492 16.92540 
1 1 1   31   17    0 o   54.762   3.5868   64.568   11.231   64.568   11.231   64.568   11.231   54.762   5.0725   54.762   5.0725 0.000000 0.000000 
1 1 1   31   17    1 o  103.324   2.6989  224.976   11.501  224.621   16.230  225.334   16.301  103.246   3.8114  103.403   3.8221 -0.1574554 5.397702 
1 1 1   31   17    2 o   62.922   3.1144   83.619   8.0113   87.109   12.265   81.023   10.581   63.959   4.6492   61.885   4.1453 2.074402 6.228878 
1 1 1   31   17    3 o   49.396   4.1124   52.426   7.9605   54.421   13.631   51.393   9.8066   49.735   6.6451   49.056   4.8468 0.6787033 8.224873 
1 1 1   31   17    4 o   28.945   5.1404   21.250   7.1479   3.6339   12.180   30.503   8.8277   20.351   8.5549   37.539   5.7016 -17.18845 10.28080 
1 1 1   31   17    5 o   27.306   5.8826   17.411   7.0891   16.115   11.932   18.118   8.8132   26.658   9.0713   27.954   7.4919 -1.295784 11.76512 
1 1 1   31   17    6 o   65.117   3.0906   91.002   8.1695   83.560   12.384   96.736   10.870   62.541   4.8009   67.694   3.8934 -5.153465 6.181225 
1 1 1   31   17    7 o   18.212   5.1909   3.9516   6.0377   6.6523   8.9031   1.6521   8.2154   19.834   7.6643   16.591   7.0029 3.242514 10.38177 
1 1 1   31   17    8 o   56.242   3.3370   68.270   7.6511   60.750   11.260   74.719   10.428   53.155   5.1362   59.329   4.2616 -6.174110 6.673921 
1 1 1   31   17    9 o   42.633   5.1714   39.631   8.0740   45.728   15.193   37.231   9.5314   43.841   8.7092   41.424   5.5787 2.416672 10.34278 
1 1 1   31   17   10 f   44.791   5.1635   48.866   8.0946   38.364   14.745   53.396   9.6843   39.657   9.1940   49.925   4.7031 -10.26855 10.32709 
1 1 1   31   17   11 o   74.781   2.8921  118.864   8.8737  119.177   13.239  118.608   11.957   74.756   4.2938   74.806   3.8755 -0.5020905E-01 5.784136 
1 1 1   31   17   12 o   64.425   4.0459   92.813   10.309   82.974   16.551   99.049   13.177   60.964   6.5825   67.886   4.7062 -6.922119 8.091812 
1 1 1   31   17   13 o   84.315   3.2087  151.803   11.061  156.615   16.887  148.187   14.639   85.291   4.8004   83.339   4.2589 1.952194 6.417330 
1 1 1   31   17   14 f   15.665   5.1141  -8.8518   7.6498   0.6288   12.139 -15.0975   9.8525   18.861   8.2404   12.469   6.0592 6.391776 10.22830 
1 1 1   31   17   15 o   82.438   3.0790  147.900   9.8734  137.226   16.666  153.673   12.256   79.570   5.0783   85.307   3.4833 -5.736656 6.158092 
1 1 1   31   17   16 o   31.157   5.8965   21.514   7.4823   32.697   13.047   16.032   9.1336   36.381   8.7925   25.933   7.8592 10.44842 11.79299 
1 1 1   31   17   17 o   36.081   6.0292   31.929   8.7456   33.670   13.506   30.672   11.477   36.608   9.0068   35.554   8.0176 1.053307 12.05841 
1 1 1   31   17   18 o   27.516   6.5783   18.510   8.6310   20.960   14.324   17.113   10.815   28.632   9.9317   26.399   8.6288 2.232769 13.15658 
1 1 1   31   17   19 o   60.896   3.9898   81.483   9.9691   92.440   14.995   72.804   13.345   64.534   5.6338   57.259   5.6509 7.275070 7.979553 
1 1 1   31   17   20 o   59.832   4.4823   81.878   10.891   85.854   14.488   76.711   16.514   62.073   5.6591   57.592   6.9525 4.480930 8.964516 
1 1 1   31   17   21 o   23.002   7.0827   6.5297   12.586   3.3403   17.213   10.195   18.451   21.731   9.6404   24.273   10.379 -2.541910 14.16547 
1 1 1   31   17   22 o   41.481   7.4844   48.495   12.758   48.951   16.664   47.849   19.832   42.778   9.6717   40.184   11.425 2.593681 14.96885 
1 1 1   31   17   23 o   57.649   6.2193   81.849   14.201   65.306   18.383  106.328   22.362   49.911   9.2715   65.386   8.2920 -15.47492 12.43854 
1 1 1   31   18    0 o   96.619   2.7530  195.756   15.458  195.756   15.458  195.756   15.458   96.619   3.8933   96.619   3.8933 0.000000 0.000000 
1 1 1   31   18    1 f   17.224   5.1173  -0.4251   6.5950   7.5158   9.5593  -7.6377   9.1104   20.689   7.9564   13.759   6.4375 6.929814 10.23455 
1 1 1   31   18    2 o   27.910   5.5662   14.767   6.9629   31.037   11.997   6.5024   8.5505   36.290   8.2074   19.531   7.5211 16.75866 11.13237 
1 1 1   31   18    3 o   44.025   4.8512   44.863   7.9062   39.301   13.535   47.744   9.7408   40.878   8.3109   47.173   5.0066 -6.294331 9.702451 
1 1 1   31   18    4 o   24.162   5.7571   13.163   6.8310   9.8456   11.195   15.131   8.6221   22.733   8.6416   25.591   7.6092 -2.858109 11.51425 
1 1 1   31   18    5 o   35.681   4.8844   30.340   6.8524   20.398   10.347   38.108   9.1456   29.339   8.2212   42.023   5.2766 -12.68450 9.768842 
1 1 1   31   18    6 o   37.884   4.5601   31.567   6.8445   41.541   10.349   23.813   9.1252   43.667   5.7463   32.100   7.0824 11.56747 9.120294 
1 1 1   31   18    7 o   32.659   5.1037   24.466   6.6590   27.998   10.112   21.762   8.8482   34.724   7.2929   30.595   7.1419 4.128342 10.20750 
1 1 1   31   18    8 o   18.185   5.1787   4.0218   6.1830  -0.5900   9.2621   7.7290   8.3042   16.322   7.1629   20.048   7.4811 -3.726002 10.35733 
1 1 1   31   18    9 o   23.620   5.5692   2.5191   7.0236   29.314   13.586  -7.2548   8.2052   34.331   9.3443   12.909   6.0618 21.42213 11.13833 
1 1 1   31   18   10 o   45.145   4.9617   45.235   8.2436   49.597   15.167   43.406   9.8209   45.610   8.3709   44.680   5.3294 0.9297142 9.923424 
1 1 1   31   18   11 o   42.392   5.5376   42.214   9.1070   40.557   14.851   43.213   11.529   40.665   9.0838   44.119   6.3359 -3.454159 11.07517 
1 1 1   31   18   12 o   82.107   3.5358  144.740   11.659  150.036   18.870  141.470   14.829   82.903   5.5186   81.311   4.4218 1.592003 7.071529 
1 1 1   31   18   13 o   21.090   6.2673   5.0747   9.2023   5.1244   12.369   5.0130   13.772   20.745   8.6640   21.435   9.0583 -0.6898212 12.53466 
1 1 1   31   18   14 o  119.243   2.8924  291.875   12.974  331.945   24.512  276.278   15.293  123.970   4.7939  114.516   3.2378 9.454590 5.784870 
1 1 1   31   18   15 o   22.385   5.0787   9.1118   7.3507 -15.8246   12.700   21.674   9.0140   14.601   7.0430   30.168   7.3191 -15.56676 10.15743 
1 1 1   31   18   16 o   27.329   6.0515   17.972   7.3368   20.296   12.403   16.721   9.0994   28.383   9.2391   26.276   7.8179 2.107115 12.10296 
1 1 1   31   18   17 o   19.089   5.5801   4.9124   7.1255   0.2908   12.216   7.2958   8.7725   18.484   8.1645   19.694   7.6086 -1.210016 11.16016 
1 1 1   31   18   18 o   68.658   3.6066  102.854   10.145  107.910   15.387   98.965   13.494   69.953   5.3331   67.364   4.8568 2.588356 7.213242 
1 1 1   31   18   19 o   70.217   3.6146  107.580   10.420  122.247   15.545   95.614   14.041   74.575   5.0540   65.859   5.1691 8.715523 7.229258 
1 1 1   31   18   20 o   35.691   6.4665   36.151   11.073   15.037   17.672   49.799   14.208   25.701   10.507   45.681   7.5413 -19.97961 12.93304 
1 1 1   31   18   21 o   25.123   7.8599   10.727   15.779   17.982   17.086 -31.3317   41.137   26.556   10.512   23.691   11.688 2.865339 15.71985 
1 1 1   31   18   22 o   17.849   6.0017 -11.3914   11.931 -13.8470   15.952  -8.2734   17.975   16.755   8.0331   18.942   8.9191 -2.186544 12.00336 
1 1 1   31   19    0 o   26.466   8.1606   22.563   13.083   22.563   13.083   22.563   13.083   26.466   11.541   26.466   11.541 0.000000 0.000000 
1 1 1   31   19    1 o   39.305   5.0952   34.368   7.6946   38.587   13.252   32.222   9.4508   40.304   8.2499   38.307   5.9817 1.996834 10.19033 
1 1 1   31   19    2 o   53.730   4.5510   70.899   8.5112   47.587   14.528   83.079   10.502   44.927   8.1404   62.533   4.0719 -17.60615 9.101964 
1 1 1   31   19    3 o   53.192   3.9215   59.563   8.1806   68.587   14.302   55.175   9.9730   55.713   6.2242   50.671   4.7720 5.041737 7.843021 
1 1 1   31   19    4 o   34.751   4.9737   28.087   6.9457   23.747   10.307   31.698   9.4006   31.555   7.9293   37.947   6.0064 -6.391581 9.947431 
1 1 1   31   19    5 o   57.559   3.3273   70.522   7.8602   78.293   11.849   64.415   10.504   60.337   4.7613   54.781   4.6491 5.555683 6.654690 
1 1 1   31   19    6 o   92.877   2.6492  181.398   10.072  192.712   15.377  172.896   13.330   95.286   3.9127   90.468   3.5726 4.817917 5.298387 
1 1 1   31   19    7 o   44.730   3.9594   43.299   7.2433   51.846   10.786   36.279   9.7757   48.819   5.3568   40.642   5.8319 8.176968 7.918759 
1 1 1   31   19    8 o   20.132   6.0340   3.6967   8.5140   4.0039   13.634   3.5003   10.901   21.030   8.9552   19.234   8.0896 1.796301 12.06800 
1 1 1   31   19    9 o   79.473   3.6135  132.439   11.604  159.031   18.870  116.268   14.715   85.502   5.3510   73.444   4.8578 12.05752 7.227092 
1 1 1   31   19   10 o   76.016   3.5971  120.899   10.892  141.741   18.434  109.721   13.500   80.531   5.5499   71.501   4.5778 9.029617 7.194260 
1 1 1   31   19   11 f   55.390   4.5264   70.541   9.7048   60.914   16.052   76.088   12.184   51.490   7.5584   59.290   4.9825 -7.800068 9.052895 
1 1 1   31   19   12 o   43.092   5.4912   42.803   9.1999   46.635   15.310   40.638   11.510   43.656   8.8067   42.528   6.5617 1.127552 10.98247 
1 1 1   31   19   13 o   66.338   3.7022   95.427   10.083  104.453   15.172   88.286   13.495   69.059   5.3267   63.616   5.1431 5.443035 7.404386 
1 1 1   31   19   14 o   40.849   5.2612   40.057   8.1740   36.334   13.661   42.133   10.202   38.085   8.8631   43.613   5.6714 -5.528046 10.52234 
1 1 1   31   19   15 o   66.913   3.4843   98.486   9.2446   94.287   15.092  101.008   11.696   65.220   5.6103   68.606   4.1334 -3.385735 6.968533 
1 1 1   31   19   16 o   58.763   3.8608   78.049   8.8751   69.847   14.573   82.883   11.189   55.547   6.3611   61.979   4.3771 -6.431870 7.721577 
1 1 1   31   19   17 o   50.864   4.2161   58.058   8.4768   58.230   14.080   57.960   10.617   50.308   6.7856   51.421   5.0059 -1.113052 8.432255 
1 1 1   31   19   18 o   40.975   5.4426   40.512   8.7775   43.407   13.521   38.403   11.540   41.915   8.1142   40.034   7.2560 1.880844 10.88525 
1 1 1   31   19   19 f  103.136   3.7313  240.270   15.449  216.464   23.935  257.270   20.226   97.678   5.9411  108.595   4.5159 -10.91718 7.462607 
1 1 1   31   19   20 o   36.787   10.575   44.850   23.941   22.229   28.826   95.155   42.986   28.850   12.649   44.724   16.950 -15.87414 21.14941 
1 1 1   31   19   21 f   20.072   9.1060  -0.1277   16.330  -0.1277   16.330   0.0000   0.0000   20.072   9.1060  ?   ?       ?      ? 
1 1 1   31   20    0 o   72.203   4.0261  112.733   16.714  112.733   16.714  112.733   16.714   72.203   5.6938   72.203   5.6938 0.000000 0.000000 
1 1 1   31   20    2 o   60.239   4.3564   80.799   10.717   69.808   15.342   91.271   14.976   55.868   6.6581   64.610   5.6198 -8.741848 8.712774 
1 1 1   31   20    3 o   45.103   4.0603   44.701   7.5214   43.027   11.007   46.168   10.302   44.165   6.0425   46.041   5.4252 -1.875362 8.120576 
1 1 1   31   20    4 o   82.571   3.0568  144.940   10.376  137.627   13.997  153.861   15.459   80.334   4.2243   84.808   4.4194 -4.473793 6.113610 
1 1 1   31   20    5 o   33.809   4.5568   25.354   6.8418   52.264   10.330   4.3259   9.1317   49.132   5.0978   18.487   7.5546 30.64450 9.113680 
1 1 1   31   20    6 o   61.074   3.1957   79.695   8.0169   82.850   11.976   77.132   10.792   62.083   4.6769   60.064   4.3562 2.019043 6.391442 
1 1 1   31   20    7 o   21.826   5.5306   9.9219   6.4845   6.2081   9.3922   13.305   8.9638   19.633   7.7867   24.018   7.8560 -4.384884 11.06118 
1 1 1   31   20    8 o   33.505   6.4620   27.813   9.0565   28.845   14.321   27.125   11.691   33.678   9.7504   33.332   8.4829 0.3458328 12.92401 
1 1 1   31   20    9 o   53.036   4.6566   61.704   10.026   71.998   15.997   55.046   12.866   56.393   6.8779   49.679   6.2794 6.714218 9.313249 
1 1 1   31   20   10 o   16.357   5.3354  -5.7457   8.0497  -3.7220   13.245  -6.9308   10.136   18.002   8.1799   14.712   6.8523 3.289709 10.67077 
1 1 1   31   20   11 o   42.247   5.5390   41.555   9.0962   48.392   14.805   37.410   11.529   44.636   8.3489   39.858   7.2812 4.777920 11.07792 
1 1 1   31   20   12 o   24.377   6.0464   7.8547   8.3694   27.926   13.947  -3.4413   10.463   32.751   9.6626   16.003   7.2712 16.74801 12.09276 
1 1 1   31   20   13 o   44.688   4.9583   44.460   8.2330   51.820   15.118   41.358   9.8162   46.126   8.2496   43.249   5.5031 2.877850 9.916637 
1 1 1   31   20   14 o   24.882   5.8707   11.677   7.2877   25.549   12.410   4.3750   9.0037   31.591   9.0567   18.174   7.4726 13.41732 11.74148 
1 1 1   31   20   15 o   87.112   3.0659  167.764   10.612  145.916   16.725  182.487   13.730   81.638   4.9671   92.586   3.5954 -10.94765 6.131825 
1 1 1   31   20   16 o   43.152   5.7721   48.392   8.8561   38.837   16.431   52.304   10.514   37.675   10.285   48.629   5.2422 -10.95411 11.54418 
1 1 1   31   20   17 f   17.332   5.7238  -6.9129   9.7923  -8.1878   12.483  -4.8736   15.789   15.903   7.4706   18.762   8.6739 -2.859006 11.44758 
1 1 1   31   20   18 o   79.039   3.4702  138.932   11.205  123.253   16.256  153.124   15.466   74.321   5.3033   83.756   4.4770 -9.435005 6.940333 
1 1 1   31   20   19 o   18.032   5.8612  -2.9601   8.7669   1.9039   16.974  -4.7297   10.238   20.929   9.4083   15.135   6.9928 5.793765 11.72237 
1 1 1   31   21    0 o   55.792   5.0462   70.267   15.687   70.267   15.687   70.267   15.687   55.792   7.1364   55.792   7.1364 0.000000 0.000000 
1 1 1   31   21    1 o   26.324   7.7393   10.520   10.210   21.186   27.817   8.8594   10.977   30.840   12.944   21.808   8.4870 9.031221 15.47856 
1 1 1   31   21    2 o   78.755   3.7334  133.617   11.792  141.596   19.244  128.820   14.922   80.165   5.8201   77.345   4.6775 2.820282 7.466812 
1 1 1   31   21    3 o   41.668   4.9772   41.150   8.0395   51.314   11.022   29.593   11.753   48.403   5.5209   34.932   8.2830 13.47098 9.954334 
1 1 1   31   21    4 o   37.322   5.2487   32.987   7.8331   36.676   10.507   28.371   11.752   40.555   6.2816   34.090   8.4106 6.465939 10.49746 
1 1 1   31   21    5 o   33.136   5.4191   27.442   7.7339   37.327   10.335   14.861   11.659   40.968   6.1163   25.303   8.9474 15.66442 10.83812 
1 1 1   31   21    6 o   46.193   4.6372   49.721   8.3025   58.086   11.187   39.466   12.387   51.567   5.2600   40.818   7.6385 10.74842 9.274433 
1 1 1   31   21    7 o   33.657   6.5862   27.852   9.2501   33.918   15.072   24.185   11.716   36.177   9.8404   31.137   8.7566 5.039629 13.17232 
1 1 1   31   21    8 o   28.609   6.5303   17.759   9.0073   32.504   14.850   9.1751   11.330   35.307   9.8332   21.911   8.5957 13.39668 13.06052 
1 1 1   31   21    9 o   62.046   4.2562   86.961   10.604   81.367   16.629   90.795   13.767   59.724   6.7506   64.368   5.1856 -4.644173 8.512425 
1 1 1   31   21   10 f   27.141   6.5256   16.944   8.5619   25.022   14.190   12.318   10.737   30.906   9.8653   23.375   8.5447 7.530399 13.05128 
1 1 1   31   21   11 o   29.882   6.6021   22.706   8.8197   23.632   14.719   22.186   11.017   30.013   10.076   29.751   8.5340 0.2613182 13.20427 
1 1 1   31   21   12 o   57.020   5.0125   64.593   10.658  103.891   21.456   51.719   12.281   66.167   7.8623   47.873   6.2197 18.29398 10.02495 
1 1 1   31   21   13 o   44.342   5.7092   48.481   9.9025   43.155   15.431   52.210   12.912   40.890   9.3527   47.795   6.5501 -6.904587 11.41831 
1 1 1   31   21   14 o   18.694   5.5804   4.1414   7.1999   1.1940   12.475   5.6135   8.8165   18.784   8.2760   18.604   7.4882 0.1792698 11.16086 
1 1 1   31   21   15 o   29.857   6.0715   20.769   7.7408   32.745   13.233   14.540   9.5439   35.395   9.0344   24.319   8.1136 11.07577 12.14295 
1 1 1   31   21   16 o   48.298   4.5223   54.709   8.4729   50.340   14.183   57.133   10.565   45.802   7.5079   50.793   5.0433 -4.991550 9.044554 
1 1 1   31   21   17 o   32.492   6.1762   27.462   8.3825   29.345   12.895   26.084   11.031   33.139   9.1385   31.845   8.3107 1.294024 12.35232 
1 1 1   31   21   18 o   55.624   5.3351   76.886   10.850   68.174   18.697   81.309   13.322   51.023   9.2244   60.226   5.3632 -9.202599 10.67016 
1 1 1   31   22    0 o   13.667   5.8569   4.5634   8.6388   4.5634   8.6388   4.5634   8.6388   13.667   8.2829   13.667   8.2829 0.000000 0.000000 
1 1 1   31   22    1 o   22.172   5.3781   8.4857   7.1743   20.169   9.8693  -4.6065   10.447   28.713   8.0234   15.631   7.1640 13.08282 10.75629 
1 1 1   31   22    2 o   34.165   5.5468   28.724   7.6752   32.660   10.406   24.027   11.366   37.308   7.0202   31.023   8.5898 6.284225 11.09360 
1 1 1   31   22    3 o   71.489   3.3022  110.924   9.7033  113.989   13.316  107.454   14.169   72.709   4.4403   70.269   4.8889 2.439453 6.604363 
1 1 1   31   22    4 o   32.595   5.6965   26.055   7.5858   26.071   10.186   26.036   11.367   32.838   7.6610   32.352   8.4327 0.4863205 11.39304 
1 1 1   31   22    5 o   46.325   4.3198   47.604   8.2033   43.142   10.895   53.445   12.466   43.903   6.0167   48.746   6.2002 -4.843723 8.639655 
1 1 1   31   22    6 o   51.283   4.9634   63.048   9.4436   68.277   11.782   53.652   15.794   55.828   5.1167   46.738   8.5065 9.090000 9.926802 
1 1 1   31   22    7 o   26.491   5.4911   14.364   9.1361 -15.8509   14.712   33.331   11.656   15.933   7.6588   37.049   7.8709 -21.11589 10.98218 
1 1 1   31   22    8 o   46.574   6.2831   53.369   10.424   54.412   20.086   52.985   12.195   44.583   10.993   48.566   6.0879 -3.982780 12.56611 
1 1 1   31   22    9 o   33.599   5.7386   30.911   8.9013   11.092   14.604   42.626   11.228   23.776   9.6135   43.423   6.2694 -19.64696 11.47714 
1 1 1   31   22   10 o   39.916   5.9770   40.453   9.3541   34.934   15.452   43.645   11.752   36.102   10.022   43.730   6.5160 -7.628593 11.95404 
1 1 1   31   22   11 o   49.673   4.8121   56.174   9.5030   60.413   15.835   53.789   11.880   50.442   7.6115   48.903   5.8899 1.538651 9.624232 
1 1 1   31   22   12 o   17.061   5.3962  -0.2759   7.3933  -5.3308   13.799   1.7596   8.7562   17.543   8.1098   16.579   7.1210 0.9639683 10.79244 
1 1 1   31   22   13 f   39.415   5.7146   38.328   8.3296   38.580   15.443   38.224   9.8918   37.709   9.8292   41.121   5.8324 -3.411995 11.42929 
1 1 1   31   22   14 o   30.664   5.9505   25.091   7.7937   20.070   13.089   27.849   9.7010   27.488   9.4962   33.840   7.1733 -6.352177 11.90101 
1 1 1   31   22   15 o   38.030   5.1610   32.005   7.7113   50.339   13.112   22.311   9.5344   46.249   6.8740   29.811   7.7002 16.43791 10.32204 
1 1 1   31   22   16 o   49.948   4.6146   58.109   9.3809   57.696   14.376   58.415   12.380   49.298   7.0701   50.598   5.9324 -1.299576 9.229298 
1 1 1   31   23    0 o   53.509   3.3993   62.053   10.413   62.053   10.413   62.053   10.413   53.509   4.8073   53.509   4.8073 0.000000 0.000000 
1 1 1   31   23    1 o   82.933   2.6582  146.693   9.0921  146.467   12.904  146.915   12.813   82.857   3.7760   83.008   3.7424 -0.1511688 5.316363 
1 1 1   31   23    2 o   58.847   3.4146   76.550   8.1456   65.937   12.050   85.478   11.053   54.682   5.3431   63.013   4.2530 -8.330421 6.829109 
1 1 1   31   23    3 o   27.910   5.8815   19.022   7.6623   26.799   10.966   11.602   10.711   32.923   8.1251   22.897   8.5058 10.02515 11.76294 
1 1 1   31   23    4 o   35.320   5.4873   30.281   7.7507   29.547   10.490   31.163   11.503   35.019   7.4893   35.621   8.0221 -0.6027565 10.97467 
1 1 1   31   23    5 o   18.873   5.5085   4.3020   7.1890   8.4725   9.6423  -0.9180   10.787   20.700   7.9825   17.046   7.5929 3.654490 11.01695 
1 1 1   31   23    6 o   54.247   4.6153   64.690   10.060   79.090   16.679   56.456   12.613   58.487   6.9143   50.007   6.1153 8.480583 9.230588 
1 1 1   31   23    7 o   52.696   4.8315   62.739   10.315   72.308   16.561   56.674   13.184   55.565   7.2261   49.827   6.4154 5.738331 9.662983 
1 1 1   31   23    8 o   58.665   4.3730   75.864   10.227   87.722   17.206   69.386   12.718   61.556   6.7770   55.774   5.5287 5.781570 8.746084 
1 1 1   31   23    9 o   62.639   4.1766   89.401   10.367   85.416   16.873   91.818   13.140   60.677   6.7422   64.601   4.9315 -3.923660 8.353282 
1 1 1   31   23   10 o   53.216   5.0968   71.472   9.8437   50.913   15.817   84.470   12.576   44.518   8.9250   61.913   4.9249 -17.39506 10.19360 
1 1 1   31   23   11 o   23.307   6.2143   11.222   7.6968   18.572   13.744   7.8641   9.2902   26.659   9.6794   19.955   7.7961 6.704174 12.42859 
1 1 1   31   23   12 o   32.614   6.2640   26.007   8.2050   35.252   14.608   21.746   9.9171   35.968   9.6478   29.259   7.9919 6.708761 12.52801 
1 1 1   31   23   13 o   66.491   4.1608  104.157   10.856   82.980   16.853  119.177   14.193   59.342   6.8855   73.639   4.6731 -14.29740 8.321541 
1 1 1   31   23   14 o   40.806   5.6030   42.889   8.9926   32.244   13.691   50.966   11.926   34.514   9.3747   47.099   6.1393 -12.58421 11.20610 
1 1 1   31   24    0 o   33.399   5.7193   28.206   9.6574   28.206   9.6574   28.206   9.6574   33.399   8.0883   33.399   8.0883 0.000000 0.000000 
1 1 1   31   24    1 o   70.294   2.8796  106.473   8.3462  107.218   11.964  105.767   11.649   70.502   4.1143   70.086   4.0299 0.4162979 5.759115 
1 1 1   31   24    2 o   20.515   5.7334   7.8516   7.4146   1.6015   12.225   11.489   9.3259   18.736   8.2255   22.295   7.9893 -3.558308 11.46686 
1 1 1   31   24    3 o   25.227   5.6976   15.074   6.9883   22.282   10.318   8.9650   9.4989   29.688   8.1694   20.767   7.9443 8.921291 11.39515 
1 1 1   31   24    4 o   46.161   4.0907   48.999   7.5805   40.959   11.366   55.442   10.174   42.131   6.5407   50.192   4.9147 -8.061436 8.181406 
1 1 1   31   24    5 o   22.538   5.6931   10.065   7.4143   0.9388   10.308   19.850   10.673   17.257   7.5652   27.819   8.5095 -10.56217 11.38616 
1 1 1   31   24    6 f   25.872   6.4483   17.282   8.6830   12.866   14.306   19.858   10.926   24.012   9.5826   27.731   8.6310 -3.719105 12.89652 
1 1 1   31   24    7 o   28.369   6.6885   21.148   8.9393   23.085   14.900   20.060   11.173   28.969   10.125   27.769   8.7423 1.199284 13.37700 
1 1 1   31   24    8 o   34.137   5.9484   31.185   8.1042   25.084   15.207   33.605   9.5777   29.923   10.241   38.351   6.0551 -8.427641 11.89681 
1 1 1   31   24    9 o   37.111   5.8248   37.752   8.2168   27.236   15.370   41.960   9.7226   30.991   10.295   43.232   5.4528 -12.24102 11.64952 
1 1 1   31   24   10 o   34.226   5.7615   33.612   8.4167   17.131   15.011   41.169   10.165   25.867   9.9643   42.584   5.7873 -16.71675 11.52303 
1 1 1   31   24   11 o   66.122   3.9805  101.186   10.018   91.190   17.292  106.237   12.290   62.368   6.7224   69.877   4.2645 -7.508415 7.960926 
1 1 1   31   25    0 o   9.3350   4.5507  -5.1216   8.2486  -5.1216   8.2486  -5.1216   8.2486   9.3350   6.4356   9.3350   6.4356 0.000000 0.000000 
1 1 1   31   25    1 o   24.622   5.4444   14.839   6.3862   20.069   9.0823   9.7253   8.9814   28.317   7.6123   20.926   7.7858 7.390886 10.88875 
1 1 1   31   25    2 o   42.684   4.1900   41.159   7.3331   44.711   11.125   38.430   9.7514   44.174   6.1061   41.195   5.7393 2.979553 8.379967 
1 1 1   31   25    3 f   37.430   4.8032   32.473   7.1590   42.919   10.955   24.687   9.4581   43.246   6.1416   31.614   7.3868 11.63276 9.606465 
1 1 1   31   25    4 o   31.692   5.4783   24.944   7.0395   27.340   10.829   23.191   9.2640   32.799   8.0621   30.585   7.4197 2.214029 10.95666 
1 1 1   31   25    5 o   37.349   5.6273   42.265   8.4237   17.131   15.525   52.753   10.028   25.914   10.091   48.785   4.9840 -22.87148 11.25456 
1 1 1   31   25    6 o   56.609   4.5125   77.638   9.2502   64.878   16.774   83.214   11.089   51.440   7.9065   61.779   4.3518 -10.33986 9.025013 
1 1 1   31   25    7 o   25.090   6.4060   14.308   7.7470   21.696   14.922   11.582   9.0642   28.070   10.101   22.111   7.8815 5.958849 12.81207 
1 1 1   32    0    0 o  119.008   3.2336  294.664   22.371  294.664   22.371  294.664   22.371  119.008   4.5730  119.008   4.5730 0.000000 0.000000 
1 1 1   32    0    1 o   12.661   5.5391   2.6380   8.0960   2.6380   8.0960   2.6380   8.0960   12.661   7.8334   12.661   7.8334 0.000000 0.000000 
1 1 1   32    0    2 o   92.054   2.4331  176.372   13.023  176.372   13.023  176.372   13.023   92.054   3.4410   92.054   3.4410 0.000000 0.000000 
1 1 1   32    0    3 o   15.175   6.0640   6.5847   8.2361   6.5847   8.2361   6.5847   8.2361   15.175   8.5757   15.175   8.5757 0.000000 0.000000 
1 1 1   32    0    4 o   92.468   2.4546  178.009   13.197  178.009   13.197  178.009   13.197   92.468   3.4714   92.468   3.4714 0.000000 0.000000 
1 1 1   32    0    5 o   51.878   3.3497   57.422   9.9417   57.422   9.9417   57.422   9.9417   51.878   4.7372   51.878   4.7372 0.000000 0.000000 
1 1 1   32    0    6 o   82.312   2.5243  141.346   12.068  141.346   12.068  141.346   12.068   82.312   3.5699   82.312   3.5699 0.000000 0.000000 
1 1 1   32    0    7 o   25.730   6.4386   18.422   8.7885   18.422   8.7885   18.422   8.7885   25.730   9.1056   25.730   9.1056 0.000000 0.000000 
1 1 1   32    0    8 o   15.411   6.1657   6.8521   8.5285   6.8521   8.5285   6.8521   8.5285   15.411   8.7196   15.411   8.7196 0.000000 0.000000 
1 1 1   32    0    9 o   60.197   3.7321   77.479   12.872   77.479   12.872   77.479   12.872   60.197   5.2780   60.197   5.2780 0.000000 0.000000 
1 1 1   32    0   10 o   12.697   6.1269  -7.4726   14.110  -7.4726   14.110  -7.4726   14.110   12.697   8.6647   12.697   8.6647 0.000000 0.000000 
1 1 1   32    0   11 f   94.248   3.8203  187.745   20.844  187.745   20.844  187.745   20.844   94.248   5.4028   94.248   5.4028 0.000000 0.000000 
1 1 1   32    0   12 o   90.304   2.8516  170.662   14.952  170.662   14.952  170.662   14.952   90.304   4.0328   90.304   4.0328 0.000000 0.000000 
1 1 1   32    0   13 o   10.655   5.0021  -1.8974   8.2617  -1.8974   8.2617  -1.8974   8.2617   10.655   7.0740   10.655   7.0740 0.000000 0.000000 
1 1 1   32    0   14 o  127.775   2.2651  339.379   16.858  339.379   16.858  339.379   16.858  127.775   3.2034  127.775   3.2034 0.000000 0.000000 
1 1 1   32    0   15 o   65.491   2.9404   90.431   11.128   90.431   11.128   90.431   11.128   65.491   4.1583   65.491   4.1583 0.000000 0.000000 
1 1 1   32    0   16 o  112.786   2.3191  264.823   15.227  264.823   15.227  264.823   15.227  112.786   3.2797  112.786   3.2797 0.000000 0.000000 
1 1 1   32    0   17 o   10.986   5.1328  -1.4140   8.5324  -1.4140   8.5324  -1.4140   8.5324   10.986   7.2589   10.986   7.2589 0.000000 0.000000 
1 1 1   32    0   18 o   65.226   2.8514   89.781   10.753   89.781   10.753   89.781   10.753   65.226   4.0325   65.226   4.0325 0.000000 0.000000 
1 1 1   32    0   19 o  108.949   2.3734  247.607   15.050  247.607   15.050  247.607   15.050  108.949   3.3565  108.949   3.3565 0.000000 0.000000 
1 1 1   32    0   20 o   13.165   6.0766  -0.1149   11.421  -0.1149   11.421  -0.1149   11.421   13.165   8.5936   13.165   8.5936 0.000000 0.000000 
1 1 1   32    0   21 o   68.263   4.5826  102.164   17.869  102.164   17.869  102.164   17.869   68.263   6.4807   68.263   6.4807 0.000000 0.000000 
1 1 1   32    0   22 o   20.087   8.5529   11.922   18.186   11.922   18.186   11.922   18.186   20.087   12.096   20.087   12.096 0.000000 0.000000 
1 1 1   32    0   23 o   26.510   9.6134   25.343   18.882   25.343   18.882   25.343   18.882   26.510   13.595   26.510   13.595 0.000000 0.000000 
1 1 1   32    0   25 o   9.4285   4.8984 -46.8213   18.293 -46.8213   18.293 -46.8213   18.293   9.4285   6.9274   9.4285   6.9274 0.000000 0.000000 
1 1 1   32    1    0 o   86.949   2.4938  157.504   12.600  157.504   12.600  157.504   12.600   86.949   3.5267   86.949   3.5267 0.000000 0.000000 
1 1 1   32    1    1 o  121.865   2.2492  308.869   11.304  302.455   15.867  315.480   16.108  120.577   3.1905  123.153   3.1712 -2.575371 4.498415 
1 1 1   32    1    2 o  125.864   2.2590  329.589   11.725  321.714   16.545  337.532   16.617  124.342   3.2262  127.385   3.1628 -3.042374 4.517951 
1 1 1   32    1    3 o  118.623   2.2684  292.792   11.098  293.956   15.746  291.643   15.645  118.856   3.2120  118.391   3.2040 0.4658356 4.536759 
1 1 1   32    1    4 o  134.333   2.2433  375.418   12.428  369.106   17.470  381.886   17.684  133.187   3.1802  135.479   3.1647 -2.291977 4.486557 
1 1 1   32    1    5 o  125.079   2.2436  325.571   11.571  335.918   16.453  315.444   16.277  127.057   3.1396  123.101   3.2058 3.956352 4.487105 
1 1 1   32    1    6 o   88.094   2.4600  161.686   8.9282  151.365   12.411  172.758   12.854   85.168   3.5331   91.020   3.4239 -5.852272 4.919990 
1 1 1   32    1    7 o  131.483   2.2407  359.867   12.146  375.281   17.384  345.167   16.976  134.244   3.1397  128.722   3.1976 5.522095 4.481329 
1 1 1   32    1    8 o  102.806   2.3537  220.400   9.9791  216.363   14.029  224.535   14.197  101.850   3.3397  103.763   3.3174 -1.913246 4.707354 
1 1 1   32    1    9 o   74.714   3.7793  117.774   11.291  121.619   18.485  115.486   14.260   75.427   5.9419   74.001   4.6720 1.425972 7.558683 
1 1 1   32    1   10 o   56.931   4.9814   70.260   11.695   68.728   16.421   71.837   16.660   56.290   7.0731   57.572   7.0163 -1.281712 9.962812 
1 1 1   32    1   11 o   77.395   4.2960  128.336   13.709  127.761   19.605  128.887   19.177   77.185   6.1583   77.604   5.9915 -0.4191895 8.591998 
1 1 1   32    1   12 o   56.973   3.4680   70.177   7.9430   77.789   10.532   60.134   12.097   60.831   4.1976   53.116   5.5216 7.714310 6.936022 
1 1 1   32    1   13 o   30.046   5.1403   20.506   6.3079   19.067   8.9821   21.907   8.8605   28.948   7.4722   31.143   7.0609 -2.194733 10.28055 
1 1 1   32    1   14 o   85.078   2.5500  151.585   8.9475  149.360   12.628  153.829   12.680   84.444   3.6257   85.712   3.5868 -1.267937 5.100048 
1 1 1   32    1   15 o   51.181   3.4165   55.692   7.1498   64.926   10.235   46.893   9.9916   55.435   4.4766   46.927   5.1623 8.508167 6.832979 
1 1 1   32    1   16 o   55.421   3.7921   67.463   8.2581   72.566   10.484   59.122   13.404   58.604   4.3374   52.239   6.2214 6.365147 7.584145 
1 1 1   32    1   17 o   23.036   5.4324   11.106   6.2474   15.692   8.9743   6.7940   8.7024   26.174   7.7586   19.897   7.6058 6.276749 10.86477 
1 1 1   32    1   18 o   75.400   2.6790  119.844   8.3239  124.542   11.712  115.049   11.833   76.935   3.6909   73.866   3.8840 3.068985 5.358007 
1 1 1   32    1   19 o   33.116   4.7560   24.530   6.3846   19.966   8.7901   29.626   9.2889   29.383   7.2885   36.849   6.1119 -7.465544 9.511927 
1 1 1   32    1   20 o   37.631   6.3782   35.110   9.5895   37.989   11.991   30.003   15.973   40.639   7.4277   34.623   10.371 6.016640 12.75632 
1 1 1   32    1   21 o   42.872   6.8368   47.486   12.483   64.522   16.924   27.164   18.485   53.137   7.7223   32.608   11.284 20.52983 13.67355 
1 1 1   32    1   22 o   36.336   9.8193   34.626   17.169   33.731   18.521   40.097   45.774   35.654   11.259   37.018   16.091 -1.364010 19.63866 
1 1 1   32    1   23 o   28.152   7.7613   17.469   13.041   20.700   18.691   14.403   18.204   29.478   11.176   26.825   10.773 2.652962 15.52261 
1 1 1   32    1   24 f   55.296   6.6154   74.851   14.713   81.934   21.037   68.069   20.585   58.647   8.6971   51.946   9.9707 6.700779 13.23076 
1 1 1   32    1   25 o   28.296   7.9090   17.243   14.314   29.423   20.395   5.4221   20.093   32.614   11.799   23.978   10.536 8.635921 15.81808 
1 1 1   32    2    0 o   24.636   6.5348   17.271   8.7693   17.271   8.7693   17.271   8.7693   24.636   9.2416   24.636   9.2416 0.000000 0.000000 
1 1 1   32    2    1 o  110.361   2.2951  253.473   10.447  251.612   14.782  255.328   14.765  109.952   3.2597  110.770   3.2318 -0.8175659 4.590232 
1 1 1   32    2    2 o   52.180   3.2627   57.198   7.0207   56.897   9.9980   57.490   9.8611   52.035   4.6585   52.324   4.5694 -0.2892075 6.525418 
1 1 1   32    2    3 o   43.847   3.6936   40.979   6.5865   33.438   9.3437   48.426   9.2860   39.700   5.7065   47.994   4.6911 -8.294064 7.387179 
1 1 1   32    2    4 o  112.907   2.2897  265.373   10.662  269.145   15.124  261.647   15.033  113.709   3.2249  112.106   3.2512 1.603569 4.579345 
1 1 1   32    2    5 o   63.032   2.9329   83.574   7.5520   69.836   10.589   97.796   10.774   57.663   4.4523   68.401   3.8189 -10.73756 5.865800 
1 1 1   32    2    6 o   69.703   2.7625  101.510   7.9225   92.030   10.984  111.791   11.438   66.287   4.0174   73.119   3.7929 -6.832092 5.525001 
1 1 1   32    2    7 o   72.560   2.7154  110.040   8.1029   98.989   11.248  121.959   11.682   68.742   3.9674   76.377   3.7085 -7.634735 5.430760 
1 1 1   32    2    8 o  108.950   2.3300  247.489   10.466  237.893   14.703  257.345   14.901  106.794   3.3380  111.106   3.2517 -4.312538 4.660040 
1 1 1   32    2    9 o   87.818   3.5230  165.044   12.242  155.872   20.065  170.483   15.452   85.517   5.6889   90.120   4.1571 -4.602203 7.045906 
1 1 1   32    2   10 o   72.624   3.9912  112.491   11.368  111.885   19.256  112.816   14.084   72.107   6.4746   73.141   4.6688 -1.034653 7.982381 
1 1 1   32    2   11 o   73.462   3.7426  107.827   10.844   93.063   13.200  138.486   19.021   66.364   4.8226   80.560   5.7247 -14.19612 7.485279 
1 1 1   32    2   12 o   80.210   2.8854  136.952   9.3865  148.247   12.544  122.579   14.150   84.177   3.6131   76.243   4.4997 7.933868 5.770729 
1 1 1   32    2   13 o   69.326   2.8093  100.856   8.0214   93.669   11.182  108.474   11.513   66.756   4.0613   71.897   3.8826 -5.140671 5.618563 
1 1 1   32    2   14 f   70.717   2.7611  104.893   8.0189   92.316   11.124  118.502   11.570   66.253   4.0707   75.181   3.7314 -8.927612 5.522153 
1 1 1   32    2   15 o   62.621   2.9420   82.543   7.5867   76.472   10.592   88.939   10.872   60.225   4.2644   65.018   4.0541 -4.792542 5.883924 
1 1 1   32    2   16 o   16.375   4.9162   1.0634   5.7760   0.7287   7.9727   1.4332   8.3795   16.023   6.8361   16.727   7.0671 -0.7044392 9.832370 
1 1 1   32    2   17 o   16.180   4.9128   0.4751   5.8959   1.1669   8.2157  -0.2596   8.4659   16.408   6.9684   15.952   6.9269 0.4556274 9.825508 
1 1 1   32    2   18 o   17.866   5.1508   2.5383   6.3794   7.7377   8.4187  -4.4730   9.7762   20.298   7.5408   15.433   7.0184 4.865003 10.30154 
1 1 1   32    2   19 o   11.265   3.8589 -13.2576   5.6388  -7.6920   7.8234 -19.2747   8.1346   12.459   5.8719   10.071   5.0084 2.388395 7.717720 
1 1 1   32    2   20 o   29.362   6.0166   20.742   7.7629   17.546   11.898   23.111   10.244   27.411   9.0549   31.312   7.9251 -3.900822 12.03321 
1 1 1   32    2   21 o   42.299   7.3654   45.537   12.687   45.054   16.841   46.172   19.291   42.498   9.8074   42.100   10.991 0.3979988 14.73081 
1 1 1   32    2   22 o   53.595   6.7968   69.191   14.618   81.809   22.259   59.622   19.384   58.394   9.2424   48.797   9.9682 9.596874 13.59360 
1 1 1   32    2   23 o   31.202   7.6191   23.339   13.649   2.9947   20.787   38.756   18.096   24.039   10.633   38.365   10.915 -14.32519 15.23810 
1 1 1   32    2   24 o   69.958   8.1875  114.919   23.624  114.919   23.624   0.0000   0.0000   69.958   8.1875  ?   ?       ?      ? 
1 1 1   32    2   25 o   43.225   9.2015   65.094   20.404   26.795   43.011   76.215   23.178   32.868   14.857   53.582   10.860 -20.71392 18.40290 
1 1 1   32    2   26 o   25.193   10.826   10.050   20.257   0.0000   0.0000   10.050   20.257  ?   ?    25.193   10.826      ?      ? 
1 1 1   32    3    0 o  108.244   2.3157  243.425   14.590  243.425   14.590  243.425   14.590  108.244   3.2749  108.244   3.2749 0.000000 0.000000 
1 1 1   32    3    1 o   62.722   2.8957   82.444   7.4712   75.362   10.538   89.601   10.594   59.973   4.2604   65.472   3.9231 -5.498981 5.791485 
1 1 1   32    3    2 o   56.256   3.1161   66.390   7.2293   66.648   10.309   66.141   10.141   56.358   4.4350   56.155   4.3784 0.2024574 6.232113 
1 1 1   32    3    3 o   29.509   5.1000   19.477   6.1966   16.048   8.6591   23.076   8.8714   26.812   7.5237   32.206   6.8872 -5.393984 10.19997 
1 1 1   32    3    4 o   83.237   2.5334  144.575   8.6972  145.227   12.329  143.928   12.270   83.423   3.5833   83.050   3.5822 0.3736343 5.066780 
1 1 1   32    3    5 o   30.875   4.7620   21.285   6.2032   31.813   8.8399   11.072   8.7068   38.712   5.5365   23.038   7.7494 15.67386 9.523978 
1 1 1   32    3    6 o   25.690   5.3519   14.686   6.1131   12.171   8.7646   17.068   8.5306   23.828   7.7670   27.551   7.3652 -3.722906 10.70387 
1 1 1   32    3    7 o   25.881   5.2712   14.532   6.2070   8.6229   8.5964   20.968   8.9717   21.251   7.6643   30.510   7.2387 -9.259108 10.54231 
1 1 1   32    3    8 f   57.564   3.4674   70.064   8.0895   69.871   12.650   70.198   10.522   57.365   5.3465   57.763   4.4167 -0.3984528 6.934845 
1 1 1   32    3    9 f   45.916   5.4919   45.398   9.8608   52.476   16.426   41.410   12.330   48.064   8.6020   43.768   6.8301 4.296501 10.98388 
1 1 1   32    3   10 f   72.610   3.8701  112.612   11.286  109.817   17.996  114.423   14.490   71.600   6.0940   73.619   4.7721 -2.018890 7.740152 
1 1 1   32    3   11 o   86.210   3.2956  154.101   10.715  150.154   12.722  163.734   19.873   84.728   3.6406   87.693   5.4945 -2.964775 6.591215 
1 1 1   32    3   12 o   83.414   2.7989  146.678   9.5266  150.911   12.698  141.227   14.409   84.914   3.6257   81.914   4.2649 3.000183 5.597760 
1 1 1   32    3   13 o   66.553   3.0796   92.869   8.3834   89.558   11.082   97.298   12.818   65.251   4.1179   67.855   4.5801 -2.603912 6.159120 
1 1 1   32    3   14 o   83.680   2.7439  147.326   9.4056  149.895   12.656  144.157   14.057   84.590   3.6274   82.770   4.1178 1.820450 5.487708 
1 1 1   32    3   15 o   48.548   3.5761   50.211   7.1509   48.610   10.267   51.718   9.9655   47.749   5.2133   49.347   4.8964 -1.598072 7.152150 
1 1 1   32    3   16 o   38.624   4.3077   33.191   6.5294   41.161   9.2232   25.183   9.2449   43.911   5.0926   33.336   6.9491 10.57485 8.615368 
1 1 1   32    3   17 o   29.639   5.1628   20.213   6.2752   21.531   8.9329   18.930   8.8171   30.627   7.1940   28.650   7.4072 1.977697 10.32567 
1 1 1   32    3   18 o   32.126   4.8107   23.449   6.3070   17.681   8.9591   29.116   8.8802   27.622   7.6174   36.631   5.8778 -9.008383 9.621468 
1 1 1   32    3   19 o   65.888   3.2283   90.407   8.4812  100.491   14.200   84.814   10.575   68.457   5.0292   63.319   4.0492 5.138191 6.456643 
1 1 1   32    3   20 o   39.130   5.4262   35.619   8.4719   32.363   12.863   38.114   11.259   36.754   8.6327   41.506   6.5767 -4.752159 10.85246 
1 1 1   32    3   21 o   43.687   6.9227   47.491   12.104   46.530   16.208   48.703   18.200   43.540   9.3077   43.833   10.250 -0.2929611 13.84545 
1 1 1   32    3   22 o   19.771   6.3647  -5.9417   11.329 -11.9589   14.888   2.3347   17.460   17.132   8.0821   22.410   9.8345 -5.277603 12.72939 
1 1 1   32    3   23 o   32.345   7.7500   25.409   13.012   39.695   19.164   13.188   17.724   38.498   11.318   26.192   10.591 12.30645 15.50009 
1 1 1   32    3   24 o  104.551   4.4619  244.264   19.240  241.332   27.170  247.213   27.248  103.882   6.3414  105.220   6.2788 -1.338646 8.923899 
1 1 1   32    3   25 o   64.754   9.6063  153.214   24.551   79.900   49.100  177.654   28.349   42.770   17.502   86.737   7.9243 -43.96692 19.21259 
1 1 1   32    3   26 o   96.795   8.0116  223.022   31.984   0.0000   0.0000  223.022   31.984  ?   ?    96.795   8.0116      ?      ? 
1 1 1   32    4    0 o   8.6841   4.2848  -7.3845   7.9054  -7.3845   7.9054  -7.3845   7.9054   8.6841   6.0596   8.6841   6.0596 0.000000 0.000000 
1 1 1   32    4    1 o   71.023   2.7129  105.421   7.9470  105.631   11.272  105.213   11.206   71.092   3.8442   70.955   3.8291 0.1372147 5.425896 
1 1 1   32    4    2 o  106.842   2.3396  237.772   10.308  243.257   14.638  232.375   14.520  108.073   3.2839  105.612   3.3333 2.460556 4.679187 
1 1 1   32    4    3 o   50.956   3.3679   54.858   7.0379   61.658   9.9766   48.122   9.9297   54.174   4.4651   47.738   5.0432 6.435524 6.735755 
1 1 1   32    4    4 o   47.390   3.4969   47.447   6.8248   50.383   9.6545   44.513   9.6489   48.891   4.7878   45.889   5.0981 3.002441 6.993774 
1 1 1   32    4    5 o   64.995   2.8725   88.471   7.6972   85.656   10.715   91.472   11.064   63.928   4.0640   66.063   4.0606 -2.135490 5.744932 
1 1 1   32    4    6 o   74.142   3.0367  117.752   9.0607  102.562   13.857  129.096   11.975   69.706   4.8200   78.578   3.6950 -8.872505 6.073314 
1 1 1   32    4    7 o   94.108   2.4328  184.805   9.4393  177.965   13.227  191.903   13.475   92.323   3.4737   95.893   3.4069 -3.569641 4.865575 
1 1 1   32    4    8 o   54.535   3.5706   64.271   7.8254   55.421   11.959   70.898   10.349   50.994   5.6859   58.075   4.3205 -7.081062 7.141145 
1 1 1   32    4    9 o   86.537   3.9412  158.842   14.027  143.127   19.274  176.539   20.453   81.939   5.7030   91.135   5.4414 -9.196190 7.882497 
1 1 1   32    4   10 o   69.252   4.5656  104.003   12.914   89.335   18.458  118.067   18.074   64.191   6.9718   74.314   5.8969 -10.12232 9.131266 
1 1 1   32    4   11 o   85.765   3.0326  155.528   10.647  162.384   14.416  147.299   15.793   87.976   3.9729   83.554   4.5828 4.421295 6.065190 
1 1 1   32    4   12 o   37.493   4.7427   30.454   7.1212   25.134   9.4902   37.309   10.773   33.389   7.1094   41.597   6.2794 -8.207996 9.485462 
1 1 1   32    4   13 f   33.766   5.1852   25.732   7.0008   24.020   9.5232   27.746   10.327   32.544   7.2774   34.988   7.3880 -2.444088 10.37031 
1 1 1   32    4   14 o   45.168   3.6492   43.508   6.7326   51.301   9.6728   36.185   9.3768   49.203   4.7665   41.133   5.5271 8.069530 7.298479 
1 1 1   32    4   15 o   61.952   2.9552   80.922   7.5491   81.200   10.563   80.631   10.793   62.079   4.1254   61.826   4.2327 0.2523918 5.910499 
1 1 1   32    4   16 o   50.731   3.3495   54.729   7.0052   54.744   10.056   54.715   9.7645   50.715   4.8075   50.747   4.6652 -0.3269958E-01 6.698946 
1 1 1   32    4   17 o   30.436   5.1775   21.307   6.4340   23.783   9.2446   18.980   8.9601   32.221   7.1437   28.650   7.4962 3.571329 10.35499 
1 1 1   32    4   18 o   44.486   3.6227   42.445   6.6450   41.115   9.3448   43.805   9.4510   43.763   5.1772   45.209   5.0686 -1.446232 7.245319 
1 1 1   32    4   19 o   75.761   3.2066  124.902   9.5999  111.750   15.505  133.078   12.225   72.067   5.2166   79.455   3.7304 -7.388077 6.413135 
1 1 1   32    4   20 o   81.429   3.3095  141.247   11.068  124.429   15.151  160.494   16.208   76.163   4.8232   86.695   4.5329 -10.53209 6.618944 
1 1 1   32    4   21 o   18.381   6.0600 -13.1398   11.373 -23.6714   15.211   0.2112   17.126   15.129   7.3910   21.633   9.6055 -6.503556 12.11994 
1 1 1   32    4   22 o   72.487   4.9792  118.581   14.885  120.879   21.203  116.347   20.901   73.195   7.0233   71.778   7.0600 1.417534 9.958457 
1 1 1   32    4   23 o   37.548   7.3911   37.351   13.704   13.264   20.162   58.035   18.683   26.874   11.129   48.221   9.7294 -21.34724 14.78223 
1 1 1   32    4   24 o   24.382   7.4149   3.5682   14.084  -9.9408   19.224   19.219   20.692   19.978   9.3486   28.786   11.512 -8.807564 14.82982 
1 1 1   32    4   25 o   45.003   9.8671   72.244   21.991   47.071   46.122   79.651   25.018   36.262   15.947   53.744   11.624 -17.48146 19.73410 
1 1 1   32    4   26 o   31.123   12.202   26.736   22.817   0.0000   0.0000   26.736   22.817  ?   ?    31.123   12.202      ?      ? 
1 1 1   32    5    0 o  134.226   2.2275  373.916   17.418  373.916   17.418  373.916   17.418  134.226   3.1502  134.226   3.1502 0.000000 0.000000 
1 1 1   32    5    1 o   76.537   2.6370  122.409   8.3227  125.862   11.825  119.020   11.716   77.616   3.6939   75.458   3.7644 2.158051 5.274041 
1 1 1   32    5    2 o   92.927   2.4626  180.179   9.4304  190.133   13.425  170.484   13.250   95.484   3.4090   90.371   3.5547 5.112221 4.925204 
1 1 1   32    5    3 o  141.956   2.2333  419.521   13.074  412.929   18.280  426.424   18.706  140.820   3.1473  143.093   3.1695 -2.272781 4.466678 
1 1 1   32    5    4 o   44.503   3.6569   41.845   6.7001   40.490   9.1501   43.412   9.8379   43.750   5.0709   45.256   5.2706 -1.505856 7.313884 
1 1 1   32    5    5 o  122.465   2.4662  310.145   12.278  296.465   15.913  330.265   19.299  119.265   3.2350  125.665   3.7235 -6.399979 4.932484 
1 1 1   32    5    6 o   46.190   3.8528   45.842   7.2524   39.709   10.557   51.323   9.9806   43.103   5.9382   49.277   4.9108 -6.174442 7.705686 
1 1 1   32    5    7 o   50.927   4.2180   58.439   8.2244   45.789   13.526   65.859   10.359   45.923   7.1414   55.931   4.4907 -10.00729 8.435971 
1 1 1   32    5    8 f   49.670   4.5744   51.447   8.6074   57.328   15.979   49.043   10.216   51.229   7.5626   48.111   5.1485 3.118919 9.148818 
1 1 1   32    5    9 o   25.996   6.4146   14.211   8.8520   4.7469   15.036   19.232   10.951   22.907   9.5585   29.086   8.5569 -6.178442 12.82912 
1 1 1   32    5   10 o  159.973   2.6927  535.956   17.764  524.940   24.962  547.260   25.287  158.298   3.8233  161.648   3.7928 -3.350281 5.385406 
1 1 1   32    5   11 o   20.601   5.6621   6.5934   6.8000   6.1639   8.8030   7.2288   10.708   19.734   7.6224   21.468   8.3747 -1.734280 11.32416 
1 1 1   32    5   12 o   62.845   3.2844   85.193   8.3309   97.017   11.270   70.949   12.370   67.945   4.0217   57.745   5.1938 10.20026 6.568805 
1 1 1   32    5   13 o   32.680   5.1196   23.995   6.7101   21.078   9.0712   27.519   9.9718   30.442   7.3157   34.919   7.1641 -4.477470 10.23930 
1 1 1   32    5   14 o   54.769   3.4461   63.639   7.7167   63.386   10.257   63.970   11.714   54.746   4.5426   54.792   5.1834 -0.4586792E-01 6.892163 
1 1 1   32    5   15 o   50.244   3.3898   53.712   7.0149   51.049   9.9861   56.306   9.8563   48.965   4.9447   51.522   4.6382 -2.557102 6.779653 
1 1 1   32    5   16 o   52.034   3.3133   57.536   7.1028   53.882   9.8977   61.415   10.199   50.303   4.7706   53.764   4.5993 -3.461006 6.626584 
1 1 1   32    5   17 o  126.473   2.3007  335.018   11.999  343.513   17.083  326.746   16.857  128.066   3.2342  124.879   3.2729 3.187614 4.601322 
1 1 1   32    5   18 o   21.808   5.0326   8.9393   5.9387   0.3197   8.4260   17.448   8.3715   16.135   6.9584   27.481   7.2726 -11.34574 10.06529 
1 1 1   32    5   19 o   91.237   2.8380  174.524   10.274  182.245   17.182  170.227   12.819   92.490   4.5042   89.984   3.4540 2.506187 5.676088 
1 1 1   32    5   20 o   53.479   6.5345   69.344   13.842   81.353   19.306   56.641   19.856   59.601   7.8536   47.357   10.446 12.24355 13.06904 
1 1 1   32    5   21 o   60.375   5.3721   83.196   13.315   80.696   17.895   86.297   19.930   59.609   7.2786   61.142   7.9033 -1.532898 10.74428 
1 1 1   32    5   22 o   53.392   6.2572   68.494   13.223   70.844   17.502   65.368   20.182   55.590   7.6335   51.195   9.9165 4.395561 12.51430 
1 1 1   32    5   23 o   21.255   6.5606  -2.2836   11.852 -18.9212   17.397   12.126   16.190   17.299   8.3186   25.211   10.147 -7.911917 13.12128 
1 1 1   32    5   24 o   44.727   9.8684   63.779   19.537   61.092   41.220   64.557   22.187   40.509   16.231   48.945   11.229 -8.436459 19.73683 
1 1 1   32    5   25 o   35.485   9.7787   39.694   19.756   31.757   45.977   41.492   21.879   33.489   15.226   37.481   12.274 -3.992493 19.55741 
1 1 1   32    5   26 o   50.656   11.540   71.605   23.571   0.0000   0.0000   71.605   23.571  ?   ?    50.656   11.540      ?      ? 
1 1 1   32    6    0 o   23.580   7.3586   17.180   10.633   17.180   10.633   17.180   10.633   23.580   10.407   23.580   10.407 0.000000 0.000000 
1 1 1   32    6    1 o   17.889   5.3336   1.1242   6.6969  -1.1385   8.8340   4.1817   10.269   16.068   7.0247   19.709   8.0277 -3.641525 10.66723 
1 1 1   32    6    2 o   85.098   2.6793  150.434   9.3393  160.396   14.226  142.888   12.381   87.507   3.9416   82.690   3.6302 4.816505 5.358606 
1 1 1   32    6    3 o   87.633   2.5268  160.562   9.1177  149.569   12.861  171.670   12.928   84.578   3.6868   90.687   3.4564 -6.108902 5.053645 
1 1 1   32    6    4 o   16.790   4.8841   0.3241   5.9091  -6.6658   8.4495   7.0154   8.2670   13.578   6.3011   20.002   7.4642 -6.424005 9.768249 
1 1 1   32    6    5 o   70.852   2.7433  105.148   8.0112  104.875   11.531  105.402   11.138   70.743   3.9522   70.961   3.8055 -0.2185898 5.486525 
1 1 1   32    6    6 o  120.142   2.5031  302.308   12.256  296.166   18.725  306.912   16.211  118.946   3.8169  121.337   3.2393 -2.390938 5.006229 
1 1 1   32    6    7 o  131.086   2.4853  358.946   13.277  358.577   20.397  359.218   17.489  130.898   3.7780  131.273   3.2302 -0.3745728 4.970624 
1 1 1   32    6    8 o   25.242   6.2729   12.731   8.8217   0.4665   14.742   19.573   11.011   21.163   9.1652   29.321   8.5670 -8.157469 12.54571 
1 1 1   32    6    9 o   75.435   3.2983  120.628   10.192  104.924   14.430  136.258   14.397   70.398   4.9699   80.473   4.3375 -10.07490 6.596518 
1 1 1   32    6   10 o   90.594   2.9706  172.666   11.095  170.860   15.876  174.390   15.512   90.101   4.2721   91.087   4.1289 -0.9867020 5.941239 
1 1 1   32    6   11 o   64.449   3.4012   91.768   8.6199  107.206   11.322   70.478   13.295   71.488   3.8399   57.411   5.6149 14.07626 6.802304 
1 1 1   32    6   12 o   21.941   5.6294   9.1038   6.5267   7.4910   8.6083   11.284   10.010   20.411   7.6168   23.471   8.2912 -3.060009 11.25878 
1 1 1   32    6   13 o   28.869   5.3555   19.585   6.8677   26.978   9.2253   10.394   10.286   34.731   6.6828   23.006   8.3705 11.72444 10.71097 
1 1 1   32    6   14 o   28.205   5.5921   18.346   6.7227   19.041   8.7530   17.346   10.498   28.867   7.3364   27.544   8.4417 1.323082 11.18414 
1 1 1   32    6   15 o   45.559   3.9151   45.219   7.2429   39.681   10.756   49.813   9.7971   42.775   6.0967   48.344   4.9135 -5.568913 7.830249 
1 1 1   32    6   16 o   61.872   3.7457   84.486   9.2363  103.690   12.705   62.962   13.451   69.920   4.4057   53.824   6.0591 16.09572 7.491487 
1 1 1   32    6   17 o   82.412   2.6244  143.138   8.8958  156.250   12.650  130.311   12.512   86.218   3.5574   78.605   3.8593 7.612419 5.248767 
1 1 1   32    6   18 o   79.129   3.0388  131.872   9.5020  136.518   16.003  129.343   11.809   79.886   4.8570   78.373   3.6533 1.512840 6.077576 
1 1 1   32    6   19 o   74.897   3.3948  120.109   10.478  122.272   15.189  118.147   14.472   75.494   4.8782   74.300   4.7225 1.193893 6.789639 
1 1 1   32    6   20 o   34.642   5.9707   28.542   8.3248   31.453   13.190   26.615   10.733   35.832   8.9508   33.453   7.9043 2.379360 11.94130 
1 1 1   32    6   21 f   28.014   7.6303   17.315   12.514   13.425   17.338   21.545   18.079   26.226   10.520   29.802   11.055 -3.576580 15.26050 
1 1 1   32    6   22 o   77.765   4.6792  135.734   14.760  138.153   19.368  132.383   22.795   79.194   5.9297   76.336   7.2401 2.857704 9.358445 
1 1 1   32    6   23 o   29.497   7.2091   15.823   12.863   41.049   18.717  -6.7556   17.708   39.059   11.097   19.934   9.2053 19.12543 14.41814 
1 1 1   32    6   24 o   33.345   8.6355   33.174   18.867 -28.0135   43.874   47.056   20.898   25.920   12.638   40.770   11.771 -14.84933 17.27102 
1 1 1   32    6   25 o   51.677   9.1826   98.390   22.874   43.694   47.324  115.064   26.129   35.391   15.824   67.964   9.3213 -32.57310 18.36513 
1 1 1   32    6   26 o   48.485   11.638   66.554   22.978   0.0000   0.0000   66.554   22.978  ?   ?    48.485   11.638      ?      ? 
1 1 1   32    6   27 o   33.506   12.294   34.899   22.256   0.0000   0.0000   34.899   22.256  ?   ?    33.506   12.294      ?      ? 
1 1 1   32    7    0 o   7.7334   3.9113 -12.2307   8.0861 -12.2307   8.0861 -12.2307   8.0861   7.7334   5.5314   7.7334   5.5314 0.000000 0.000000 
1 1 1   32    7    1 o   40.460   4.0219   34.871   6.7098   35.834   9.6161   33.958   9.3671   41.004   5.6859   39.916   5.6898 1.088615 8.043833 
1 1 1   32    7    2 o   28.506   5.3121   18.390   6.3858   21.371   8.9893   15.354   9.0730   30.801   7.2045   26.211   7.8084 4.590172 10.62430 
1 1 1   32    7    3 o  105.797   2.5273  233.283   10.954  228.867   14.609  238.956   16.556  104.728   3.3822  106.866   3.7562 -2.137489 5.054539 
1 1 1   32    7    4 o   39.697   4.7679   35.266   7.2502   31.798   11.871   37.329   9.1562   37.452   7.9321   41.942   5.2930 -4.490406 9.535880 
1 1 1   32    7    5 o   86.299   3.4759  167.841   10.885  133.860   19.817  182.523   13.026   79.070   6.0766   93.528   3.3769 -14.45793 6.951884 
1 1 1   32    7    6 o   22.869   5.7308   10.294   6.6966   11.583   10.364   9.3705   8.7741   23.912   8.4379   21.827   7.7570 2.085863 11.46163 
1 1 1   32    7    7 o   22.606   5.6429   9.1648   6.6150   15.065   10.406   5.1638   8.5691   26.182   8.4579   19.029   7.4723 7.153196 11.28583 
1 1 1   32    7    8 o   96.060   3.3903  198.065   12.942  182.669   20.856  207.704   16.503   92.630   5.4591   99.489   4.0218 -6.859131 6.780572 
1 1 1   32    7    9 o   77.624   3.1888  126.975   10.192  137.565   14.660  117.068   14.179   80.795   4.3992   74.452   4.6175 6.342781 6.377625 
1 1 1   32    7   10 o   27.782   5.6842   17.835   7.1450   22.684   9.5299   11.609   10.798   31.580   7.4391   23.983   8.5964 7.596405 11.36832 
1 1 1   32    7   11 o   82.642   2.8053  141.522   9.4703  157.568   14.680  130.085   12.394   86.542   4.1128   78.742   3.8163 7.800537 5.610655 
1 1 1   32    7   12 o   44.397   4.1354   41.406   7.4816   36.402   9.7086   48.722   11.739   41.207   5.7124   47.586   5.9813 -6.378689 8.270872 
1 1 1   32    7   13 o   73.824   2.9435  114.264   8.8708  110.924   11.665  118.843   13.660   72.650   3.8931   74.998   4.4160 -2.347626 5.887050 
1 1 1   32    7   14 o  122.908   2.6463  317.381   13.400  315.846   18.501  319.075   19.434  122.647   3.6573  123.169   3.8256 -0.5218430 5.292555 
1 1 1   32    7   15 o   30.849   5.0228   21.848   6.2721   19.487   8.9359   24.140   8.8056   29.065   7.4268   32.634   6.7643 -3.569172 10.04555 
1 1 1   32    7   16 o   35.926   4.5157   28.754   6.5129   30.498   8.9777   26.816   9.4627   37.520   5.8014   34.332   6.9217 3.188530 9.031421 
1 1 1   32    7   17 o   40.803   4.0800   36.038   6.8283   31.241   9.4375   41.308   9.8918   37.861   6.0437   43.745   5.4826 -5.883823 8.159986 
1 1 1   32    7   18 o   32.449   5.4473   25.538   7.1808   19.179   12.188   28.919   8.8871   28.475   9.1486   36.423   5.9158 -7.948803 10.89468 
1 1 1   32    7   19 o   34.433   5.7970   28.144   8.0953   30.318   11.989   26.321   10.975   35.614   8.3131   33.252   8.0817 2.361488 11.59403 
1 1 1   32    7   20 o   28.916   6.1581   19.135   7.9368   27.048   12.662   14.013   10.186   33.116   9.0242   24.715   8.3817 8.400936 12.31621 
1 1 1   32    7   21 o   54.302   5.0390   66.967   10.391   65.718   18.478   67.544   12.567   52.946   8.4616   55.659   5.4744 -2.713116 10.07808 
1 1 1   32    7   22 o   61.294   5.4123   85.595   13.584   79.105   17.954   94.286   20.776   58.813   7.4014   63.775   7.8987 -4.962006 10.82456 
1 1 1   32    7   23 o   52.854   7.9606   79.441   16.609   57.148   27.467   92.293   20.854   43.074   13.723   62.635   8.0725 -19.56145 15.92120 
1 1 1   32    7   24 o   22.586   7.9612 -32.3698   18.018   7.0959   43.162 -40.6989   19.829   29.654   13.918   15.518   7.7339 14.13634 15.92243 
1 1 1   32    7   25 o   31.947   9.7309   19.015   19.362   59.330   41.873   8.0517   21.837   38.844   16.058   25.049   10.995 13.79518 19.46189 
1 1 1   32    7   26 o   48.587   12.061   68.947   24.058   0.0000   0.0000   68.947   24.058  ?   ?    48.587   12.061      ?      ? 
1 1 1   32    7   27 o   42.320   12.220   55.190   22.521   0.0000   0.0000   55.190   22.521  ?   ?    42.320   12.220      ?      ? 
1 1 1   32    8    0 o   57.293   3.1601   69.600   10.413   69.600   10.413   69.600   10.413   57.293   4.4690   57.293   4.4690 0.000000 0.000000 
1 1 1   32    8    1 o   28.358   5.2276   18.121   6.2472   14.470   8.7730   21.876   8.8981   25.514   7.6958   31.202   7.0770 -5.688011 10.45511 
1 1 1   32    8    2 o  118.320   2.2915  291.824   11.182  288.035   15.754  295.671   15.874  117.542   3.2497  119.097   3.2316 -1.554848 4.582951 
1 1 1   32    8    3 o   20.521   5.3773   7.3249   6.0996   9.8578   8.8390   5.0220   8.4280   22.186   7.7958   18.856   7.4085 3.329599 10.75456 
1 1 1   32    8    4 o   89.923   2.7033  169.056   9.8795  170.718   15.366  167.884   12.899   90.186   4.1310   89.660   3.4881 0.5261765 5.406680 
1 1 1   32    8    5 o   94.316   2.7040  185.755   10.365  189.301   16.152  183.272   13.516   94.962   4.1238   93.669   3.4985 1.292923 5.407915 
1 1 1   32    8    6 o   20.171   5.4702   4.2409   6.6836   12.769   10.435  -1.6909   8.7031   24.660   8.4814   15.682   6.9108 8.978565 10.94040 
1 1 1   32    8    7 o   41.185   5.6387   40.457   9.1198   25.565   13.772   52.089   12.171   33.079   9.5572   49.291   5.9867 -16.21130 11.27746 
1 1 1   32    8    8 o   71.342   3.7235  106.235   10.802   96.719   13.938  120.549   17.094   67.523   5.0047   75.160   5.5144 -7.636993 7.446903 
1 1 1   32    8    9 o   37.069   5.6303   31.507   8.3713   36.811   11.896   26.305   11.782   40.443   7.4047   33.694   8.4836 6.748676 11.26059 
1 1 1   32    8   10 o   55.710   3.9940   67.405   9.0088   54.420   12.961   79.540   12.530   50.209   6.2591   61.211   4.9632 -11.00188 7.988088 
1 1 1   32    8   11 o   37.027   4.5070   30.196   6.6839   28.687   9.8613   31.478   9.0907   35.746   6.9389   38.309   5.7535 -2.562859 9.013966 
1 1 1   32    8   12 o   19.419   5.1948   5.6725   6.0081   0.5640   8.6503   10.434   8.3510   16.567   7.0958   22.270   7.5890 -5.702759 10.38959 
1 1 1   32    8   13 o   77.847   2.8751  127.743   9.1212  127.689   12.015  127.816   14.012   77.960   3.7368   77.735   4.3705 0.2245865 5.750174 
1 1 1   32    8   14 o   57.857   3.4479   71.256   8.1714   70.329   10.909   72.442   12.333   57.535   4.5974   58.180   5.1398 -0.6448936 6.895877 
1 1 1   32    8   15 o   78.613   2.6922  130.007   8.7228  135.873   12.621  124.641   12.070   80.307   3.8103   76.919   3.8045 3.388428 5.384459 
1 1 1   32    8   16 o  101.002   2.4403  214.175   10.162  206.559   14.254  222.048   14.492   99.158   3.4853  102.846   3.4165 -3.687553 4.880589 
1 1 1   32    8   17 o  110.333   2.7352  261.590   12.165  230.276   18.577  285.100   16.096  104.126   4.3255  116.540   3.3487 -12.41369 5.470312 
1 1 1   32    8   18 o  110.274   2.7613  257.511   12.267  256.471   19.517  258.190   15.772  109.782   4.3105  110.765   3.4523 -0.9829254 5.522560 
1 1 1   32    8   19 o   64.539   3.7652   91.074   9.9431   82.419   14.473   98.810   13.683   61.365   5.7185   67.713   4.8995 -6.347851 7.530363 
1 1 1   32    8   20 o   25.407   6.3453   14.077   8.1594   18.466   13.045   11.256   10.457   27.769   9.4849   23.046   8.4316 4.722950 12.69070 
1 1 1   32    8   21 o   31.693   6.8200   23.878   9.0062   28.585   17.108   22.073   10.593   33.161   10.854   30.226   8.2613 2.935350 13.63993 
1 1 1   32    8   22 o   65.465   5.1271   96.706   13.737   87.752   18.108  108.848   21.086   62.100   7.0697   68.829   7.4276 -6.728943 10.25422 
1 1 1   32    8   23 o   23.474   7.4332  -4.1965   14.864   18.424   23.951 -18.3673   18.957   28.814   12.047   18.134   8.7108 10.68030 14.86646 
1 1 1   32    8   24 o   25.391   8.3607   1.4209   17.863  -1.0126   40.382   2.0129   19.918   27.958   13.226   22.823   10.231 5.134853 16.72149 
1 1 1   32    8   25 o   21.479   7.4384 -18.5006   17.604 -36.9549   41.391 -14.4252   19.451   24.038   11.834   18.919   9.0158 5.118961 14.87685 
1 1 1   32    8   26 o   70.508   9.1264  125.782   26.540   0.0000   0.0000  125.782   26.540  ?   ?    70.508   9.1264      ?      ? 
1 1 1   32    8   27 o   44.222   12.397   61.034   23.522   0.0000   0.0000   61.034   23.522  ?   ?    44.222   12.397      ?      ? 
1 1 1   32    9    0 o   78.492   2.6165  128.807   11.918  128.807   11.918  128.807   11.918   78.492   3.7003   78.492   3.7003 0.000000 0.000000 
1 1 1   32    9    1 o  110.053   2.3317  252.516   10.580  243.383   14.797  262.069   15.134  108.009   3.3216  112.097   3.2733 -4.088364 4.663481 
1 1 1   32    9    2 o   61.164   3.1661   78.804   7.9293   78.691   11.941   78.893   10.605   61.047   4.7426   61.281   4.1958 -0.2337875 6.332242 
1 1 1   32    9    3 o  117.621   2.7357  289.914   13.270  287.555   18.860  292.228   18.675  117.130   3.9039  118.112   3.8335 -0.9818802 5.471395 
1 1 1   32    9    4 o   54.966   3.5071   63.394   7.8809   68.234   12.129   59.858   10.368   56.698   5.1867   53.234   4.7220 3.464279 7.014223 
1 1 1   32    9    5 o   40.516   4.2639   34.757   7.0561   38.527   10.939   32.071   9.2339   42.309   6.2688   38.723   5.7816 3.586079 8.527871 
1 1 1   32    9    6 o   70.379   3.0740  104.705   8.8426  101.441   13.307  107.285   11.833   69.284   4.6569   71.474   4.0139 -2.189964 6.148035 
1 1 1   32    9    7 o  114.585   2.7844  275.621   13.153  286.827   18.720  264.697   18.484  116.913   3.8823  112.257   3.9923 4.656235 5.568706 
1 1 1   32    9    8 o   71.505   3.3836  108.389   9.9436  119.941   14.187   97.233   13.941   75.338   4.5656   67.672   4.9949 7.666191 6.767168 
1 1 1   32    9    9 o  123.007   2.7377  317.389   13.882  302.770   19.365  332.843   19.910  120.074   3.9101  125.940   3.8330 -5.866379 5.475472 
1 1 1   32    9   10 o   95.852   2.6899  188.262   10.467  168.510   13.434  218.790   16.700   89.677   3.6320  102.027   3.9687 -12.35034 5.379743 
1 1 1   32    9   11 o   14.896   4.6629  -3.4622   5.8848   2.1548   8.4703  -8.7033   8.1820   17.193   7.1743   12.599   5.9582 4.594662 9.325836 
1 1 1   32    9   12 o   14.033   4.5208  -4.4268   5.8028  -6.6239   8.4740  -2.4869   7.9625   13.526   6.2883   14.541   6.4968 -1.014747 9.041595 
1 1 1   32    9   13 f   71.382   3.3917  106.445   9.3734  102.601   11.353  114.676   16.614   69.764   3.9456   73.000   5.5180 -3.235771 6.783484 
1 1 1   32    9   14 o   20.919   5.8874   6.5073   7.6649   4.3309   11.187   8.4330   10.523   20.069   8.2986   21.769   8.3535 -1.700047 11.77484 
1 1 1   32    9   15 o   39.034   5.3972   35.530   8.4027   28.524   12.457   41.379   11.382   34.594   8.7305   43.473   6.3479 -8.878700 10.79433 
1 1 1   32    9   16 f   66.255   2.9561   93.180   8.0629   87.634   11.479   98.581   11.327   64.240   4.3326   68.270   4.0229 -4.030525 5.912233 
1 1 1   32    9   17 o   20.545   5.5902   2.4627   6.9237   16.873   12.082  -4.5832   8.4485   26.989   9.1285   14.101   6.4553 12.88873 11.18037 
1 1 1   32    9   18 o   27.804   6.1190   17.952   7.5386   20.935   12.555   16.270   9.4273   29.323   9.2710   26.284   7.9888 3.039145 12.23809 
1 1 1   32    9   19 o   29.554   5.9629   21.814   8.0143   13.435   12.481   27.693   10.454   24.853   9.1919   34.255   7.5983 -9.402107 11.92578 
1 1 1   32    9   20 o   15.365   4.9966  -6.4947   7.5099 -16.8997   12.425  -0.5053   9.4267   14.275   6.9052   16.456   7.2239 -2.181617 9.993263 
1 1 1   32    9   21 o   41.072   6.3945   43.687   9.7324   35.049   18.674   46.908   11.404   36.090   11.292   46.054   6.0036 -9.963955 12.78903 
1 1 1   32    9   22 o   28.146   8.0818   17.455   13.979   16.469   25.667   17.870   16.669   28.749   12.266   27.544   10.527 1.204782 16.16352 
1 1 1   32    9   23 o   51.336   8.2248   73.584   16.936   69.305   25.685   76.876   22.527   48.587   12.682   54.084   10.477 -5.496479 16.44969 
1 1 1   32    9   24 o   28.237   9.1939   2.7903   17.304   46.836   44.734  -4.9596   18.764   35.902   15.749   20.571   9.4912 15.33167 18.38784 
1 1 1   32    9   25 o   26.361   8.7989  -0.3258   18.348   27.969   44.632  -6.0799   20.127   31.949   14.704   20.773   9.6689 11.17561 17.59784 
1 1 1   32    9   26 o   31.609   12.026   30.333   21.691   0.0000   0.0000   30.333   21.691  ?   ?    31.609   12.026      ?      ? 
1 1 1   32    9   27 o   25.541   10.885   14.159   20.173   0.0000   0.0000   14.159   20.173  ?   ?    25.541   10.885      ?      ? 
1 1 1   32   10    0 o   44.368   3.9960   43.194   9.8837   43.194   9.8837   43.194   9.8837   44.368   5.6513   44.368   5.6513 0.000000 0.000000 
1 1 1   32   10    1 o   86.594   2.7637  157.902   9.7419  153.276   14.905  161.353   12.872   85.355   4.2340   87.832   3.5531 -2.477486 5.527319 
1 1 1   32   10    2 o   97.941   2.7602  200.797   11.127  207.797   16.373  194.791   15.167   99.487   3.9902   96.396   3.8149 3.090225 5.520454 
1 1 1   32   10    3 o   53.874   3.7625   62.048   8.2808   59.705   12.453   63.904   11.087   52.828   5.7154   54.919   4.8948 -2.090572 7.524950 
1 1 1   32   10    4 o   45.698   4.0616   45.315   7.4836   41.299   11.550   48.221   9.8251   43.725   6.4044   47.672   4.9970 -3.947121 8.123176 
1 1 1   32   10    5 o   55.500   3.6418   67.626   8.0455   52.965   12.109   79.212   10.765   49.671   5.9109   61.329   4.2558 -11.65760 7.283614 
1 1 1   32   10    6 o   32.366   5.4175   24.742   7.1876   29.723   9.4966   18.062   10.998   36.576   6.5350   28.156   8.6423 8.419428 10.83492 
1 1 1   32   10    7 o   48.064   4.3883   49.565   8.5653   62.106   12.614   38.835   11.668   53.849   5.6795   42.278   6.6912 11.57131 8.776597 
1 1 1   32   10    8 o   52.205   4.1100   58.583   8.8196   57.337   12.925   59.669   12.065   51.590   6.0742   52.820   5.5382 -1.229507 8.219924 
1 1 1   32   10    9 o   72.225   3.0431  109.209   8.9882  104.000   11.850  116.264   13.792   70.292   4.0875   74.158   4.5094 -3.865990 6.086212 
1 1 1   32   10   10 o   52.592   3.6589   58.627   7.8237   56.783   10.174   61.295   12.239   51.719   4.7695   53.465   5.5501 -1.745636 7.317895 
1 1 1   32   10   11 o   45.807   3.6355   44.893   6.8185   51.838   9.7779   38.319   9.5131   49.362   4.8027   42.251   5.4590 7.110645 7.270951 
1 1 1   32   10   12 o   17.908   5.1414   3.6692   5.9724   1.8885   8.6882   5.2645   8.2235   17.157   7.2195   18.660   7.3223 -1.502401 10.28283 
1 1 1   32   10   13 o   52.693   3.6089   58.129   7.7444   47.708   10.169   72.517   11.949   47.148   5.2295   58.237   4.9747 -11.08859 7.217729 
1 1 1   32   10   14 o   78.789   2.9079  130.769   9.3639  127.279   12.367  135.460   14.336   77.680   3.8599   79.897   4.3503 -2.216927 5.815832 
1 1 1   32   10   15 o   50.268   3.8574   55.491   7.8360   61.725   10.532   47.759   11.728   53.759   4.7498   46.776   6.0792 6.982658 7.714750 
1 1 1   32   10   16 o   89.890   2.8310  167.877   10.186  184.299   16.852  158.424   12.786   93.051   4.3911   86.729   3.5743 6.321686 5.661970 
1 1 1   32   10   17 o   89.839   3.0070  171.672   10.973  173.229   17.079  170.577   14.320   89.940   4.6040   89.738   3.8692 0.2019272 6.013916 
1 1 1   32   10   18 o   89.404   3.1673  170.291   11.641  190.564   17.094  152.759   15.897   94.406   4.3902   84.402   4.5666 10.00426 6.334632 
1 1 1   32   10   19 o  126.043   2.8788  336.283   14.926  362.801   22.109  314.076   20.232  130.552   4.1060  121.534   4.0363 9.018806 5.757674 
1 1 1   32   10   20 o   45.317   4.9769   48.094   8.7062   41.067   13.577   53.002   11.346   41.433   8.2354   49.202   5.5909 -7.769527 9.953896 
1 1 1   32   10   21 o   80.241   3.8724  136.673   12.168  156.099   21.298  127.261   14.825   83.689   6.1704   76.792   4.6808 6.896805 7.744889 
1 1 1   32   10   22 f   85.128   5.4606  171.626   18.429  161.686   29.702  177.847   23.499   81.513   8.8347   88.743   6.4202 -7.230461 10.92113 
1 1 1   32   10   23 o   47.265   8.0317   68.379   17.273   35.273   27.555   89.811   22.170   34.007   13.385   60.522   8.8815 -26.51522 16.06337 
1 1 1   32   10   24 o   40.916   8.3459   60.095   19.493  -4.0435   42.512   77.169   21.934   27.655   13.220   54.176   10.190 -26.52132 16.69175 
1 1 1   32   10   25 o   28.711   8.7832   20.504   18.345  -3.2594   44.662   25.327   20.121   27.499   13.250   29.922   11.533 -2.422897 17.56649 
1 1 1   32   10   26 f   15.326   7.5985 -31.7868   18.160   0.0000   0.0000 -31.7868   18.160  ?   ?    15.326   7.5985      ?      ? 
1 1 1   32   10   27 o   74.592   8.5657  140.185   26.352   0.0000   0.0000  140.185   26.352  ?   ?    74.592   8.5657      ?      ? 
1 1 1   32   11    0 o   25.730   7.3953   19.877   10.888   19.877   10.888   19.877   10.888   25.730   10.458   25.730   10.458 0.000000 0.000000 
1 1 1   32   11    1 o   79.895   3.1103  134.609   10.241  127.353   14.345  142.150   14.624   77.668   4.4782   82.123   4.3175 -4.455284 6.220545 
1 1 1   32   11    2 o  104.946   2.8089  231.377   12.148  244.233   17.298  218.869   17.063  107.863   3.8883  102.030   4.0547 5.833000 5.617831 
1 1 1   32   11    3 o   75.914   3.1788  121.706   9.9519  123.905   14.112  119.531   14.037   76.608   4.4662   75.221   4.5245 1.387215 6.357502 
1 1 1   32   11    4 o  102.232   2.8259  218.934   11.859  190.926   16.312  250.331   17.271   95.243   4.1525  109.221   3.8340 -13.97794 5.651778 
1 1 1   32   11    5 f   39.410   4.6363   33.046   7.2718   27.594   9.3723   41.292   11.527   35.134   6.7124   43.685   6.3973 -8.550697 9.272663 
1 1 1   32   11    6 o   85.746   3.0866  155.225   10.908  158.758   15.273  151.546   15.585   86.786   4.2669   84.706   4.4610 2.079193 6.173102 
1 1 1   32   11    7 o   52.369   5.1336   58.018   10.863   72.374   17.656   49.273   13.780   57.293   7.4717   47.445   7.0418 9.847958 10.26713 
1 1 1   32   11    8 o   32.354   6.1118   23.610   8.6278   14.686   11.590   34.704   12.922   25.988   8.9382   38.720   8.3380 -12.73180 12.22351 
1 1 1   32   11    9 o   26.873   5.7738   15.765   6.9508   11.986   9.0129   21.311   10.919   23.520   7.8846   30.226   8.4369 -6.706465 11.54767 
1 1 1   32   11   10 o   19.451   5.3209   6.1581   6.0739   6.0022   8.6165   6.3120   8.5634   19.374   7.5250   19.528   7.5248 -0.1536484 10.64188 
1 1 1   32   11   11 o   52.088   3.3190   57.641   7.1057   64.489   10.277   51.369   9.8357   55.105   4.5217   49.071   4.8597 6.033966 6.638015 
1 1 1   32   11   12 o   19.916   5.2542   6.4177   6.1097   1.1740   8.6388   11.665   8.6420   16.742   7.1287   23.090   7.7208 -6.348848 10.50849 
1 1 1   32   11   13 o   90.967   2.5209  173.878   9.4452  186.651   13.539  161.766   13.183   94.260   3.4825   87.674   3.6457 6.585228 5.041746 
1 1 1   32   11   14 o   69.672   3.0703  102.003   8.7237   96.191   11.385  110.267   13.576   67.406   4.0953   71.938   4.5757 -4.532173 6.140683 
1 1 1   32   11   15 o   47.307   3.9649   47.631   7.6569   40.137   10.089   57.812   11.759   42.967   5.6929   51.647   5.5204 -8.679192 7.929896 
1 1 1   32   11   16 o   67.882   3.4266   98.977   9.2785   99.397   15.161   98.726   11.732   67.641   5.4344   68.124   4.1755 -0.4832993 6.853278 
1 1 1   32   11   17 o   73.023   3.3189  115.782   9.6712  109.332   15.514  119.882   12.368   70.935   5.3028   75.111   3.9925 -4.176147 6.637714 
1 1 1   32   11   18 o   30.220   6.3240   22.654   8.4683   19.472   13.368   24.787   10.945   28.369   9.6018   32.070   8.2326 -3.700195 12.64792 
1 1 1   32   11   19 o   25.228   6.1143   14.761   7.9448   8.9927   12.374   18.807   10.363   22.510   8.9344   27.946   8.3495 -5.435596 12.22860 
1 1 1   32   11   20 o   34.614   6.0539   28.788   8.3626   32.123   13.845   26.872   10.493   35.717   9.3052   33.510   7.7469 2.207184 12.10785 
1 1 1   32   11   21 o   39.242   7.4564   46.091   11.145   25.473   31.638   49.012   11.908   31.709   13.575   46.775   6.1724 -15.06635 14.91270 
1 1 1   32   11   22 o   29.096   8.1918   17.354   14.670   36.176   24.221   6.4499   18.435   34.683   12.809   23.509   10.215 11.17317 16.38365 
1 1 1   32   11   23 o   45.090   7.5583   61.987   17.284   15.617   26.910   94.553   22.551   28.138   12.282   62.043   8.8128 -33.90507 15.11666 
1 1 1   32   11   24 o   65.957   7.7199  121.188   19.401   95.282   29.638  140.611   25.663   55.842   13.095   76.072   8.1792 -20.22995 15.43976 
1 1 1   32   11   25 o   29.398   8.9429   24.024   19.314   4.2872   43.413   28.894   21.566   27.826   13.317   30.971   11.939 -3.144478 17.88589 
1 1 1   32   12    0 o   17.021   6.8209   8.5838   10.460   8.5838   10.460   8.5838   10.460   17.021   9.6463   17.021   9.6463 0.000000 0.000000 
1 1 1   32   12    1 o   85.309   2.9925  153.397   10.525  148.755   14.912  158.004   14.857   83.991   4.3046   86.626   4.1583 -2.635529 5.985045 
1 1 1   32   12    2 o   62.498   3.5210   83.188   9.0369   74.449   12.768   91.960   12.792   59.104   5.2377   65.893   4.7070 -6.789665 7.042005 
1 1 1   32   12    3 o   34.990   5.4130   27.942   7.5978   25.889   10.634   30.082   10.859   33.587   7.8223   36.394   7.4844 -2.806946 10.82607 
1 1 1   32   12    4 o   60.554   3.3445   77.418   8.2346   75.940   10.738   79.528   12.831   59.985   4.3402   61.123   5.0896 -1.138531 6.688906 
1 1 1   32   12    5 o  133.872   2.4844  375.756   13.532  377.838   17.777  372.886   20.869  134.487   3.2048  133.258   3.7970 1.229095 4.968703 
1 1 1   32   12    6 o   59.264   3.7378   75.075   9.1341   75.063   13.067   75.087   12.773   59.235   5.3486   59.294   5.2229 -0.5893707E-01 7.475689 
1 1 1   32   12    7 o   69.591   3.4744  103.144   9.9703  103.150   14.247  103.138   13.958   69.570   4.9651   69.612   4.8615 -0.4250336E-01 6.948815 
1 1 1   32   12    8 o   25.680   6.0704   13.627   7.9652   21.639   11.612   6.5062   10.947   30.330   8.7795   21.030   8.3856 9.299603 12.14076 
1 1 1   32   12    9 o   43.009   4.5897   42.870   7.4928   50.884   9.8615   31.925   11.524   48.832   4.8964   37.187   7.7646 11.64501 9.179497 
1 1 1   32   12   10 o   28.209   5.3492   18.340   6.4047   21.747   9.2141   15.155   8.9087   30.697   7.3706   25.720   7.7545 4.977200 10.69848 
1 1 1   32   12   11 o   44.039   3.8674   42.240   6.8796   32.671   9.6890   51.970   9.7699   38.735   6.0647   49.344   4.8006 -10.60910 7.734761 
1 1 1   32   12   12 o   20.160   5.5168   6.6068   6.5311   8.9895   9.7579   4.6731   8.7905   21.681   8.1058   18.638   7.4857 3.043402 11.03358 
1 1 1   32   12   13 o   72.346   2.8819  110.255   8.5761  103.053   11.623  118.863   12.707   69.783   4.0382   74.910   4.1127 -5.126640 5.763823 
1 1 1   32   12   14 o   67.587   3.2223   96.703   8.8660   92.617   11.543  102.580   13.845   66.016   4.2395   69.159   4.8538 -3.142693 6.444557 
1 1 1   32   12   15 o   46.480   4.4705   46.488   8.4507   57.522   13.290   38.998   10.949   50.983   6.3202   41.977   6.3244 9.006145 8.941062 
1 1 1   32   12   16 o   32.477   5.5697   26.561   7.6244   16.962   12.651   32.036   9.5547   26.862   9.3327   38.092   6.0817 -11.22958 11.13940 
1 1 1   32   12   17 o   38.412   5.3825   31.750   7.8955   46.039   13.867   24.896   9.6044   44.245   7.8881   32.579   7.3256 11.66650 10.76503 
1 1 1   32   12   18 o   34.297   6.0893   28.651   8.5259   28.970   13.177   28.422   11.182   34.145   9.1650   34.449   8.0199 -0.3043556 12.17854 
1 1 1   32   12   19 o   40.912   5.5279   39.702   8.8668   37.786   14.172   40.934   11.366   39.070   8.9822   42.753   6.4460 -3.682621 11.05583 
1 1 1   32   12   20 f   31.558   6.2124   25.173   8.3667   22.966   13.102   26.692   10.872   30.032   9.4684   33.085   8.0451 -3.053419 12.42473 
1 1 1   32   12   21 o   45.923   8.0271   46.269   11.075   79.210   31.698   41.688   11.820   49.107   14.587   42.740   6.7051 6.366825 16.05428 
1 1 1   32   12   22 o   28.338   8.3291   18.168   15.745   22.593   25.106   15.299   20.215   29.868   12.398   26.808   11.126 3.059792 16.65815 
1 1 1   32   12   23 o   75.323   6.1439  141.291   18.755  122.685   27.469  157.539   25.670   69.226   9.6207   81.419   7.6442 -12.19247 12.28789 
1 1 1   32   12   24 o   27.741   8.1575   18.872   16.149   5.3440   25.905   27.470   20.653   24.884   11.358   30.599   11.712 -5.714941 16.31506 
1 1 1   32   12   25 o   48.076   9.1573   88.562   21.415   55.557   44.716   98.385   24.394   35.061   15.547   61.092   9.6812 -26.03100 18.31460 
1 1 1   32   12   26 o   80.065   8.2508  159.448   27.246   0.0000   0.0000  159.448   27.246  ?   ?    80.065   8.2508      ?      ? 
1 1 1   32   13    0 o   68.410   3.3732   99.323   13.309   99.323   13.309   99.323   13.309   68.410   4.7704   68.410   4.7704 0.000000 0.000000 
1 1 1   32   13    1 o  138.207   2.6694  401.246   15.215  394.001   21.381  408.678   21.657  136.936   3.7857  139.477   3.7646 -2.541443 5.338874 
1 1 1   32   13    2 o   67.653   3.3415   97.196   9.3228   95.732   13.197   98.654   13.172   67.127   4.7665   68.178   4.6843 -1.050949 6.682998 
1 1 1   32   13    3 o   76.604   2.9551  125.484   9.1166  132.598   11.902  115.384   14.181   79.482   3.6307   73.725   4.6637 5.756500 5.910287 
1 1 1   32   13    4 o  108.764   2.7068  249.398   12.110  258.160   16.722  239.736   17.560  110.871   3.6569  106.657   3.9917 4.213806 5.413544 
1 1 1   32   13    5 o   78.077   2.9273  128.261   9.2737  126.139   12.039  131.358   14.543   77.442   3.7691   78.711   4.4799 -1.269218 5.854508 
1 1 1   32   13    6 o   55.318   3.9334   65.813   8.9565   71.727   12.908   60.322   12.437   57.772   5.4174   52.864   5.7043 4.907703 7.866826 
1 1 1   32   13    7 o   78.669   3.2741  131.629   10.616  138.039   15.100  125.364   14.928   80.608   4.5419   76.730   4.7171 3.878265 6.548283 
1 1 1   32   13    8 o  106.152   2.6291  235.244   11.345  226.322   14.722  248.286   17.800  103.850   3.4372  108.454   3.9793 -4.603966 5.258224 
1 1 1   32   13    9 o   39.753   4.1742   34.453   6.8094   31.296   9.7606   37.446   9.5045   37.850   6.2524   41.656   5.5320 -3.805904 8.348388 
1 1 1   32   13   10 o   43.759   3.7994   41.228   6.8507   43.738   9.8089   38.839   9.5721   45.092   5.2741   42.426   5.4703 2.666710 7.598753 
1 1 1   32   13   11 o   59.294   3.1199   74.848   7.6177   71.783   10.921   77.752   10.631   58.050   4.5615   60.539   4.2576 -2.489758 6.239746 
1 1 1   32   13   12 o   90.055   2.5248  170.766   9.3641  158.936   13.136  182.988   13.352   86.832   3.6680   93.277   3.4706 -6.444923 5.049671 
1 1 1   32   13   13 o   17.502   5.0720   2.3639   6.0937  -2.5009   8.5765   7.3236   8.6598   14.986   6.7158   20.018   7.6026 -5.031978 10.14400 
1 1 1   32   13   14 o   35.123   5.0501   27.487   7.1598   21.213   9.3774   36.256   11.087   29.955   7.5830   40.290   6.6718 -10.33512 10.10020 
1 1 1   32   13   15 o   24.311   5.5631   11.500   7.9343  -5.3829   12.110   24.197   10.502   16.844   7.7176   31.778   8.0143 -14.93339 11.12613 
1 1 1   32   13   16 o   64.765   3.6235   93.242   9.3227   79.433   14.580  102.793   12.126   60.109   5.8809   69.422   4.2349 -9.313362 7.247005 
1 1 1   32   13   17 o   27.614   6.8595   17.751   9.1138   18.506   17.111   17.452   10.768   28.233   10.695   26.995   8.5916 1.238815 13.71893 
1 1 1   32   13   18 o   51.302   5.2310   56.311   10.234   72.063   19.206   50.064   12.095   55.178   8.4393   47.427   6.1831 7.751068 10.46193 
1 1 1   32   13   19 o   34.223   6.0779   29.299   8.4958   27.565   13.361   30.476   11.008   32.823   9.3933   35.623   7.7155 -2.800442 12.15578 
1 1 1   32   13   20 o   62.579   4.9538   96.140   11.252   73.344   19.718  107.147   13.702   54.913   8.7061   70.246   4.7292 -15.33251 9.907645 
1 1 1   32   13   21 o   37.680   8.1092   34.751   10.601   50.595   29.913   32.476   11.337   38.747   14.247   36.614   7.7490 2.133335 16.21836 
1 1 1   32   13   22 o   67.889   6.9897  121.017   18.328   98.905   27.376  138.981   24.675   59.500   11.572   76.279   7.8430 -16.77947 13.97942 
1 1 1   32   13   23 f   27.656   8.0517   18.897   14.356   21.598   24.182   17.428   17.839   28.700   12.059   26.613   10.673 2.087715 16.10346 
1 1 1   32   13   24 o   32.431   8.8168   33.128   16.211   37.479   26.880   30.642   20.322   33.189   13.170   31.674   11.726 1.514893 17.63350 
1 1 1   32   13   25 o   26.353   8.0574   14.934   17.223 -40.1997   43.691   25.077   18.740   23.345   11.610   29.360   11.176 -6.014452 16.11482 
1 1 1   32   14    0 o   30.849   6.8056   25.598   10.737   25.598   10.737   25.598   10.737   30.849   9.6245   30.849   9.6245 0.000000 0.000000 
1 1 1   32   14    1 f   46.990   3.9647   46.499   7.5935   39.361   9.9121   56.640   11.814   42.719   5.6257   51.260   5.5880 -8.540859 7.929353 
1 1 1   32   14    2 o   61.545   3.2182   78.792   8.0752   69.553   10.496   92.192   12.641   57.258   4.4445   65.831   4.6556 -8.573639 6.436468 
1 1 1   32   14    3 o   63.138   3.2654   86.390   8.2776   93.757   10.860   76.176   12.787   66.669   3.9495   59.607   5.2011 7.062210 6.530748 
1 1 1   32   14    4 o   62.448   3.3095   84.636   8.3081   92.536   10.957   73.952   12.743   66.203   4.0129   58.693   5.2639 7.509995 6.619071 
1 1 1   32   14    5 o  113.201   2.7988  270.499   13.062  268.314   18.692  272.585   18.261  112.713   4.0209  113.690   3.8944 -0.9765396 5.597673 
1 1 1   32   14    6 o   51.436   4.1955   57.010   8.8252   68.162   13.055   47.625   11.976   56.159   5.6364   46.712   6.2160 9.446983 8.390923 
1 1 1   32   14    7 o   95.852   2.9714  194.279   11.736  206.054   16.961  183.464   16.256   98.654   4.1684   93.050   4.2357 5.604034 5.942807 
1 1 1   32   14    8 o   28.509   5.1613   18.888   6.3143   12.333   8.9634   25.347   8.8965   23.604   7.8624   33.415   6.6886 -9.811806 10.32254 
1 1 1   32   14    9 o   37.004   4.4881   30.381   6.6793   33.928   9.6333   27.096   9.2692   39.479   5.9162   34.529   6.7506 4.949741 8.976147 
1 1 1   32   14   10 o   40.844   4.0463   36.292   6.8060   34.545   9.7030   37.984   9.5493   39.805   5.9101   41.882   5.5281 -2.076515 8.092567 
1 1 1   32   14   11 o   30.343   5.1572   21.484   6.3950   23.951   9.0220   18.992   9.0659   32.229   6.9885   28.457   7.5861 3.772646 10.31443 
1 1 1   32   14   12 o  108.357   2.3837  247.027   10.648  236.826   14.892  257.696   15.231  106.047   3.4048  110.666   3.3369 -4.619362 4.767371 
1 1 1   32   14   13 o   35.372   4.7290   29.597   6.6844   46.252   9.5857   13.831   9.3261   46.262   5.0238   24.481   8.0135 21.78127 9.458034 
1 1 1   32   14   14 o  104.287   2.9865  231.533   12.835  242.201   18.614  221.864   17.722  106.564   4.2351  102.010   4.2121 4.553902 5.973049 
1 1 1   32   14   15 o   17.095   5.4088  -3.5150   7.5824   3.0761   12.565  -7.2896   9.5088   20.059   8.5708   14.132   6.6003 5.927881 10.81764 
1 1 1   32   14   16 o   52.171   4.2666   59.013   9.0876   71.452   13.959   49.863   11.972   56.900   5.9482   47.442   6.1183 9.457611 8.533180 
1 1 1   32   14   17 o   36.479   5.8139   31.300   8.5433   41.832   13.215   23.738   11.198   41.883   7.9406   31.075   8.4943 10.80866 11.62781 
1 1 1   32   14   18 o   24.050   6.2747   11.211   8.1880   20.060   13.407   5.9469   10.340   28.270   9.6158   19.829   8.0637 8.441463 12.54933 
1 1 1   32   14   19 o   18.746   5.6712   0.9431   7.7756   8.8997   12.485  -4.0991   9.9386   22.144   8.9114   15.348   7.0170 6.796027 11.34247 
1 1 1   32   14   20 o   36.044   5.6927   39.145   10.019   1.9995   17.861   56.197   12.102   21.925   9.7679   50.163   5.8493 -28.23878 11.38536 
1 1 1   32   14   21 o   25.421   7.5531   12.333   10.354   11.512   29.641   12.447   11.050   27.484   12.387   23.359   8.6468 4.124990 15.10616 
1 1 1   32   14   22 o   27.303   8.0441   17.829   15.342   9.6969   24.020   23.433   19.940   25.482   11.342   29.124   11.410 -3.642090 16.08811 
1 1 1   32   14   23 o   31.200   7.8187   28.659   15.294  -1.2657   25.778   44.913   18.999   23.377   10.901   39.023   11.211 -15.64572 15.63743 
1 1 1   32   14   24 f   26.129   7.9153   15.138   15.722   2.1504   26.675   22.053   19.462   24.120   11.194   28.138   11.193 -4.018448 15.83053 
1 1 1   32   15    0 o   18.624   6.5793   11.216   8.7144   11.216   8.7144   11.216   8.7144   18.624   9.3045   18.624   9.3045 0.000000 0.000000 
1 1 1   32   15    1 o   46.567   3.6385   46.522   6.9843   46.369   9.7138   46.687   10.049   46.516   5.0631   46.618   5.2267 -0.1016884 7.276904 
1 1 1   32   15    2 o   41.579   4.3047   37.474   7.3284   36.055   9.7224   39.342   11.152   40.782   5.7801   42.376   6.3806 -1.593468 8.609357 
1 1 1   32   15    3 f   44.972   4.0369   42.921   7.4114   36.541   9.7349   51.716   11.431   41.062   5.7482   48.882   5.6697 -7.819965 8.073819 
1 1 1   32   15    4 o   28.980   5.6797   19.773   6.9881   20.590   9.1360   18.621   10.849   29.788   7.4541   28.172   8.5715 1.616282 11.35931 
1 1 1   32   15    5 o   48.044   4.5017   51.189   8.7828   42.392   12.616   59.462   12.235   43.692   7.0007   52.397   5.6613 -8.705288 9.003385 
1 1 1   32   15    6 o   53.972   3.7930   58.882   8.1073   89.116   13.296   40.987   10.229   64.471   5.0001   43.473   5.7049 20.99754 7.585949 
1 1 1   32   15    7 o   85.568   2.5900  154.321   9.1373  150.943   12.993  157.626   12.853   84.611   3.7231   86.524   3.6016 -1.913681 5.180054 
1 1 1   32   15    8 o   69.051   2.8464  100.982   8.0689  114.028   11.589   88.708   11.241   73.468   3.8245   64.634   4.2169 8.834267 5.692882 
1 1 1   32   15    9 o   50.099   3.6003   54.857   7.1994   71.098   10.281   39.229   10.085   57.790   4.3133   42.407   5.7659 15.38235 7.200670 
1 1 1   32   15   10 o   67.488   2.8829   96.619   8.0129  104.213   11.569   89.617   11.109   70.068   4.0032   64.908   4.1496 5.160408 5.765849 
1 1 1   32   15   11 f   31.758   5.0704   23.608   6.4875   22.078   9.2937   25.062   9.0600   30.607   7.4356   32.910   6.8956 -2.302395 10.14084 
1 1 1   32   15   12 o   19.705   5.3962   6.8090   6.2516   6.6662   8.9110   6.9474   8.7729   19.658   7.6478   19.751   7.6148 -0.9250641E-01 10.79233 
1 1 1   32   15   13 o  107.604   2.7048  247.469   11.520  237.828   18.962  253.109   14.502  105.493   4.3580  109.715   3.2049 -4.221794 5.409570 
1 1 1   32   15   14 o   25.393   5.8986   11.664   7.9346   26.706   12.441   1.3496   10.302   32.907   8.9359   17.879   7.7022 15.02803 11.79720 
1 1 1   32   15   15 o  107.485   2.9815  246.898   13.201  245.679   19.120  248.009   18.248  107.132   4.3271  107.838   4.1028 -0.7062302 5.962963 
1 1 1   32   15   16 o   26.167   6.4164   15.742   8.8862   22.816   12.443   8.3792   12.695   30.149   9.1813   22.186   8.9658 7.962729 12.83284 
1 1 1   32   15   17 o   43.361   5.4324   48.221   9.0330   22.549   13.119   71.361   12.456   29.706   9.4863   57.017   5.2966 -27.31075 10.86481 
1 1 1   32   15   18 o   36.014   5.9105   31.460   8.5740   38.361   13.170   26.384   11.296   39.466   8.3511   32.561   8.3663 6.905342 11.82099 
1 1 1   32   15   19 o  111.349   3.5428  277.244   15.667  244.094   24.785  299.303   20.218  104.678   5.7406  118.020   4.1535 -13.34192 7.085661 
1 1 1   32   15   20 o   76.841   4.1186  131.707   12.375  134.667   21.131  130.162   15.266   76.497   6.6975   77.186   4.7954 -0.6889191 8.237273 
1 1 1   32   15   21 o   25.920   7.5642   14.871   11.036   11.003   28.890   15.532   11.942   26.782   12.135   25.058   9.0340 1.724354 15.12834 
1 1 1   32   15   22 o   72.352   7.1218  140.430   19.406   94.985   27.249  187.197   27.643   56.606   12.042   88.098   7.6076 -31.49282 14.24357 
1 1 1   32   15   23 o   32.130   13.016   34.763   26.828   34.763   26.828   0.0000   0.0000   32.130   13.016  ?   ?       ?      ? 
1 1 1   32   16    0 o   14.320   5.9378   5.5637   8.3428   5.5637   8.3428   5.5637   8.3428   14.320   8.3973   14.320   8.3973 0.000000 0.000000 
1 1 1   32   16    1 o   68.127   2.8274   98.212   7.9420  100.957   11.219   95.456   11.244   69.108   3.9360   67.147   4.0602 1.961754 5.654846 
1 1 1   32   16    2 o   28.114   5.2593   18.388   6.2026   19.746   8.7966   17.045   8.7472   29.159   7.3242   27.070   7.5498 2.088772 10.51866 
1 1 1   32   16    3 o  107.024   2.3705  240.575   10.463  240.108   14.863  241.034   14.733  106.910   3.3706  107.137   3.3341 -0.2271881 4.741047 
1 1 1   32   16    4 o   47.483   4.2010   50.320   7.8451   44.977   12.757   53.570   9.9490   44.960   6.8793   50.006   4.8238 -5.045994 8.401982 
1 1 1   32   16    5 o   57.346   3.6194   70.068   8.3473   74.361   13.535   67.433   10.604   58.502   5.6094   56.191   4.5756 2.311665 7.238872 
1 1 1   32   16    6 o   89.836   2.8921  174.432   10.374  156.986   16.384  186.108   13.404   85.652   4.6379   94.020   3.4566 -8.368286 5.784297 
1 1 1   32   16    7 o   52.276   3.4141   59.249   7.2853   51.328   10.506   66.586   10.112   48.697   5.2307   55.856   4.3892 -7.159233 6.828256 
1 1 1   32   16    8 f   19.361   5.1654   5.6953   6.0948  -0.8624   8.7585   11.852   8.4866   15.771   6.9420   22.952   7.6507 -7.181216 10.33078 
1 1 1   32   16    9 o   46.552   3.6609   47.034   7.0184   44.755   10.007   49.239   9.8456   45.365   5.3485   47.739   5.0004 -2.374096 7.321893 
1 1 1   32   16   10 o   44.502   3.8598   43.475   6.9939   50.892   9.8726   36.001   9.9094   48.563   4.9290   40.441   5.9410 8.122169 7.719509 
1 1 1   32   16   11 o   35.916   4.6544   29.715   6.6196   37.865   9.3451   21.508   9.3780   41.691   5.4348   30.141   7.5576 11.54945 9.308843 
1 1 1   32   16   12 o   16.756   4.9585   2.4022   5.7452   2.5367   7.9914   2.2584   8.2656   16.722   6.9724   16.790   7.0522 -0.6806946E-01 9.917009 
1 1 1   32   16   13 o   45.760   4.3750   44.527   8.0218   55.127   13.429   38.646   10.002   49.610   6.5632   41.909   5.7867 7.701206 8.749930 
1 1 1   32   16   14 o   26.908   6.1769   16.275   8.0007   24.875   12.454   10.231   10.440   31.527   9.0824   22.289   8.3743 9.238115 12.35386 
1 1 1   32   16   15 o   36.836   5.7890   32.247   8.4967   39.403   13.253   27.252   11.072   40.263   8.2577   33.409   8.1155 6.853802 11.57800 
1 1 1   32   16   16 o   19.585   5.9542   3.0943   8.6701   3.5227   11.936   2.6157   12.615   19.570   8.3572   19.600   8.4832 -0.3052902E-01 11.90833 
1 1 1   32   16   17 o   32.250   6.0810   25.661   8.2419   31.357   12.492   21.269   10.968   35.364   8.6384   29.136   8.5612 6.227737 12.16207 
1 1 1   32   16   18 o   33.675   5.4529   29.247   8.4364   10.024   12.529   45.193   11.411   22.600   8.9839   44.749   6.1828 -22.14812 10.90588 
1 1 1   32   16   19 o   66.468   4.9764  103.965   13.437   89.285   19.525  117.174   18.521   61.159   7.7406   71.776   6.2563 -10.61741 9.952765 
1 1 1   32   16   20 o   35.651   7.1076   36.806   10.750   29.129   20.981   39.538   12.518   31.267   11.844   40.036   7.8612 -8.769838 14.21515 
1 1 1   32   16   21 o   21.551   7.1494  -1.0579   10.063   13.025   29.892  -2.8580   10.687   27.014   12.280   16.089   7.3250 10.92505 14.29886 
1 1 1   32   16   22 o   23.488   7.2899   2.4944   15.489 -28.5708   25.036   21.759   19.716   18.942   9.3008   28.033   11.228 -9.090515 14.57973 
1 1 1   32   17    0 f   16.305   6.2493   8.4870   8.3386   8.4870   8.3386   8.4870   8.3386   16.305   8.8378   16.305   8.8378 0.000000 0.000000 
1 1 1   32   17    1 o   13.857   4.4916  -4.6358   5.8204  -3.2003   8.3206  -6.0113   8.1449   14.448   6.5322   13.266   6.1666 1.181787 8.983143 
1 1 1   32   17    2 f   43.395   3.8399   40.970   6.8661   40.069   9.8501   41.822   9.5760   42.872   5.5705   43.918   5.2866 -1.045609 7.679787 
1 1 1   32   17    3 o   33.143   4.8875   25.356   6.5748   20.739   9.4670   29.658   9.1380   29.584   7.6883   36.701   6.0368 -7.117033 9.775086 
1 1 1   32   17    4 o   46.739   4.2916   49.853   7.7694   42.096   12.759   54.424   9.7946   43.146   7.1700   50.331   4.7183 -7.185116 8.583164 
1 1 1   32   17    5 o   41.604   4.5352   37.453   7.5942   43.275   12.460   34.011   9.5789   43.878   6.8851   39.331   5.9050 4.547440 9.070485 
1 1 1   32   17    6 o   15.185   4.9050  -3.8880   6.5430  -5.1477   11.176  -3.2310   8.0707   16.201   7.4197   14.170   6.4176 2.031563 9.810047 
1 1 1   32   17    7 o   47.361   3.6422   48.701   7.0967   46.484   10.233   50.755   9.8506   46.222   5.3676   48.499   4.9245 -2.277103 7.284335 
1 1 1   32   17    8 o   50.100   3.5042   54.420   7.2050   50.274   10.419   58.221   9.9746   48.126   5.2488   52.074   4.6442 -3.947517 7.008484 
1 1 1   32   17    9 o   53.659   3.3656   62.097   7.4089   54.718   10.431   69.610   10.525   50.305   5.0276   57.013   4.4759 -6.708275 6.731297 
1 1 1   32   17   10 o   72.907   2.7610  112.935   8.2918  106.158   11.694  119.787   11.759   70.647   4.0133   75.167   3.7929 -4.520546 5.522054 
1 1 1   32   17   11 o   93.675   2.5185  185.541   9.7233  176.107   13.643  195.281   13.862   91.212   3.6264   96.137   3.4959 -4.924797 5.037067 
1 1 1   32   17   12 o  112.795   2.6645  267.748   12.191  283.434   19.270  257.279   15.742  115.270   4.0532  110.321   3.4597 4.948242 5.328938 
1 1 1   32   17   13 o   48.650   4.1470   52.754   8.0146   51.387   13.073   53.577   10.144   47.652   6.6518   49.647   4.9541 -1.995449 8.293971 
1 1 1   32   17   14 o   81.412   3.3095  144.476   11.035  130.116   15.946  157.673   15.286   77.222   5.0066   85.601   4.3296 -8.379410 6.619020 
1 1 1   32   17   15 o   25.902   5.9854   13.768   8.1054   27.641   12.453   3.5691   10.677   32.975   8.9341   18.830   7.9675 14.14514 11.97073 
1 1 1   32   17   16 o   45.958   5.5391   50.888   10.078   53.938   13.451   46.984   15.217   48.558   6.7164   43.358   8.8099 5.200092 11.07812 
1 1 1   32   17   17 o   18.859   5.8399   1.7468   8.3559   1.5365   14.092   1.8609   10.377   19.887   8.7773   17.830   7.7056 2.057032 11.67980 
1 1 1   32   17   18 o   31.285   6.4755   27.563   9.5282   14.983   16.647   33.692   11.620   25.588   10.293   36.981   7.8604 -11.39300 12.95101 
1 1 1   32   17   19 o   43.729   6.1407   58.007   10.616   23.812   18.065   76.045   13.120   29.157   11.003   58.302   5.4563 -29.14475 12.28141 
1 1 1   32   17   20 o   32.936   8.2657   27.344   10.967   46.777   29.903   24.324   11.788   35.517   13.955   30.355   8.8629 5.161861 16.53145 
1 1 1   32   17   21 o   18.798   6.3651  -4.1821   9.9290 -22.3168   29.544  -1.8731   10.542   21.318   10.389   16.279   7.3573 5.038168 12.73027 
1 1 1   32   18    0 o   50.029   3.6237   54.455   10.320   54.455   10.320   54.455   10.320   50.029   5.1246   50.029   5.1246 0.000000 0.000000 
1 1 1   32   18    1 o   91.579   2.5251  177.206   9.5350  174.027   13.555  180.320   13.415   90.734   3.6221   92.423   3.5192 -1.688965 5.050205 
1 1 1   32   18    2 f   22.712   5.5298   11.375   6.2807   12.648   9.0730   10.203   8.7029   23.605   7.9109   21.820   7.7286 1.784866 11.05954 
1 1 1   32   18    3 o  111.929   2.6551  264.677   12.019  268.536   18.996  262.100   15.521  112.326   4.1003  111.533   3.3741 0.7934647 5.310112 
1 1 1   32   18    4 o   37.114   5.1898   32.260   7.4655   30.023   12.367   33.542   9.3642   35.138   8.6025   39.090   5.8081 -3.952011 10.37967 
1 1 1   32   18    5 o   38.384   5.1464   35.322   7.5264   29.210   12.487   38.809   9.4325   34.559   8.7513   42.209   5.4182 -7.650467 10.29283 
1 1 1   32   18    6 o   22.899   5.4827   11.111   6.3395   16.397   9.3992   6.6994   8.5867   26.306   7.9727   19.492   7.5284 6.814026 10.96543 
1 1 1   32   18    7 o   40.365   4.1083   35.844   6.8342   34.910   9.7672   36.739   9.5659   39.788   5.9518   40.942   5.6648 -1.154007 8.216693 
1 1 1   32   18    8 o   35.111   4.8503   28.522   6.7715   29.469   9.6441   27.602   9.5101   35.735   6.7916   34.487   6.9265 1.248211 9.700602 
1 1 1   32   18    9 o   45.898   3.7113   46.082   6.9780   51.806   9.8516   40.319   9.8852   48.936   4.8810   42.860   5.5920 6.076847 7.422597 
1 1 1   32   18   10 o   26.051   5.4207   16.005   6.3352   11.991   8.7780   20.368   9.1525   22.936   7.7807   29.167   7.5497 -6.230913 10.84145 
1 1 1   32   18   11 o   46.462   4.7024   49.216   8.9313   44.958   13.075   52.941   12.229   44.228   7.1678   48.696   6.0888 -4.467670 9.404809 
1 1 1   32   18   12 f   52.168   4.0621   61.363   8.3998   56.307   13.514   64.547   10.723   49.811   6.5777   54.525   4.7682 -4.714024 8.124155 
1 1 1   32   18   13 o   71.797   3.6970  114.962   9.9901  108.336   17.907  117.956   12.037   69.316   6.2636   74.277   3.9293 -4.961205 7.394065 
1 1 1   32   18   14 o   32.947   5.8582   27.771   7.8801   23.186   13.071   30.389   9.8767   29.956   9.4585   35.937   6.9145 -5.980839 11.71637 
1 1 1   32   18   15 o   60.074   4.5742   82.427   11.224   84.517   15.038   79.799   16.864   61.380   5.9403   58.768   6.9574 2.612793 9.148353 
1 1 1   32   18   16 f   40.356   6.0306   41.209   9.8641   47.035   13.405   34.330   14.567   44.758   7.2617   35.953   9.6302 8.804420 12.06120 
1 1 1   32   18   17 o   65.549   4.4530   99.501   11.422   93.722   18.966  102.790   14.309   62.906   7.3100   68.191   5.0875 -5.284901 8.906095 
1 1 1   32   18   18 o   25.502   6.5422   16.867   9.1766   7.9511   16.932   20.575   10.919   22.836   9.8561   28.167   8.6057 -5.330645 13.08438 
1 1 1   32   18   19 o   26.376   6.8439   13.042   9.3902   33.201   17.568   4.9795   11.111   33.452   11.001   19.300   8.1449 14.15229 13.68788 
1 1 1   32   18   20 o   22.279   6.8451   7.8924   10.883 -28.6595   31.960   12.687   11.575   21.360   10.492   23.198   8.7946 -1.838593 13.69024 
1 1 1   32   19    0 o   95.957   2.4739  192.924   13.805  192.924   13.805  192.924   13.805   95.957   3.4986   95.957   3.4986 0.000000 0.000000 
1 1 1   32   19    1 o   80.317   2.6556  136.744   8.7956  139.988   12.479  133.541   12.399   81.283   3.7222   79.351   3.7886 1.931999 5.311173 
1 1 1   32   19    2 o   49.462   3.5315   53.061   7.1698   47.120   10.099   59.097   10.180   46.536   5.2618   52.388   4.7116 -5.851646 7.062979 
1 1 1   32   19    3 o   82.978   2.9771  149.181   9.9170  136.224   15.508  158.145   12.899   79.512   4.7289   86.444   3.6179 -6.931671 5.954172 
1 1 1   32   19    4 o   24.143   5.6692   13.474   7.2679   3.3981   11.874   19.511   9.1910   19.699   8.3720   28.586   7.6463 -8.886641 11.33832 
1 1 1   32   19    5 o   25.274   5.3058   15.135   7.2713  -1.5791   11.937   24.997   9.1688   17.852   7.9670   32.696   7.0096 -14.84434 10.61166 
1 1 1   32   19    6 o   14.289   4.6048  -3.8996   6.0201  -5.8325   8.7087  -2.1306   8.3313   13.791   6.3992   14.786   6.6232 -0.9949121 9.209624 
1 1 1   32   19    7 o   35.324   5.1312   27.827   7.3444   18.428   9.5126   41.697   11.556   27.608   7.9333   43.040   6.5098 -15.43218 10.26236 
1 1 1   32   19    8 o   31.793   5.2975   24.096   6.8201   26.064   10.060   22.423   9.2780   32.978   7.5577   30.608   7.4253 2.370140 10.59501 
1 1 1   32   19    9 o   61.010   3.2662   80.033   8.1907   86.748   12.215   74.548   11.041   63.283   4.6799   58.737   4.5574 4.545517 6.532347 
1 1 1   32   19   10 o   50.737   3.4693   55.985   7.2475   58.023   10.628   54.214   9.9085   51.546   4.9992   49.928   4.8117 1.618183 6.938658 
1 1 1   32   19   11 o   34.617   5.6394   27.931   7.5928   34.755   13.011   24.408   9.3499   37.299   8.6291   31.934   7.2630 5.365936 11.27886 
1 1 1   32   19   12 o   68.817   3.4002  104.542   9.3158   96.841   14.916  109.467   11.928   66.178   5.4648   71.456   4.0474 -5.277313 6.800421 
1 1 1   32   19   13 o   13.319   4.5200 -10.6467   6.8246 -12.1569   11.505  -9.8268   8.4769   14.348   6.8638   12.291   5.8829 2.056888 9.039935 
1 1 1   32   19   14 o   64.947   3.5230   91.488   9.1527   97.392   15.044   88.019   11.533   66.145   5.5143   63.749   4.3862 2.395924 7.046048 
1 1 1   32   19   15 o   43.502   5.8528   46.829   10.063   44.086   13.424   50.349   15.204   42.277   7.9911   44.728   8.5536 -2.451065 11.70565 
1 1 1   32   19   16 o   64.827   4.5449   99.840   11.639  115.606   15.450   79.149   17.699   72.130   5.1934   57.524   7.4601 14.60621 9.089822 
1 1 1   32   19   17 o   33.154   6.7567   31.862   10.037   22.255   18.068   36.150   12.071   28.301   10.923   38.007   7.9559 -9.706606 13.51345 
1 1 1   32   19   18 o   87.183   4.0480  177.393   13.685  152.626   22.467  192.003   17.255   80.654   6.7538   93.712   4.4644 -13.05822 8.095974 
1 1 1   32   20    0 o   23.160   6.7422   16.585   9.0163   16.585   9.0163   16.585   9.0163   23.160   9.5349   23.160   9.5349 0.000000 0.000000 
1 1 1   32   20    1 o   58.658   3.2299   74.174   7.6856   57.891   10.569   92.448   11.196   51.592   4.9668   65.724   4.1303 -14.13214 6.459818 
1 1 1   32   20    2 o   44.529   5.0333   46.173   8.8933   37.967   12.541   54.472   12.613   39.733   7.9309   49.326   6.1998 -9.593472 10.06660 
1 1 1   32   20    3 o   65.766   3.4239   93.123   9.0720   97.610   14.591   90.295   11.583   66.718   5.3026   64.814   4.3329 1.903862 6.847733 
1 1 1   32   20    4 o   24.297   5.9831   14.052   7.4142   8.8421   13.140   16.485   8.9803   22.455   9.1052   26.139   7.7642 -3.683329 11.96611 
1 1 1   32   20    5 o   49.931   3.6072   54.468   7.4158   58.830   10.637   50.343   10.344   51.950   4.9643   47.912   5.2347 4.037399 7.214349 
1 1 1   32   20    6 o   51.915   3.4491   58.685   7.3853   58.781   10.450   58.589   10.439   51.958   4.8763   51.872   4.8793 0.8620453E-01 6.898221 
1 1 1   32   20    7 o   18.442   5.1646   4.4805   6.2009  -1.3927   8.8829   10.063   8.6601   15.463   6.8888   21.421   7.6965 -5.958611 10.32915 
1 1 1   32   20    8 o   65.454   2.9970   92.202   8.0818   90.684   11.639   93.616   11.231   64.860   4.3509   66.047   4.1227 -1.186501 5.993943 
1 1 1   32   20    9 o   44.302   3.8241   43.382   6.9704   40.121   9.8573   46.644   9.8580   42.517   5.6212   46.087   5.1862 -3.569382 7.648168 
1 1 1   32   20   10 o   28.276   4.7522   20.524   7.5441  -7.5619   12.670   35.950   9.3900   16.356   7.6325   40.196   5.6639 -23.83960 9.504462 
1 1 1   32   20   11 o   65.491   3.4725   93.926   9.0614   93.517   14.789   94.172   11.466   64.873   5.5271   66.109   4.2051 -1.235992 6.944920 
1 1 1   32   20   12 o   62.141   3.6782   86.392   9.0179   81.107   14.774   89.530   11.385   59.943   5.9757   64.340   4.2903 -4.397167 7.356302 
1 1 1   32   20   13 o   17.956   5.4139   2.9967   7.0953  -3.4146   12.412   6.1086   8.6475   17.179   7.8493   18.734   7.4585 -1.555611 10.82777 
1 1 1   32   20   14 o   75.406   3.5029  125.696   10.876  119.973   15.553  131.172   15.214   73.547   5.1273   77.265   4.7740 -3.717842 7.005768 
1 1 1   32   20   15 o   27.237   6.5228   18.781   9.6512   29.486   13.331   6.9887   13.991   33.067   9.3549   21.407   9.0925 11.66012 13.04564 
1 1 1   32   20   16 o   28.156   8.9209   16.295   23.545   34.532   28.360 -24.1668   42.241   31.925   13.208   24.386   11.995 7.538752 17.84187 
1 1 1   32   21    0 o   8.3140   4.1595  -9.5319   8.2790  -9.5319   8.2790  -9.5319   8.2790   8.3140   5.8824   8.3140   5.8824 0.000000 0.000000 
1 1 1   32   21    1 o   33.806   5.1084   27.476   7.0166   31.990   9.5219   22.113   10.380   37.732   6.1185   29.880   8.1822 7.852699 10.21689 
1 1 1   32   21    2 o   33.518   5.9145   27.211   8.0632   33.036   12.691   23.268   10.442   36.355   8.5984   30.681   8.1235 5.673702 11.82892 
1 1 1   32   21    3 f  104.154   2.7465  233.568   11.509  223.053   18.148  240.641   14.885  101.742   4.3248  106.566   3.3866 -4.824265 5.492990 
1 1 1   32   21    4 o   28.199   5.8566   19.926   7.1864   18.012   11.933   21.014   9.0016   26.901   9.0723   29.497   7.4089 -2.596371 11.71323 
1 1 1   32   21    5 o   74.503   2.7899  118.972   8.5570  111.932   12.177  125.840   12.028   72.223   4.0878   76.784   3.7979 -4.560905 5.579815 
1 1 1   32   21    6 o   19.740   5.3830   7.2507   6.2503   9.5407   8.9669   5.0866   8.7168   21.122   7.7951   18.358   7.4257 2.763973 10.76594 
1 1 1   32   21    7 o   58.750   3.1994   74.678   7.7447   78.448   11.257   71.291   10.672   60.147   4.5379   57.354   4.5113 2.792629 6.398779 
1 1 1   32   21    8 o   34.982   4.8324   28.890   6.7963   41.961   9.9295   17.369   9.3219   43.429   5.5435   26.535   7.9170 16.89426 9.664849 
1 1 1   32   21    9 o   35.194   5.4715   33.901   7.9275   17.317   13.178   43.306   9.9238   26.269   9.4872   44.120   5.4535 -17.85142 10.94291 
1 1 1   32   21   10 o   44.189   4.5678   42.459   8.0393   54.860   13.730   35.990   9.9169   48.545   6.8575   39.834   6.0361 8.710316 9.135645 
1 1 1   32   21   11 o   24.975   6.1565   15.956   7.8393   9.3941   14.954   18.442   9.2055   22.794   9.5238   27.157   7.8044 -4.363047 12.31304 
1 1 1   32   21   12 o   67.603   3.8664  102.457   10.719  102.201   15.984  102.665   14.451   67.225   5.7648   67.981   5.1540 -0.7563400 7.732785 
1 1 1   32   21   13 o   31.334   5.4188   27.013   7.8136   10.783   12.808   36.634   9.8613   22.585   9.0483   40.082   5.9651 -17.49692 10.83757 
1 1 1   32   21   14 o   68.751   3.7265  106.176   10.488   99.150   15.416  112.231   14.310   66.232   5.6433   71.269   4.8682 -5.036934 7.452905 
1 1 1   32   22    0 o   16.209   6.4259   8.5467   9.1500   8.5467   9.1500   8.5467   9.1500   16.209   9.0876   16.209   9.0876 0.000000 0.000000 
1 1 1   32   22    1 f   56.304   3.7932   71.372   8.4556   65.314   13.630   75.162   10.781   53.715   6.1525   58.893   4.4383 -5.178177 7.586314 
1 1 1   32   22    2 o   28.272   6.0815   19.553   7.5425   24.052   12.349   16.875   9.5260   30.425   9.1198   26.118   8.0477 4.307018 12.16296 
1 1 1   32   22    3 o   27.371   5.9701   18.998   7.3557   17.436   12.017   19.935   9.3021   26.330   9.0989   28.412   7.7317 -2.082245 11.94018 
1 1 1   32   22    4 o   38.960   4.3963   34.858   6.8864   38.113   9.7910   31.670   9.6875   41.213   5.7600   36.707   6.6433 4.506180 8.792679 
1 1 1   32   22    5 o   53.216   3.4212   62.138   7.4996   60.816   10.798   63.370   10.424   52.575   4.9797   53.857   4.6926 -1.282101 6.842402 
1 1 1   32   22    6 o   55.981   3.3597   68.617   7.7515   69.191   11.196   68.088   10.742   56.148   4.8348   55.814   4.6664 0.3336411 6.719460 
1 1 1   32   22    7 o   52.503   4.0282   62.082   8.6984   63.119   11.946   60.912   12.690   53.157   5.4489   51.850   5.9341 1.306915 8.056316 
1 1 1   32   22    8 o   66.874   3.7934  100.045   10.372   97.758   15.585  101.862   13.896   65.817   5.7413   67.931   4.9596 -2.114105 7.586864 
1 1 1   32   22    9 o   24.803   5.9530   15.812   7.6321   8.4363   13.002   19.689   9.4270   21.653   8.9495   27.953   7.8523 -6.300673 11.90600 
1 1 1   32   22   10 o   74.885   3.2763  122.749   9.7831  123.942   15.995  122.036   12.366   74.594   5.1990   75.175   3.9883 -0.5805206 6.552538 
1 1 1   32   22   11 o   31.186   5.5870   26.421   7.6742   15.343   12.972   32.386   9.5188   24.817   9.3324   37.555   6.1453 -12.73819 11.17406 
1 1 1   32   22   12 o   56.979   5.8305   93.302   10.108   54.839   19.615  107.210   11.795   43.592   10.930   70.366   4.0641 -26.77415 11.66098 
1 1 1   32   23    0 o   18.542   6.8090   11.906   9.5509   11.906   9.5509   11.906   9.5509   18.542   9.6294   18.542   9.6294 0.000000 0.000000 
1 1 1   32   23    1 o   33.761   5.1635   24.782   7.3843   47.140   12.203   11.866   9.2752   45.095   6.5610   22.428   7.9750 22.66646 10.32700 
1 1 1   32   23    2 o   28.509   6.1141   21.805   8.6949   9.6153   13.603   30.225   11.306   22.381   9.1917   34.636   8.0648 -12.25570 12.22812 
1 1 1   32   23    3 o   76.117   2.8235  125.048   8.8568  119.012   12.484  131.166   12.568   74.193   4.0796   78.041   3.9045 -3.847946 5.646950 
1 1 1   32   23    4 o   41.964   4.4222   41.367   7.1383   28.428   9.9789   54.927   10.215   34.091   7.3161   49.838   4.9697 -15.74759 8.844346 
1 1 1   32   23    5 o   71.893   2.8785  111.538   8.5160  122.395   12.339  101.663   11.768   75.305   3.9727   68.480   4.1666 6.825554 5.756992 
1 1 1   32   23    6 o   58.562   3.8648   78.230   8.8540   72.299   14.660   81.635   11.109   55.946   6.3532   61.178   4.4027 -5.231678 7.729587 
1 1 1   32   23    7 o   22.918   6.0066   9.6975   7.3575   21.187   13.011   4.2962   8.9207   28.045   9.4729   17.791   7.3879 10.25454 12.01325 
1 1 1   32   23    8 o   47.306   4.6779   53.693   8.3273   48.032   13.811   56.926   10.438   43.946   7.9108   50.667   4.9949 -6.720737 9.355716 
1 1 1   32   23    9 o   18.973   5.5400   5.2717   7.2898  -3.5298   12.981   9.3257   8.8102   17.355   7.9658   20.592   7.7014 -3.236845 11.07991 
1 1 1   32   24    0 o   11.137   5.4042  -5.5452   11.319  -5.5452   11.319  -5.5452   11.319   11.137   7.6426   11.137   7.6426 0.000000 0.000000 
1 1 1   32   24    1 o   36.313   5.4443   31.301   7.7767   41.922   12.633   24.821   9.8680   41.151   7.7271   31.474   7.6715 9.676691 10.88853 
1 1 1   32   24    2 o   22.983   5.7280   12.859   7.3150   3.9311   12.257   17.798   9.1166   19.422   8.3840   26.544   7.8069 -7.121981 11.45594 
1 1 1   32   24    3 o   41.127   4.9022   40.653   7.9610   37.630   12.112   42.952   10.563   38.846   7.8304   43.408   5.9001 -4.561264 9.804378 
1 1 1   33    0    1 o   26.688   8.8352   22.988   15.383   22.988   15.383   22.988   15.383   26.688   12.495   26.688   12.495 0.000000 0.000000 
1 1 1   33    0    2 o  107.467   3.6658  243.155   22.856  243.155   22.856  243.155   22.856  107.467   5.1842  107.467   5.1842 0.000000 0.000000 
1 1 1   33    0    3 o   27.176   7.5310   21.744   11.429   21.744   11.429   21.744   11.429   27.176   10.650   27.176   10.650 0.000000 0.000000 
1 1 1   33    0    4 o   51.423   3.6502   56.908   10.696   56.908   10.696   56.908   10.696   51.423   5.1622   51.423   5.1622 0.000000 0.000000 
1 1 1   33    0    5 o   12.182   5.4684   1.3737   8.4481   1.3737   8.4481   1.3737   8.4481   12.182   7.7335   12.182   7.7335 0.000000 0.000000 
1 1 1   33    0    6 f   18.313   6.5109   10.656   8.5627   10.656   8.5627   10.656   8.5627   18.313   9.2078   18.313   9.2078 0.000000 0.000000 
1 1 1   33    0    7 o   37.484   4.7449   32.230   9.3845   32.230   9.3845   32.230   9.3845   37.484   6.7103   37.484   6.7103 0.000000 0.000000 
1 1 1   33    0    8 o   9.0585   4.4439  -6.6727   8.1820  -6.6727   8.1820  -6.6727   8.1820   9.0585   6.2846   9.0585   6.2846 0.000000 0.000000 
1 1 1   33    0    9 o   17.800   6.5462   10.063   8.8379   10.063   8.8379   10.063   8.8379   17.800   9.2578   17.800   9.2578 0.000000 0.000000 
1 1 1   33    0   10 o  113.045   2.5839  266.479   16.997  266.479   16.997  266.479   16.997  113.045   3.6542  113.045   3.6542 0.000000 0.000000 
1 1 1   33    0   11 o   35.070   5.0332   28.907   9.1140   28.907   9.1140   28.907   9.1140   35.070   7.1180   35.070   7.1180 0.000000 0.000000 
1 1 1   33    0   12 o   40.631   4.3218   37.009   9.5585   37.009   9.5585   37.009   9.5585   40.631   6.1120   40.631   6.1120 0.000000 0.000000 
1 1 1   33    0   13 o   67.712   2.8427   96.607   11.137   96.607   11.137   96.607   11.137   67.712   4.0202   67.712   4.0202 0.000000 0.000000 
1 1 1   33    0   14 o   16.633   6.3982   8.6876   8.7703   8.6876   8.7703   8.6876   8.7703   16.633   9.0485   16.633   9.0485 0.000000 0.000000 
1 1 1   33    0   15 o   21.279   6.7647   14.255   8.9803   14.255   8.9803   14.255   8.9803   21.279   9.5667   21.279   9.5667 0.000000 0.000000 
1 1 1   33    0   16 o   97.328   2.4387  197.902   13.805  197.902   13.805  197.902   13.805   97.328   3.4489   97.328   3.4489 0.000000 0.000000 
1 1 1   33    0   17 o   16.813   6.6349   8.8051   9.7010   8.8051   9.7010   8.8051   9.7010   16.813   9.3831   16.813   9.3831 0.000000 0.000000 
1 1 1   33    0   18 o   14.652   6.4362   4.1685   11.045   4.1685   11.045   4.1685   11.045   14.652   9.1022   14.652   9.1022 0.000000 0.000000 
1 1 1   33    0   19 o   22.318   7.5929   16.606   11.440   16.606   11.440   16.606   11.440   22.318   10.738   22.318   10.738 0.000000 0.000000 
1 1 1   33    0   20 o   87.326   4.9072  167.253   24.632  167.253   24.632  167.253   24.632   87.326   6.9398   87.326   6.9398 0.000000 0.000000 
1 1 1   33    0   21 o   21.147   8.7556   14.671   18.093   14.671   18.093   14.671   18.093   21.147   12.382   21.147   12.382 0.000000 0.000000 
1 1 1   33    0   22 o   81.465   4.9617  146.874   23.174  146.874   23.174  146.874   23.174   81.465   7.0169   81.465   7.0169 0.000000 0.000000 
1 1 1   33    1    0 f   57.588   5.3408   73.695   17.085   73.695   17.085   73.695   17.085   57.588   7.5530   57.588   7.5530 0.000000 0.000000 
1 1 1   33    1    1 o   33.915   6.9563   26.578   11.097   13.307   16.014   38.835   15.391   26.965   10.315   40.864   9.3360 -13.89892 13.91268 
1 1 1   33    1    2 o   54.447   5.2771   64.653   11.832   59.930   16.477   69.680   17.001   52.325   7.6349   56.568   7.2869 -4.242275 10.55419 
1 1 1   33    1    3 o   36.949   5.4891   31.779   8.3477   17.776   12.033   44.772   11.591   28.213   9.0929   45.685   6.1512 -17.47248 10.97811 
1 1 1   33    1    4 o   16.109   5.0414  -4.8126   6.8040 -10.8732   8.9854   3.3334   10.417   12.862   6.1287   19.357   8.0065 -6.495745 10.08287 
1 1 1   33    1    5 o   53.986   3.2984   61.672   7.3096   54.630   10.293   68.838   10.382   50.801   4.9124   57.171   4.4030 -6.369759 6.596861 
1 1 1   33    1    6 o   71.053   2.7483  105.884   8.0431   98.773   11.280  113.238   11.472   68.595   3.9871   73.511   3.7836 -4.915794 5.496591 
1 1 1   33    1    7 o   30.641   5.1278   21.220   6.3895   18.827   8.8446   23.832   9.2407   28.782   7.4072   32.500   7.0930 -3.717724 10.25563 
1 1 1   33    1    8 f   29.834   5.1319   20.331   6.2980   23.579   8.7776   16.885   9.0416   32.409   6.7844   27.259   7.7017 5.149429 10.26375 
1 1 1   33    1    9 o   71.605   2.7474  107.632   8.1117  104.249   11.407  111.093   11.538   70.454   3.9254   72.757   3.8449 -2.302528 5.494738 
1 1 1   33    1   10 o   54.359   3.1884   62.554   7.0660   50.974   9.8157   75.010   10.180   49.022   4.8547   59.695   4.1346 -10.67350 6.376802 
1 1 1   33    1   11 o   86.645   2.5068  157.282   8.9542  151.535   12.642  163.068   12.684   85.034   3.6046   88.256   3.4846 -3.222710 5.013585 
1 1 1   33    1   12 o   54.709   3.1713   63.473   7.1292   70.014   10.125   57.042   10.040   57.577   4.2637   51.840   4.6956 5.736942 6.342566 
1 1 1   33    1   13 o   45.217   3.6254   43.807   6.7224   49.575   9.5875   38.228   9.4284   48.245   4.8182   42.188   5.4185 6.056870 7.250876 
1 1 1   33    1   14 o   20.263   5.0193   5.9998   6.0652   15.285   8.4838  -3.7075   8.6744   25.819   7.5132   14.706   6.6576 11.11278 10.03853 
1 1 1   33    1   15 o   23.642   5.5315   12.361   6.2931   11.216   8.9366   13.488   8.8635   22.837   7.8491   24.447   7.7963 -1.610594 11.06301 
1 1 1   33    1   16 o   15.066   4.7176  -1.6544   5.8137  -0.6375   8.0343  -2.7721   8.4230   15.337   6.7025   14.794   6.6409 0.5432539 9.435262 
1 1 1   33    1   17 o   65.327   3.4056   91.166   9.1617   84.669   12.628   98.387   13.312   62.848   4.8717   67.806   4.7601 -4.958748 6.811129 
1 1 1   33    1   18 f   33.914   5.7257   27.322   7.8767   26.063   10.677   28.825   11.668   33.133   7.9203   34.696   8.2705 -1.562397 11.45133 
1 1 1   33    1   19 o   17.681   5.4300   0.5209   7.3663   2.1377   10.659  -0.9575   10.192   18.480   7.8949   16.883   7.4573 1.597879 10.85999 
1 1 1   33    1   20 o   83.765   5.1231  170.101   15.121  133.461   28.082  185.062   17.944   74.731   9.1107   92.800   4.6883 -18.06841 10.24626 
1 1 1   33    1   21 o   62.770   9.5815  127.056   21.264  137.758   24.014   88.196   45.760   77.491   7.5135   48.049   17.629 29.44168 19.16310 
1 1 1   33    1   22 o   22.813   9.9783   4.0177   17.843   4.0177   17.843   0.0000   0.0000   22.813   9.9783  ?   ?       ?      ? 
1 1 1   33    1   23 o   77.080   8.1970  141.771   26.059   0.0000   0.0000  141.771   26.059  ?   ?    77.080   8.1970      ?      ? 
1 1 1   33    2    0 o   41.334   7.8258   43.688   16.304   43.688   16.304   43.688   16.304   41.334   11.067   41.334   11.067 0.000000 0.000000 
1 1 1   33    2    1 o   65.725   4.5265   92.947   12.269   93.452   17.235   92.429   17.469   65.933   6.3378   65.517   6.4645 0.4159012 9.053018 
1 1 1   33    2    2 o   85.631   3.0609  154.282   10.796  144.364   15.192  164.402   15.345   82.803   4.4482   88.460   4.2059 -5.656647 6.121802 
1 1 1   33    2    3 o  123.179   2.7149  317.670   13.776  296.287   19.242  340.153   19.731  118.887   3.9242  127.472   3.7528 -8.585442 5.429842 
1 1 1   33    2    4 o   38.758   5.0571   35.824   7.5000   44.858   9.7805   22.928   11.685   45.980   5.1573   31.537   8.7004 14.44260 10.11413 
1 1 1   33    2    5 o   87.205   2.7432  160.807   9.7296  169.123   12.948  150.024   14.746   89.954   3.4901   84.457   4.2331 5.496216 5.486324 
1 1 1   33    2    6 o   50.565   3.4984   55.147   7.0492   71.790   10.039   38.958   9.9007   58.427   4.1659   42.703   5.6214 15.72442 6.996779 
1 1 1   33    2    7 f  101.576   2.3757  215.595   9.9496  222.332   14.093  208.901   14.049  103.176   3.3118   99.975   3.4070 3.201744 4.751410 
1 1 1   33    2    8 o   67.245   2.8366   95.159   7.8525  101.453   11.080   88.809   11.130   69.527   3.8639   64.963   4.1541 4.564560 5.673266 
1 1 1   33    2    9 o   41.888   3.9568   37.800   6.7658   32.013   9.6182   43.468   9.5191   38.565   6.0469   45.211   5.1049 -6.646374 7.913596 
1 1 1   33    2   10 o   53.755   3.2235   61.103   7.1395   57.563   10.032   64.734   10.162   52.147   4.6645   55.364   4.4505 -3.216919 6.447033 
1 1 1   33    2   11 o   39.005   4.6041   36.076   6.7600   14.758   9.4989   57.953   9.6226   25.649   8.0584   52.360   4.4558 -26.71122 9.208214 
1 1 1   33    2   12 o   71.467   2.7615  107.358   8.1279   99.518   11.300  115.764   11.700   68.737   3.9857   74.197   3.8233 -5.460526 5.523000 
1 1 1   33    2   13 o   87.962   2.5113  162.400   9.1093  160.929   12.741  163.938   13.029   87.564   3.5278   88.359   3.5752 -0.7940903 5.022685 
1 1 1   33    2   14 o   29.042   5.1677   19.513   6.2857   24.192   8.8766   14.808   8.9021   32.624   6.8167   25.460   7.7686 7.163805 10.33531 
1 1 1   33    2   15 o  102.626   2.4009  220.780   10.154  208.830   14.123  233.566   14.609   99.735   3.4334  105.518   3.3569 -5.782768 4.801786 
1 1 1   33    2   16 o   25.033   5.4921   14.360   6.2758   15.383   8.6206   13.207   9.1541   25.820   7.5908   24.246   7.9394 1.573580 10.98430 
1 1 1   33    2   17 o   30.698   6.1480   20.764   7.5566   17.794   8.9410   28.190   14.137   27.586   7.6106   33.809   9.6577 -6.223652 12.29608 
1 1 1   33    2   18 o   39.321   5.9945   39.269   9.3061   45.833   11.657   27.735   15.452   45.560   6.2036   33.083   10.259 12.47745 11.98897 
1 1 1   33    2   19 o   33.526   5.8897   27.098   8.1066   25.607   11.217   28.727   11.729   32.551   8.3225   34.500   8.3361 -1.948887 11.77944 
1 1 1   33    2   20 o   52.214   6.1120   62.344   10.991   69.887   22.326   59.930   12.628   52.214   10.726   52.214   5.8636 -0.8049011E-03 12.22398 
1 1 1   33    2   21 o   53.479   7.1112   71.999   15.251   64.932   22.165   78.353   21.017   49.704   11.093   57.254   8.9004 -7.549644 14.22235 
1 1 1   33    2   22 o   89.481   5.2462  185.467   19.272  195.343   26.608  174.570   27.949   92.557   6.9702   86.406   7.8426 6.151382 10.49235 
1 1 1   33    2   23 o   19.784   9.2548  -8.9399   18.816   0.0000   0.0000  -8.9399   18.816  ?   ?    19.784   9.2548      ?      ? 
1 1 1   33    3    0 o   12.913   5.9457  -0.3211   10.835  -0.3211   10.835  -0.3211   10.835   12.913   8.4085   12.913   8.4085 0.000000 0.000000 
1 1 1   33    3    1 o   21.653   6.0303   6.9261   7.9238   7.8843   11.222   5.9731   11.190   22.151   8.5921   21.154   8.4637 0.9976082 12.06062 
1 1 1   33    3    2 o   19.046   5.6525   2.1216   7.5709  -0.6756   10.906   4.7237   10.519   17.989   7.8364   20.102   8.1481 -2.113131 11.30490 
1 1 1   33    3    3 o   53.135   4.0143   60.266   8.7971   60.858   12.451   59.676   12.431   53.404   5.6527   52.867   5.7012 0.5366135 8.028508 
1 1 1   33    3    4 f   47.449   4.0205   49.424   7.6149   55.888   10.071   40.794   11.636   51.421   4.7486   43.476   6.4891 7.945801 8.040997 
1 1 1   33    3    5 o   78.262   2.8442  129.200   9.0913  133.288   12.162  124.023   13.686   79.781   3.6962   76.743   4.3240 3.037643 5.688474 
1 1 1   33    3    6 o   23.439   5.6909   11.514   6.6120   11.887   8.7334   11.013   10.121   23.504   7.7576   23.374   8.3285 0.1299915 11.38180 
1 1 1   33    3    7 o   72.763   2.6912  111.038   8.0736  110.815   11.265  111.273   11.577   72.704   3.7566   72.823   3.8546 -0.1185303 5.382378 
1 1 1   33    3    8 o   22.680   5.5214   10.694   6.2633   9.8148   8.8165   11.589   8.8992   22.049   7.7822   23.311   7.8346 -1.262804 11.04282 
1 1 1   33    3    9 o   21.965   5.2704   8.9255   6.1825   2.1596   8.6486   15.996   8.8412   17.368   7.2486   26.562   7.6528 -9.193426 10.54071 
1 1 1   33    3   10 o   81.096   2.5928  137.852   8.6716  140.444   12.335  135.319   12.193   81.855   3.6536   80.338   3.6799 1.516602 5.185606 
1 1 1   33    3   11 o   28.757   5.3072   18.946   6.3627   19.471   9.0045   18.422   8.9918   29.159   7.4576   28.356   7.5530 0.8026314 10.61437 
1 1 1   33    3   12 o   80.554   2.6254  136.150   8.7119  126.998   12.092  146.029   12.563   77.719   3.7722   83.389   3.6527 -5.669991 5.250870 
1 1 1   33    3   13 o   42.285   4.5106   40.951   7.3307   49.060   9.8390   30.832   10.991   47.925   4.9776   36.645   7.5237 11.27956 9.021284 
1 1 1   33    3   14 o   57.119   3.3122   69.341   7.7900   71.970   11.422   67.054   10.652   58.097   4.7667   56.141   4.6002 1.955830 6.624439 
1 1 1   33    3   15 f   89.774   2.6420  170.626   9.7307  156.225   14.059  183.868   13.481   86.001   3.9637   93.547   3.4941 -7.545998 5.283904 
1 1 1   33    3   16 o   26.287   5.5028   16.015   6.3870   16.068   8.8803   15.959   9.1929   26.330   7.6940   26.244   7.8692 0.8572769E-01 11.00550 
1 1 1   33    3   17 o   23.534   5.4718   12.321   6.7970   18.312   8.6637   2.7314   10.962   28.007   7.3920   19.061   8.0697 8.945894 10.94355 
1 1 1   33    3   18 o   61.586   3.6554   81.871   9.2711   77.341   12.705   87.032   13.560   59.779   5.1530   63.394   5.1860 -3.615452 7.310786 
1 1 1   33    3   19 o   88.036   4.4434  162.864   14.243  192.189   28.461  153.066   16.451   91.702   7.5249   84.370   4.7275 7.332390 8.886741 
1 1 1   33    3   20 f   24.183   6.8402   5.5013   9.0878   24.123   19.063   0.0246   10.338   30.994   11.377   17.372   7.5969 13.62182 13.68036 
1 1 1   33    3   21 o   45.474   7.6050   54.715   14.217   65.496   19.882   43.433   20.338   51.138   9.7829   39.811   11.646 11.32672 15.21003 
1 1 1   33    3   22 o   36.586   9.3473   43.270   20.586   3.4855   44.196   54.295   23.264   29.757   14.004   43.415   12.385 -13.65766 18.69451 
1 1 1   33    3   23 o   51.220   11.055   70.959   22.670   0.0000   0.0000   70.959   22.670  ?   ?    51.220   11.055      ?      ? 
1 1 1   33    4    0 o   37.891   6.1424   34.802   11.823   34.802   11.823   34.802   11.823   37.891   8.6866   37.891   8.6866 0.000000 0.000000 
1 1 1   33    4    1 o   55.297   4.0033   65.566   9.0747   58.108   12.928   72.810   12.741   52.060   6.0209   58.534   5.2777 -6.474167 8.006530 
1 1 1   33    4    2 o   21.545   5.9303   6.6976   7.7126   11.016   11.184   2.7813   10.650   23.840   8.7200   19.250   8.0397 4.589756 11.86064 
1 1 1   33    4    3 f  127.755   2.7049  342.058   14.252  345.830   20.240  338.349   20.072  128.456   3.8203  127.054   3.8304 1.402313 5.409869 
1 1 1   33    4    4 o   73.610   2.9824  114.102   8.9183  114.617   11.668  113.378   13.831   73.939   3.8261   73.281   4.5761 0.6582260 5.964840 
1 1 1   33    4    5 o   26.709   5.7172   16.197   6.8175   17.398   8.8303   14.426   10.727   27.678   7.5335   25.739   8.6019 1.939295 11.43440 
1 1 1   33    4    6 o   56.836   3.4777   68.120   8.0867   65.601   10.697   71.481   12.354   55.698   4.6564   57.975   5.1666 -2.276985 6.955305 
1 1 1   33    4    7 o   24.460   5.4108   13.093   6.2744   17.374   8.7180   8.4918   9.0374   27.641   7.4696   21.278   7.8301 6.363443 10.82154 
1 1 1   33    4    8 o   20.298   5.4029   7.2227   6.1579   7.8017   8.6931   6.6396   8.7240   20.655   7.6647   19.941   7.6169 0.7134190 10.80584 
1 1 1   33    4    9 o   17.103   5.0856  -1.5271   6.4370  -8.1620   8.4716   7.5359   9.9012   13.074   6.1457   21.133   8.1045 -8.059278 10.17114 
1 1 1   33    4   10 o   74.561   2.8237  117.135   8.6546  114.211   12.670  119.693   11.850   73.620   4.1726   75.502   3.8055 -1.882065 5.647334 
1 1 1   33    4   11 o   41.294   4.2069   37.613   6.8420   29.376   9.6574   45.915   9.6949   36.186   6.7181   46.402   5.0657 -10.21590 8.413891 
1 1 1   33    4   12 o   63.324   2.9733   85.030   7.7304   93.530   10.885   76.378   10.981   66.614   3.9616   60.033   4.4349 6.581253 5.946683 
1 1 1   33    4   13 o   22.148   5.1196   8.9119   6.1800  -0.2124   8.6783   18.299   8.8026   16.147   7.0122   28.150   7.4613 -12.00358 10.23923 
1 1 1   33    4   14 o   31.128   4.7571   22.086   6.3157   10.230   8.7904   34.737   9.0803   22.116   7.7742   40.139   5.4848 -18.02311 9.514267 
1 1 1   33    4   15 o   18.412   5.1987   4.4265   5.9945   2.3069   8.2043   6.8539   8.7799   16.927   7.0617   19.897   7.6315 -2.970469 10.39748 
1 1 1   33    4   16 o   15.940   4.7034  -1.3773   5.7946   7.1848   8.1219 -10.2541   8.2697   19.714   7.3902   12.166   5.8200 7.547092 9.406794 
1 1 1   33    4   17 o   71.679   3.2052  109.634   9.1509  109.219   11.540  110.338   15.020   71.823   3.8955   71.535   5.0910 0.2883224 6.410388 
1 1 1   33    4   18 o   84.796   4.3449  153.576   15.196  153.576   15.196   0.0000   0.0000   84.796   4.3449  ?   ?       ?      ? 
1 1 1   33    4   19 o   60.709   4.6878   86.941   10.697   68.176   18.020   97.152   13.292   54.239   8.0551   67.178   4.7975 -12.93901 9.375504 
1 1 1   33    4   20 o   47.990   6.4363   56.053   10.688   54.852   21.387   56.453   12.339   45.349   11.436   50.630   5.9089 -5.280579 12.87257 
1 1 1   33    4   21 o   58.065   6.2635   81.731   14.511   73.444   20.999   89.305   20.075   54.165   9.7584   61.965   7.8549 -7.799419 12.52702 
1 1 1   33    4   22 o   28.756   11.636   19.454   21.414   0.0000   0.0000   19.454   21.414  ?   ?    28.756   11.636      ?      ? 
1 1 1   33    4   23 o   53.743   11.540   79.680   24.815   0.0000   0.0000   79.680   24.815  ?   ?    53.743   11.540      ?      ? 
1 1 1   33    4   24 o   18.800   9.0158 -17.1487   20.122   0.0000   0.0000 -17.1487   20.122  ?   ?    18.800   9.0158      ?      ? 
1 1 1   33    5    0 o   63.411   3.6371   85.748   13.249   85.748   13.249   85.748   13.249   63.411   5.1436   63.411   5.1436 0.000000 0.000000 
1 1 1   33    5    1 o   74.387   3.2606  116.799   10.000  119.250   14.368  114.495   13.928   75.134   4.6366   73.640   4.5856 1.494247 6.521167 
1 1 1   33    5    2 o   59.681   3.7080   75.716   9.0989   83.842   13.063   68.059   12.681   62.860   5.0387   56.503   5.4415 6.356728 7.416028 
1 1 1   33    5    3 o   37.886   5.2262   32.302   7.9604   26.387   11.381   37.967   11.138   33.852   8.2311   41.920   6.4420 -8.068306 10.45234 
1 1 1   33    5    4 o   61.306   3.2405   78.913   8.1326   75.622   10.772   83.277   12.403   59.898   4.3601   62.715   4.7949 -2.816853 6.480921 
1 1 1   33    5    5 o   65.484   3.1364   90.710   8.3746   92.134   11.098   88.827   12.763   66.201   4.0645   64.766   4.7780 1.434189 6.272862 
1 1 1   33    5    6 o  112.854   2.6578  266.968   12.344  290.937   17.681  244.175   17.242  117.853   3.6375  107.854   3.8760 9.998848 5.315526 
1 1 1   33    5    7 o   96.165   2.4617  193.448   9.7615  187.725   13.720  199.316   13.891   94.713   3.5122   97.618   3.4502 -2.905045 4.923368 
1 1 1   33    5    8 o   92.817   2.4932  180.333   9.5441  181.078   13.564  179.602   13.432   93.003   3.5361   92.631   3.5157 0.3718338 4.986412 
1 1 1   33    5    9 o   33.621   4.7519   25.180   6.4567   21.772   9.2170   28.465   9.0478   30.903   7.3403   36.338   6.0368 -5.435122 9.503860 
1 1 1   33    5   10 o   99.682   2.4091  207.781   9.8994  215.959   14.277  200.208   13.738  101.569   3.4081   97.796   3.4060 3.773041 4.818296 
1 1 1   33    5   11 o   69.131   2.8276  100.730   8.0616  100.610   11.459  100.848   11.344   69.081   4.0216   69.180   3.9758 -0.9844208E-01 5.655116 
1 1 1   33    5   12 o   47.273   3.5628   47.862   6.9318   50.642   9.7179   44.982   9.8903   48.740   4.8342   45.806   5.2350 2.933311 7.125669 
1 1 1   33    5   13 o   46.220   3.6274   45.768   6.9134   47.173   9.8707   44.415   9.6859   46.926   5.1000   45.514   5.1598 1.412567 7.254856 
1 1 1   33    5   14 o   28.091   5.0547   18.213   6.2699   9.4333   8.8857   26.918   8.8483   21.601   7.7920   34.580   6.4409 -12.97902 10.10947 
1 1 1   33    5   15 o   49.700   3.5867   53.630   7.1881   41.000   10.131   66.432   10.200   43.503   5.6464   55.897   4.4244 -12.39376 7.173421 
1 1 1   33    5   16 o   32.692   5.5036   24.780   7.2331   22.985   9.4351   27.337   11.265   31.414   7.4033   33.969   8.1455 -2.554863 11.00716 
1 1 1   33    5   17 o   55.200   3.6984   64.891   8.2725   60.471   10.608   71.750   13.215   53.025   4.8506   57.376   5.5842 -4.350712 7.396764 
1 1 1   33    5   18 o   50.715   4.2039   56.280   8.7651   52.200   11.836   61.235   13.044   48.722   5.8898   52.708   6.0002 -3.986485 8.407866 
1 1 1   33    5   19 o   47.859   5.2824   48.088   9.7711   65.212   18.026   40.963   11.627   52.888   8.2638   42.830   6.5822 10.05754 10.56481 
1 1 1   33    5   20 o   27.023   7.6968   13.081   12.778   23.183   21.373   7.4615   15.940   30.692   11.871   23.354   9.8003 7.338486 15.39357 
1 1 1   33    5   21 o   59.789   8.2105   84.304   20.247   0.0000   0.0000   84.304   20.247  ?   ?    59.789   8.2105      ?      ? 
1 1 1   33    5   22 o   59.989   9.0325  128.585   22.653   58.185   43.168  155.337   26.611   38.930   16.216   81.048   7.9607 -42.11745 18.06491 
1 1 1   33    5   23 o   33.014   11.898   31.111   20.710   0.0000   0.0000   31.111   20.710  ?   ?    33.014   11.898      ?      ? 
1 1 1   33    5   24 o   43.303   12.128   55.234   22.523   0.0000   0.0000   55.234   22.523  ?   ?    43.303   12.128      ?      ? 
1 1 1   33    6    0 o   90.175   2.9639  170.474   15.513  170.474   15.513  170.474   15.513   90.175   4.1915   90.175   4.1915 0.000000 0.000000 
1 1 1   33    6    1 f  149.055   3.3068  469.686   20.281  513.433   29.058  428.130   28.321  155.944   4.5178  142.166   4.8300 13.77847 6.613600 
1 1 1   33    6    2 o   71.530   3.4162  109.067   10.011   98.117   14.460  119.145   13.873   67.926   5.1614   75.134   4.4768 -7.207726 6.832467 
1 1 1   33    6    3 o   37.239   5.4787   31.343   8.1321   35.965   11.993   27.409   11.065   39.892   7.5657   34.586   7.9262 5.306160 10.95743 
1 1 1   33    6    4 o   22.358   5.6757   9.6237   6.9212   13.645   9.2084   4.4018   10.493   24.861   7.9484   19.855   8.1042 5.005272 11.35144 
1 1 1   33    6    5 o   79.058   2.8997  132.901   9.3370  144.032   12.623  119.452   13.875   82.900   3.6918   75.215   4.4725 7.685608 5.799377 
1 1 1   33    6    6 o   21.295   5.4320   5.8166   6.7039  -2.0016   8.8370   16.416   10.290   15.630   6.9218   26.960   8.3735 -11.33082 10.86399 
1 1 1   33    6    7 o   38.344   4.6941   32.474   7.1582   33.019   9.4654   31.745   10.941   39.207   5.8535   37.481   7.3399 1.725204 9.388147 
1 1 1   33    6    8 o   46.224   3.7413   45.727   6.9819   58.128   10.130   34.506   9.6363   52.380   4.6890   40.067   5.8311 12.31294 7.482536 
1 1 1   33    6    9 o   21.521   5.4373   9.0599   6.1606   11.472   8.8427   6.7850   8.5876   23.144   7.8096   19.898   7.5675 3.246304 10.87455 
1 1 1   33    6   10 o   70.149   2.7891  103.660   8.0667  106.772   11.401  100.541   11.415   71.226   3.8810   69.071   4.0069 2.155663 5.578301 
1 1 1   33    6   11 o   49.927   3.5238   53.720   7.1126   66.248   10.132   41.549   9.9869   55.912   4.3938   43.942   5.5104 11.96978 7.047659 
1 1 1   33    6   12 o   87.268   2.5536  160.112   9.1841  152.309   12.938  168.038   13.039   85.089   3.6867   89.446   3.5344 -4.357002 5.107203 
1 1 1   33    6   13 o   88.811   2.4974  165.752   9.1464  169.420   12.945  162.095   12.925   89.810   3.4946   87.813   3.5688 1.997231 4.994843 
1 1 1   33    6   14 o   27.147   4.5940   15.051   6.2286   1.1194   8.5433   30.859   9.1002   16.609   7.0810   37.686   5.8547 -21.07734 9.187941 
1 1 1   33    6   15 o   70.837   3.0115  106.593   8.7352  105.981   13.133  107.079   11.698   70.529   4.5148   71.145   3.9866 -0.6164246 6.022941 
1 1 1   33    6   16 o   19.927   5.6598   5.0883   7.6863   11.174   8.6080 -18.8519   17.073   22.570   7.7048   17.284   8.2928 5.285852 11.31963 
1 1 1   33    6   17 o   19.567   5.4814   5.9200   6.7085   8.8036   8.7503   1.8083   10.449   20.920   7.7038   18.213   7.7996 2.707167 10.96279 
1 1 1   33    6   18 o   29.042   6.6908   20.798   8.9655   17.716   16.350   22.123   10.721   27.823   10.475   30.262   8.3277 -2.439499 13.38155 
1 1 1   33    6   19 o   19.978   6.0472   3.5988   8.3782  -4.6925   16.844   6.3246   9.6576   20.092   9.1662   19.863   7.8902 0.2291470 12.09443 
1 1 1   33    6   20 o   45.380   6.7337   45.769   10.356   61.665   23.019   41.735   11.596   47.601   11.787   43.160   6.5144 4.440506 13.46736 
1 1 1   33    6   21 o   90.589   4.8302  177.937   18.047   0.0000   0.0000  177.937   18.047  ?   ?    90.589   4.8302      ?      ? 
1 1 1   33    6   22 o   33.717   9.3392   34.197   18.544   21.025   41.205   37.542   20.766   31.444   14.342   35.990   11.966 -4.545420 18.67845 
1 1 1   33    6   23 o   44.590   11.771   56.658   21.965   0.0000   0.0000   56.658   21.965  ?   ?    44.590   11.771      ?      ? 
1 1 1   33    6   24 o   35.760   12.555   39.656   22.923   0.0000   0.0000   39.656   22.923  ?   ?    35.760   12.555      ?      ? 
1 1 1   33    7    0 f   60.777   3.6998   79.056   12.892   79.056   12.892   79.056   12.892   60.777   5.2323   60.777   5.2323 0.000000 0.000000 
1 1 1   33    7    1 o   40.857   5.0650   37.034   8.3452   36.094   12.008   37.911   11.606   39.952   7.5641   41.762   6.7382 -1.809536 10.13006 
1 1 1   33    7    2 o   58.579   3.8085   73.160   9.1959   74.758   13.292   71.692   12.735   59.171   5.4467   57.988   5.3248 1.182110 7.617086 
1 1 1   33    7    3 o   74.845   3.2838  115.367   9.6717  108.520   11.856  128.983   16.720   71.857   4.0005   77.833   5.2085 -5.976204 6.567577 
1 1 1   33    7    4 o   24.773   5.8771   10.580   7.2486   4.2225   9.0390   22.034   12.133   18.752   7.5699   30.793   8.9920 -12.04135 11.75416 
1 1 1   33    7    5 o   27.472   6.0423   17.013   7.5815   19.097   11.042   15.154   10.428   28.835   8.6194   26.108   8.4703 2.726461 12.08468 
1 1 1   33    7    6 o  100.093   2.6572  211.469   10.824  219.064   14.354  201.459   16.480  102.343   3.4006   97.842   4.0838 4.500671 5.314316 
1 1 1   33    7    7 o   54.265   3.5900   62.948   7.9452   64.642   10.574   60.751   12.041   55.246   4.6405   53.283   5.4790 1.963699 7.180095 
1 1 1   33    7    8 o   29.420   5.2998   19.837   6.5285   15.647   9.1652   24.153   9.3017   26.235   7.8553   32.606   7.1165 -6.371469 10.59960 
1 1 1   33    7    9 o   93.535   2.4950  183.434   9.6211  190.940   13.732  176.197   13.484   95.432   3.4888   91.639   3.5675 3.792656 4.989929 
1 1 1   33    7   10 o   70.071   2.8323  103.593   8.1759  109.966   11.627   97.361   11.499   72.243   3.9024   67.899   4.1060 4.343903 5.664584 
1 1 1   33    7   11 o   54.242   3.5171   62.079   7.8179   71.305   11.863   54.996   10.394   57.757   4.9800   50.728   4.9680 7.028912 7.034291 
1 1 1   33    7   12 o   73.825   3.0703  114.713   9.2068  110.691   11.934  120.625   14.469   72.395   3.9969   75.255   4.6617 -2.859741 6.140633 
1 1 1   33    7   13 o   97.479   2.4503  199.474   9.8400  213.017   14.102  186.622   13.737  100.738   3.3940   94.220   3.5350 6.517685 4.900573 
1 1 1   33    7   14 o   12.401   4.1604 -10.2352   5.8526  -4.6439   8.2778 -15.8239   8.2759   13.937   6.3838   10.864   5.3371 3.072748 8.320889 
1 1 1   33    7   15 o   21.761   5.4590   9.4810   6.3360   5.3499   8.9060   13.715   9.0160   19.015   7.5695   24.507   7.8680 -5.492195 10.91803 
1 1 1   33    7   16 o   72.248   3.2640  112.212   9.4440  113.406   12.054  110.314   15.197   73.088   3.9988   71.409   5.1600 1.679413 6.528049 
1 1 1   33    7   17 f   28.779   5.8742   19.713   7.3237   17.739   9.7533   22.264   11.089   27.276   8.0891   30.283   8.5201 -3.006596 11.74842 
1 1 1   33    7   18 o   41.010   6.1825   42.339   9.6460   34.728   17.119   45.880   11.676   36.506   10.687   45.515   6.2199 -9.008282 12.36501 
1 1 1   33    7   19 o   42.472   6.1264   41.709   9.5214   47.223   18.254   39.649   11.160   42.777   10.438   42.168   6.4166 0.6091385 12.25288 
1 1 1   33    7   20 o   22.475   6.5067   7.0489   8.6500   13.395   16.744   4.7387   10.102   25.759   10.337   19.190   7.9059 6.569178 13.01340 
1 1 1   33    7   21 o   13.572   6.4129  -8.6168   9.4424   0.0000   0.0000  -8.6168   9.4424  ?   ?    13.572   6.4129      ?      ? 
1 1 1   33    7   22 o   25.092   7.8964   5.7146   16.870 -47.1296   40.743   16.650   18.534   23.153   11.461   27.031   10.865 -3.878576 15.79274 
1 1 1   33    7   23 o   19.747   9.3690 -12.9115   20.550   0.0000   0.0000 -12.9115   20.550  ?   ?    19.747   9.3690      ?      ? 
1 1 1   33    7   24 o   39.098   12.668   48.231   23.333   0.0000   0.0000   48.231   23.333  ?   ?    39.098   12.668      ?      ? 
1 1 1   33    8    0 o   52.949   4.0993   60.971   12.274   60.971   12.274   60.971   12.274   52.949   5.7973   52.949   5.7973 0.000000 0.000000 
1 1 1   33    8    1 o   47.671   4.3709   49.037   8.5750   53.201   12.234   45.017   12.022   49.733   5.9645   45.609   6.3909 4.124008 8.741804 
1 1 1   33    8    2 o   62.125   3.6362   82.098   9.3132   78.880   13.019   85.471   13.328   60.862   5.1865   63.388   5.0979 -2.525799 7.272448 
1 1 1   33    8    3 o   50.842   3.7751   55.486   7.7921   57.242   10.266   53.099   11.969   51.963   4.7899   49.721   5.8364 2.242821 7.550266 
1 1 1   33    8    4 o   58.487   3.4672   73.298   8.1990   76.484   10.744   68.856   12.688   60.209   4.3264   56.765   5.4192 3.444405 6.934345 
1 1 1   33    8    5 o   64.441   3.2386   88.982   8.4554   95.235   11.227   80.788   12.852   67.270   4.0465   61.611   5.0578 5.659061 6.477273 
1 1 1   33    8    6 o  126.002   2.6776  333.617   13.907  340.545   19.480  326.416   19.861  127.384   3.7078  124.620   3.8640 2.763710 5.355209 
1 1 1   33    8    7 o   43.389   5.7228   43.360   9.2154   44.290   11.125   41.325   16.451   45.283   5.9563   41.495   9.7736 3.788425 11.44555 
1 1 1   33    8    8 o   62.468   3.9697   85.496   9.2973   87.888   11.162   80.076   16.801   64.499   4.1960   60.437   6.7400 4.062199 7.939358 
1 1 1   33    8    9 o   56.109   3.4662   66.861   7.9919   63.796   10.762   70.628   11.933   54.733   4.7674   57.485   5.0330 -2.752235 6.932452 
1 1 1   33    8   10 o   33.830   5.4349   25.540   7.2782   31.892   11.795   21.634   9.2491   37.050   7.9562   30.611   7.4061 6.438406 10.86975 
1 1 1   33    8   11 o   40.062   4.3504   35.338   6.8987   44.002   10.064   27.658   9.4748   45.208   5.3976   34.915   6.8241 10.29279 8.700717 
1 1 1   33    8   12 o   25.576   5.4829   14.950   6.3505   17.748   9.0261   12.207   8.9365   27.639   7.6553   23.514   7.8513 4.124325 10.96571 
1 1 1   33    8   13 o   19.777   5.3667   6.6341   6.1658   5.0024   8.5391   8.4116   8.9124   18.638   7.4143   20.916   7.7610 -2.278311 10.73336 
1 1 1   33    8   14 o   48.825   3.5819   51.227   7.2095   49.659   10.005   52.921   10.398   48.056   5.0479   49.594   5.0833 -1.538765 7.163826 
1 1 1   33    8   15 o   26.954   5.1092   16.790   6.4958   26.871   9.0510   6.0829   9.3283   34.288   6.6400   19.620   7.7669 14.66783 10.21834 
1 1 1   33    8   16 o   58.172   3.5337   73.212   8.3301   73.749   10.858   72.444   12.987   58.688   4.4857   57.656   5.4614 1.032162 7.067417 
1 1 1   33    8   17 o   34.214   6.0677   29.027   8.5554   24.621   13.321   32.120   11.162   31.448   9.4826   36.979   7.5729 -5.531408 12.13542 
1 1 1   33    8   18 o   17.884   5.4801  -0.7632   8.0870 -21.7965   15.695   6.8392   9.4360   15.748   7.6514   20.020   7.8473 -4.272474 10.96012 
1 1 1   33    8   19 o   39.493   6.1955   34.646   9.3828   51.667   16.781   26.905   11.317   45.721   9.2174   33.264   8.2811 12.45655 12.39097 
1 1 1   33    8   20 o   32.494   6.9414   31.924   10.726  -7.3381   31.420   37.103   11.411   25.235   11.854   39.752   7.2263 -14.51708 13.88281 
1 1 1   33    8   21 o   24.957   8.5697   14.903   10.651   0.0000   0.0000   14.903   10.651  ?   ?    24.957   8.5697      ?      ? 
1 1 1   33    8   22 o   27.522   8.6258   13.378   17.487  -7.7874   43.702   17.413   19.081   27.678   13.277   27.366   11.016 0.3112717 17.25153 
1 1 1   33    8   23 o   28.563   8.8806   17.182   17.652   16.371   40.800   17.369   19.580   29.961   13.884   27.166   11.077 2.794764 17.76120 
1 1 1   33    8   24 o   53.599   11.251   81.148   24.079   0.0000   0.0000   81.148   24.079  ?   ?    53.599   11.251      ?      ? 
1 1 1   33    8   25 o   43.375   12.395   59.125   23.282   0.0000   0.0000   59.125   23.282  ?   ?    43.375   12.395      ?      ? 
1 1 1   33    9    0 o   11.361   5.4165  -3.9714   10.375  -3.9714   10.375  -3.9714   10.375   11.361   7.6600   11.361   7.6600 0.000000 0.000000 
1 1 1   33    9    1 o   51.191   4.2387   56.406   8.9423   59.547   12.898   53.498   12.409   52.579   5.9474   49.804   6.0411 2.775776 8.477437 
1 1 1   33    9    2 o   71.991   3.7524  110.478   10.979  111.934   17.071  109.451   14.338   72.187   5.7337   71.795   4.8422 0.3927689 7.504804 
1 1 1   33    9    3 o   58.121   4.2330   75.991   9.0853   80.825   10.919   65.112   16.380   61.882   4.2781   54.360   7.3056 7.522022 8.466044 
1 1 1   33    9    4 o   55.093   3.5480   64.574   7.9507   64.159   10.409   65.156   12.319   55.025   4.5866   55.161   5.4146 -0.1352997 7.096073 
1 1 1   33    9    5 o   60.300   3.3845   78.842   8.2058   86.656   10.848   68.393   12.545   64.102   4.1033   56.499   5.3836 7.603355 6.769045 
1 1 1   33    9    6 o   74.175   3.0078  116.987   9.0597  120.641   11.935  112.020   13.917   75.725   3.8214   72.626   4.6460 3.098648 6.015694 
1 1 1   33    9    7 o   57.078   3.4759   70.071   8.0611   73.501   10.701   65.571   12.257   58.893   4.4054   55.263   5.3776 3.629971 6.951719 
1 1 1   33    9    8 o   42.700   4.7940   43.980   7.5687   57.604   10.060   26.207   11.490   52.025   4.6882   33.375   8.3636 18.64979 9.588000 
1 1 1   33    9    9 o   93.737   2.4855  184.523   9.6009  174.536   13.481  194.801   13.677   91.129   3.5867   96.346   3.4418 -5.217049 4.970942 
1 1 1   33    9   10 o   24.092   5.4771   13.017   6.1909   11.906   8.7889   14.112   8.7219   23.285   7.7861   24.899   7.7053 -1.613256 10.95427 
1 1 1   33    9   11 o   21.335   4.9334   6.3674   6.2763   19.125   8.8996  -6.2558   8.8527   28.710   7.4510   13.959   6.4682 14.75103 9.866842 
1 1 1   33    9   12 f   54.873   3.3287   64.417   7.5164   61.432   10.818   67.203   10.451   53.565   4.8967   56.181   4.5103 -2.616703 6.657350 
1 1 1   33    9   13 o   51.766   3.4395   57.462   7.3403   57.972   10.259   56.928   10.507   52.034   4.7803   51.497   4.9468 0.5375900 6.879087 
1 1 1   33    9   14 o   40.275   4.8919   38.870   7.4805   46.517   9.7498   27.927   11.664   46.428   5.0915   34.122   8.3547 12.30622 9.783873 
1 1 1   33    9   15 o   55.746   4.2052   68.474   9.5607   81.276   13.743   56.468   13.309   61.082   5.4551   50.409   6.4014 10.67296 8.410486 
1 1 1   33    9   16 o   72.526   3.6163  113.668   10.803  122.122   15.628  105.932   14.950   75.152   5.0420   69.900   5.1854 5.251831 7.232628 
1 1 1   33    9   17 o   56.555   4.0803   69.196   9.4239   77.352   14.626   63.406   12.323   59.234   5.9868   53.876   5.5456 5.357197 8.160592 
1 1 1   33    9   18 o   46.120   5.6214   43.444   9.7610   70.576   18.521   33.010   11.486   54.921   8.1764   37.319   7.7168 17.60147 11.24286 
1 1 1   33    9   19 o   68.652   4.0751   97.329   10.977  127.506   19.523   83.378   13.275   75.499   6.2695   61.805   5.2075 13.69401 8.150155 
1 1 1   33    9   20 o   39.857   8.0186   40.158   10.911   49.684   31.350   38.845   11.639   38.497   14.502   41.216   6.8467 -2.718296 16.03712 
1 1 1   33    9   21 o   97.074   4.5851  204.119   18.358   0.0000   0.0000  204.119   18.358  ?   ?    97.074   4.5851      ?      ? 
1 1 1   33    9   22 o   35.492   8.4579   41.971   18.654 -19.4538   42.972   56.233   20.706   26.071   12.666   44.913   11.213 -18.84152 16.91573 
1 1 1   33    9   23 o   25.497   8.1993   8.1372   17.061 -13.7307   41.215   12.659   18.742   25.831   12.515   25.163   10.597 0.6676140 16.39850 
1 1 1   33    9   24 o   24.632   10.583   11.401   19.348   0.0000   0.0000   11.401   19.348  ?   ?    24.632   10.583      ?      ? 
1 1 1   33    9   25 o   29.732   11.797   26.340   21.567   0.0000   0.0000   26.340   21.567  ?   ?    29.732   11.797      ?      ? 
1 1 1   33   10    0 o   78.738   3.1968  130.863   14.571  130.863   14.571  130.863   14.571   78.738   4.5209   78.738   4.5209 0.000000 0.000000 
1 1 1   33   10    1 o   56.628   3.9649   69.094   9.2246   62.207   13.018   76.040   13.073   53.672   5.8807   59.584   5.3197 -5.912281 7.929807 
1 1 1   33   10    2 o   64.335   3.5501   88.313   9.4190   88.275   13.423   88.349   13.220   64.304   5.0610   64.366   4.9800 -0.6153107E-01 7.100280 
1 1 1   33   10    3 o   53.026   3.9674   59.912   8.3323   58.352   10.375   62.746   13.985   52.361   4.8041   53.692   6.3151 -1.331654 7.934719 
1 1 1   33   10    4 o   16.875   5.1044  -2.1258   6.4866  -7.8915   8.3379   6.7141   10.324   12.969   6.0965   20.782   8.1887 -7.813663 10.20888 
1 1 1   33   10    5 o   54.586   3.6072   62.609   8.0442   55.436   10.535   72.640   12.458   50.936   5.0146   58.236   5.1867 -7.299755 7.214384 
1 1 1   33   10    6 o   55.730   3.5361   65.874   8.0666   62.427   10.666   70.479   12.330   54.126   4.7778   57.334   5.2142 -3.208336 7.072136 
1 1 1   33   10    7 o   54.147   3.6470   63.240   8.0186   65.397   10.580   60.329   12.292   55.439   4.6270   52.855   5.6385 2.584572 7.293930 
1 1 1   33   10    8 o   61.242   3.2943   80.090   8.2039   81.246   10.794   78.507   12.624   61.939   4.2253   60.544   5.0553 1.394592 6.588565 
1 1 1   33   10    9 o   24.035   5.5306   12.908   6.3329   14.786   8.8293   10.917   9.0884   25.401   7.7336   22.669   7.9084 2.731825 11.06130 
1 1 1   33   10   10 o   49.279   3.4978   52.089   7.0938   55.458   9.9791   48.646   10.086   50.965   4.7474   47.593   5.1382 3.371624 6.995644 
1 1 1   33   10   11 o   24.224   4.8566   11.662   6.2122  -0.8940   8.7915   24.182   8.7793   15.890   6.9758   32.558   6.7591 -16.66772 9.713227 
1 1 1   33   10   12 o   48.979   3.5935   51.707   7.2464   54.533   10.177   48.801   10.321   50.413   4.8944   47.546   5.2629 2.867397 7.187057 
1 1 1   33   10   13 o   99.096   2.5898  207.808   10.541  212.387   14.372  202.475   15.509  100.400   3.4706   97.793   3.8450 2.606880 5.179696 
1 1 1   33   10   14 o   35.094   4.8395   27.884   6.8444   22.160   9.3301   34.554   10.071   30.657   7.4516   39.531   6.1770 -8.873415 9.678918 
1 1 1   33   10   15 o   48.762   3.9524   51.972   7.8023   52.049   10.137   51.860   12.221   49.077   5.0079   48.447   6.1162 0.6302147 7.904870 
1 1 1   33   10   16 o   21.278   5.9874   6.4086   7.8986   12.553   12.348   2.1532   10.276   24.336   9.1143   18.220   7.7669 6.116165 11.97482 
1 1 1   33   10   17 o   29.424   6.8486   20.544   9.1460   24.743   16.234   18.591   11.070   31.132   10.581   27.715   8.6979 3.416651 13.69726 
1 1 1   33   10   18 o   28.126   6.8685   18.472   8.9617   22.243   17.103   17.045   10.522   29.680   10.794   26.573   8.4965 3.107321 13.73704 
1 1 1   33   10   19 o   34.437   7.2997   34.251   10.573   17.677   28.155   36.972   11.408   29.271   12.671   39.602   7.2516 -10.33141 14.59945 
1 1 1   33   10   20 o   59.307   7.9603  106.230   13.859   75.701   33.033  112.751   15.267   46.918   15.060   71.697   5.1629 -24.77916 15.92056 
1 1 1   33   10   21 o   40.859   7.2952   39.642   11.843   0.0000   0.0000   39.642   11.843  ?   ?    40.859   7.2952      ?      ? 
1 1 1   33   10   22 o   36.091   8.7825   45.344   18.511   0.3418   45.203   54.412   20.291   28.283   13.550   43.900   11.177 -15.61687 17.56509 
1 1 1   33   10   23 o   28.186   9.1550  -0.0176   16.669   65.468   43.621 -11.2157   18.038   37.849   16.065   18.523   8.7852 19.32635 18.31003 
1 1 1   33   10   24 o   34.536   11.885   37.366   20.492   0.0000   0.0000   37.366   20.492  ?   ?    34.536   11.885      ?      ? 
1 1 1   33   10   25 o   19.200   9.0861  -9.5287   19.083   0.0000   0.0000  -9.5287   19.083  ?   ?    19.200   9.0861      ?      ? 
1 1 1   33   11    0 o   17.760   7.0582   9.7206   11.077   9.7206   11.077   9.7206   11.077   17.760   9.9817   17.760   9.9817 0.000000 0.000000 
1 1 1   33   11    1 o   68.795   3.4317  100.944   9.7183   93.000   13.615  109.195   13.876   65.964   5.0043   71.627   4.6971 -5.663002 6.863358 
1 1 1   33   11    2 o   32.003   5.3421   24.473   7.2504   31.222   9.5597   15.333   11.124   37.889   6.1174   26.118   8.7596 11.77112 10.68429 
1 1 1   33   11    3 o  112.932   2.5625  267.269   11.777  263.137   15.397  273.093   18.281  112.049   3.3317  113.815   3.8943 -1.765778 5.125020 
1 1 1   33   11    4 o   59.012   3.4055   74.803   8.1426   77.410   10.690   71.200   12.567   60.449   4.2878   57.576   5.2919 2.873814 6.811025 
1 1 1   33   11    5 o   38.000   4.8446   32.048   7.2115   29.285   9.3107   36.192   11.401   36.107   6.4906   39.893   7.1940 -3.785831 9.689234 
1 1 1   33   11    6 o   48.724   5.3760   56.162   8.9465   58.909   10.462   48.686   17.260   52.527   4.8289   44.921   9.6066 7.606194 10.75198 
1 1 1   33   11    7 o   19.890   5.7065   4.9245   7.3209   2.9201   10.024   7.2162   10.718   18.607   7.7878   21.173   8.3432 -2.566141 11.41308 
1 1 1   33   11    8 o   53.882   3.8724   62.199   8.2817   60.926   10.355   64.459   13.795   53.441   4.6981   54.323   6.1571 -0.8817406 7.744824 
1 1 1   33   11    9 o   35.656   4.7118   28.462   6.7359   22.670   9.2901   34.883   9.7809   31.287   7.3280   40.025   5.9249 -8.737762 9.423591 
1 1 1   33   11   10 o   82.177   2.6785  142.460   9.0749  139.167   12.619  145.987   13.060   81.205   3.7678   83.150   3.8081 -1.945412 5.357046 
1 1 1   33   11   11 o   42.747   3.9996   39.805   7.0410   42.018   9.9296   37.568   9.9855   44.016   5.4696   41.479   5.8368 2.536919 7.999100 
1 1 1   33   11   12 o   21.736   5.4965   9.8138   6.3229   7.1905   9.0187   12.350   8.8671   20.068   7.7253   23.405   7.8207 -3.336622 10.99292 
1 1 1   33   11   13 o   40.347   4.4021   36.776   7.0566   41.487   9.7687   31.635   10.205   43.646   5.4266   37.049   6.9331 6.597649 8.804293 
1 1 1   33   11   14 o   46.381   3.8012   46.611   7.1955   38.211   9.8543   56.206   10.531   41.761   5.7212   51.001   5.0065 -9.240158 7.602500 
1 1 1   33   11   15 o   27.044   5.4010   18.070   6.9327   25.165   8.9287   7.2989   11.001   33.012   6.7844   21.076   8.4057 11.93637 10.80205 
1 1 1   33   11   16 o   15.276   4.8233 -10.0723   7.4686 -32.8997   11.763   5.3452   9.6671   11.240   5.6527   19.311   7.8170 -8.070926 9.646659 
1 1 1   33   11   17 o   67.363   4.2569   96.293   11.161  114.706   19.926   87.876   13.473   71.198   6.7857   63.528   5.1419 7.670208 8.513767 
1 1 1   33   11   18 o   37.321   6.2928   35.657   9.3300   30.707   16.601   37.942   11.280   33.773   10.659   40.869   6.6919 -7.096092 12.58553 
1 1 1   33   11   19 o   43.726   7.3845   58.979   11.358   35.589   29.258   63.130   12.324   34.074   13.667   53.377   5.5981 -19.30269 14.76907 
1 1 1   33   11   20 f   19.157   6.3526  -2.9860   10.052 -38.9370   30.104   1.5254   10.664   20.380   10.044   17.933   7.7807 2.446621 12.70522 
1 1 1   33   11   21 o   48.208   6.6703   53.422   13.263   0.0000   0.0000   53.422   13.263  ?   ?    48.208   6.6703      ?      ? 
1 1 1   33   11   22 o   33.602   9.0638   37.800   18.123   17.560   41.786   42.490   20.114   29.622   13.835   37.582   11.713 -7.960857 18.12766 
1 1 1   33   11   23 o   55.705   10.059   83.615   22.259   0.0000   0.0000   83.615   22.259  ?   ?    55.705   10.059      ?      ? 
1 1 1   33   12    0 o  102.410   2.8745  219.990   17.109  219.990   17.109  219.990   17.109  102.410   4.0652  102.410   4.0652 0.000000 0.000000 
1 1 1   33   12    1 o   67.331   3.2181   95.746   8.8063   92.568   11.437  100.374   13.802   66.123   4.1937   68.539   4.8824 -2.416298 6.436201 
1 1 1   33   12    2 o   72.771   3.0570  111.004   9.0370  105.153   11.680  119.730   14.264   70.548   4.0142   74.993   4.6116 -4.445244 6.113958 
1 1 1   33   12    3 o   47.721   4.0508   49.552   7.8215   50.658   10.207   47.979   12.173   48.609   5.0914   46.833   6.3019 1.775528 8.101601 
1 1 1   33   12    4 o   16.211   5.0549  -4.0741   6.6948  -9.7481   8.6360   4.4711   10.598   12.697   6.0384   19.725   8.1085 -7.028474 10.10988 
1 1 1   33   12    5 o   34.083   5.3341   25.944   7.2769   19.657   9.4546   35.082   11.398   29.022   7.7519   39.144   7.3292 -10.12180 10.66813 
1 1 1   33   12    6 o   21.333   5.6946   8.3053   7.0371   11.653   9.1671   3.5017   10.980   23.167   7.9504   19.499   8.1551 3.667978 11.38927 
1 1 1   33   12    7 o   65.210   3.2881   91.546   8.6396   95.066   11.231   86.444   13.521   67.017   4.0634   63.403   5.1706 3.614124 6.576171 
1 1 1   33   12    8 o   83.205   2.8896  145.129   9.7701  138.025   12.646  155.648   15.389   80.861   3.7917   85.549   4.3614 -4.688431 5.779187 
1 1 1   33   12    9 o   27.395   5.5043   17.568   6.5801   20.726   9.3436   14.460   9.2683   29.723   7.5939   25.067   7.9700 4.656473 11.00854 
1 1 1   33   12   10 o   51.473   3.4857   56.971   7.3964   54.739   10.297   59.350   10.631   50.423   4.9513   52.523   4.9076 -2.100315 6.971329 
1 1 1   33   12   11 o   69.948   2.8836  104.056   8.1625   79.527   11.216  131.678   11.902   60.972   4.4600   78.924   3.6563 -17.95175 5.767155 
1 1 1   33   12   12 o   36.255   5.2512   30.651   7.5795   33.506   11.099   28.156   10.375   37.903   7.3655   34.607   7.4866 3.296204 10.50234 
1 1 1   33   12   13 o   93.088   2.6285  182.725   10.067  174.114   13.662  192.953   14.890   90.740   3.6505   95.436   3.7829 -4.695572 5.257010 
1 1 1   33   12   14 o  102.098   2.8233  218.711   11.574  209.445   14.644  234.136   18.894   99.562   3.5660  104.633   4.3781 -5.070587 5.646604 
1 1 1   33   12   15 o   29.417   6.3757   21.308   8.4252   21.002   12.926   21.535   11.109   29.149   9.4276   29.685   8.5859 -0.5354881 12.75134 
1 1 1   33   12   16 o   76.949   3.4148  128.151   10.782  128.116   16.059  128.179   14.549   76.751   5.0731   77.146   4.5724 -0.3947372 6.829574 
1 1 1   33   12   17 o   48.519   5.8809   60.124   10.376   46.039   17.705   67.494   12.806   41.774   10.333   55.265   5.6184 -13.49074 11.76181 
1 1 1   33   12   18 o   64.907   7.5996  153.200   15.372   46.968   31.921  185.270   17.539   37.322   14.487   92.492   4.5976 -55.17060 15.19929 
1 1 1   33   12   19 o   25.822   7.8094   8.0352   10.518   28.762   28.698   4.8190   11.305   31.933   13.255   19.711   8.2614 12.22267 15.61885 
1 1 1   33   12   20 o   27.630   7.2607   20.120   10.869   0.6152   27.643   23.687   11.822   24.876   11.492   30.384   8.8767 -5.507597 14.52149 
1 1 1   33   12   21 o   58.757   7.9224  112.010   14.104   70.269   32.653  121.584   15.638   43.347   14.998   74.167   5.1121 -30.81961 15.84485 
1 1 1   33   12   22 f   40.112   8.3298   61.496   19.234  -0.1844   44.663   75.540   21.311   27.391   13.211   52.832   10.149 -25.44106 16.65950 
1 1 1   33   12   23 o   51.665   11.219   76.861   23.222   0.0000   0.0000   76.861   23.222  ?   ?    51.665   11.219      ?      ? 
1 1 1   33   13    0 o   37.018   6.3785   34.182   11.933   34.182   11.933   34.182   11.933   37.018   9.0205   37.018   9.0205 0.000000 0.000000 
1 1 1   33   13    1 o   25.108   5.0381   13.485   6.9102   25.820   9.1182  -3.1601   10.592   33.670   6.8001   16.546   7.4357 17.12367 10.07627 
1 1 1   33   13    2 o   65.830   3.2607   92.726   8.7000   94.398   11.372   90.368   13.509   66.760   4.1301   64.899   5.0470 1.860825 6.521456 
1 1 1   33   13    3 o   35.346   5.2812   28.797   7.3290   28.465   9.4339   29.303   11.640   35.427   6.7018   35.265   8.1639 0.1621475 10.56238 
1 1 1   33   13    4 o   93.746   2.7196  184.216   10.360  177.991   13.446  193.311   16.253   91.976   3.5445   95.517   4.1257 -3.540611 5.439255 
1 1 1   33   13    5 o   35.243   5.0379   26.871   7.2655   14.078   9.4348   45.511   11.389   24.861   8.0558   45.625   6.0521 -20.76382 10.07590 
1 1 1   33   13    6 o   78.570   2.9717  131.723   9.4646  134.826   12.393  127.379   14.661   79.912   3.7601   77.228   4.6027 2.684151 5.943345 
1 1 1   33   13    7 o   21.161   5.6382   8.5247   6.7458   10.278   8.8825   6.1361   10.369   22.038   7.8077   20.285   8.1361 1.753193 11.27640 
1 1 1   33   13    8 o   74.455   3.1686  122.648   9.3272  139.537   12.199   98.885   14.471   81.291   3.6386   67.620   5.1886 13.67040 6.337266 
1 1 1   33   13    9 o   21.165   5.3892   8.7084   6.3412   13.666   8.7647   3.2626   9.1859   24.324   7.7522   18.005   7.4886 6.318911 10.77849 
1 1 1   33   13   10 o   53.753   3.3905   62.126   7.5118   59.246   10.429   65.231   10.829   52.448   4.8212   55.059   4.7685 -2.611015 6.781050 
1 1 1   33   13   11 o   69.748   3.0293  104.991   8.6074  117.213   11.818   91.183   12.561   74.345   3.8542   65.150   4.6747 9.194344 6.058663 
1 1 1   33   13   12 o   13.759   4.5037  -6.0903   6.1262  -2.9247   8.3592  -9.7634   9.0043   14.561   6.5688   12.956   6.1631 1.604942 9.007384 
1 1 1   33   13   13 o   87.570   2.6865  162.615   9.6819  162.798   13.271  162.408   14.157   87.704   3.6687   87.436   3.9256 0.2674561 5.373055 
1 1 1   33   13   14 f   31.458   5.6209   23.347   7.1659   21.329   9.1732   26.506   11.478   29.965   7.4532   32.951   8.4158 -2.985966 11.24172 
1 1 1   33   13   15 o  104.750   3.0747  235.791   13.211  206.186   18.503  266.574   18.868   97.802   4.5871  111.697   4.0956 -13.89538 6.149406 
1 1 1   33   13   16 f   40.275   5.6402   40.180   8.9290   32.276   13.956   45.657   11.618   35.470   9.3917   45.080   6.2485 -9.610504 11.28047 
1 1 1   33   13   17 o   56.467   7.6063   92.912   12.549   69.696   30.255   97.736   13.792   46.052   14.368   66.883   4.9996 -20.83133 15.21266 
1 1 1   33   13   18 o   46.623   7.4925   50.654   10.967   71.076   27.985   46.948   11.921   47.704   13.575   45.541   6.3465 2.162277 14.98491 
1 1 1   33   13   19 o   18.592   6.2253  -4.7855   10.037 -33.2403   28.115  -0.6295   10.745   20.093   9.8636   17.092   7.5978 3.000788 12.45061 
1 1 1   33   13   20 f   38.323   8.2811   37.628   11.628   57.113   29.288   33.981   12.669   40.102   14.181   36.543   8.5565 3.558945 16.56221 
1 1 1   33   13   21 o   56.480   7.7863  100.710   13.691   69.769   31.072  108.163   15.251   43.327   14.639   69.633   5.3103 -26.30589 15.57265 
1 1 1   33   13   22 o   23.226   8.0069  -9.0360   16.838   10.229   43.286 -12.4710   18.278   28.175   13.433   18.277   8.7180 9.897566 16.01375 
1 1 1   33   14    0 o   15.847   6.3553   7.5836   9.0895   7.5836   9.0895   7.5836   9.0895   15.847   8.9878   15.847   8.9878 0.000000 0.000000 
1 1 1   33   14    1 o   49.669   3.8820   52.177   7.8069   46.977   9.9583   60.470   12.575   46.673   5.1731   52.664   5.7895 -5.990551 7.763968 
1 1 1   33   14    2 o   72.529   3.1334  113.655   9.1454  120.332   11.939  104.172   14.227   75.439   3.8370   69.619   4.9548 5.819656 6.266841 
1 1 1   33   14    3 o   41.412   4.7087   39.460   7.5235   42.900   9.7195   34.319   11.883   44.536   5.2913   38.287   7.7903 6.249710 9.417386 
1 1 1   33   14    4 o   47.429   4.0653   49.939   7.7336   53.684   10.112   44.663   12.004   49.965   4.9068   44.893   6.4830 5.071754 8.130578 
1 1 1   33   14    5 o   33.376   5.2537   25.636   8.0769   7.2314   11.170   45.799   11.692   21.204   8.4658   45.548   6.2239 -24.34426 10.50748 
1 1 1   33   14    6 o   86.168   2.8564  156.929   9.9963  153.030   12.983  162.605   15.665   85.065   3.7006   87.271   4.3521 -2.205887 5.712736 
1 1 1   33   14    7 o   25.933   5.7685   15.750   6.7956   15.501   8.7642   16.125   10.761   25.688   7.6793   26.177   8.6098 -0.4887791 11.53693 
1 1 1   33   14    8 o   69.627   3.1143  103.610   8.8178  103.244   11.548  104.122   13.656   69.688   4.0178   69.565   4.7595 0.1231232 6.228592 
1 1 1   33   14    9 o   28.917   4.7037   17.862   6.4593   3.8624   8.7172   34.909   9.6190   17.971   7.3667   39.862   5.8506 -21.89118 9.407351 
1 1 1   33   14   10 o   54.083   3.5066   63.147   7.7652   63.082   10.386   63.230   11.693   54.200   4.6460   53.966   5.2535 0.2337532 7.013229 
1 1 1   33   14   11 o   56.624   3.3666   68.207   7.7800   55.854   10.456   83.531   11.645   50.831   4.9873   62.417   4.5236 -11.58614 6.733188 
1 1 1   33   14   12 o   26.308   5.5519   16.086   6.5422   12.452   8.8080   20.559   9.7709   23.356   7.7946   29.261   7.9080 -5.904701 11.10375 
1 1 1   33   14   13 o   48.294   3.7235   51.046   7.3890   53.947   10.243   47.899   10.669   49.869   4.9802   46.719   5.5367 3.149384 7.446991 
1 1 1   33   14   14 o   85.914   3.1978  157.337   11.254  185.182   16.854  134.933   15.118   92.794   4.4037   79.033   4.6379 13.76126 6.395561 
1 1 1   33   14   15 o   49.208   4.5203   53.807   9.1001   62.717   13.949   47.205   12.007   52.679   6.4199   45.737   6.3652 6.942699 9.040529 
1 1 1   33   14   16 o   30.714   6.3055   24.323   8.5107   20.841   13.375   26.692   11.032   28.556   9.6049   32.872   8.1723 -4.316034 12.61107 
1 1 1   33   14   17 o   54.832   7.5947   91.387   12.627   61.518   29.742   97.954   13.946   42.797   14.323   66.867   5.0567 -24.06960 15.18947 
1 1 1   33   14   18 o   64.040   7.2028  112.324   13.295   94.303   30.576  116.526   14.764   55.132   13.544   72.948   4.9072 -17.81516 14.40559 
1 1 1   33   14   19 o   44.329   7.7685   52.595   12.188   60.813   27.778   50.636   13.563   42.200   13.831   46.457   7.0785 -4.256596 15.53694 
1 1 1   33   14   20 o   27.236   6.9184   20.903   11.063 -10.4801   27.151   27.150   12.114   22.303   10.635   32.168   8.8519 -9.864515 13.83684 
1 1 1   33   14   21 o   30.554   7.9460   26.102   11.508   27.485   29.606   25.855   12.490   30.052   13.001   31.057   9.1387 -1.004862 15.89191 
1 1 1   33   15    0 o   36.691   5.1883   31.980   9.8522   31.980   9.8522   31.980   9.8522   36.691   7.3373   36.691   7.3373 0.000000 0.000000 
1 1 1   33   15    1 o  103.303   2.4378  224.491   10.372  209.300   14.316  241.276   15.049   99.609   3.4846  106.998   3.4100 -7.389252 4.875510 
1 1 1   33   15    2 o   29.219   5.5822   21.323   7.2439   27.205   9.3576   12.526   11.443   34.347   6.8460   24.091   8.8190 10.25591 11.16435 
1 1 1   33   15    3 o   73.395   3.0689  113.403   9.1953  103.994   12.008  126.741   14.297   69.867   4.1672   76.923   4.5064 -7.055359 6.137870 
1 1 1   33   15    4 o   58.165   3.5039   71.578   8.3036   63.981   10.766   82.733   13.045   54.518   4.7881   61.811   5.1171 -7.292793 7.007847 
1 1 1   33   15    5 o   83.996   2.8882  150.027   9.8317  149.531   12.774  150.746   15.400   84.068   3.6840   83.923   4.4491 0.1447296 5.776340 
1 1 1   33   15    6 o   60.856   3.4717   81.452   8.4450   87.911   10.988   72.132   13.200   64.246   4.1468   57.466   5.5692 6.779282 6.943440 
1 1 1   33   15    7 o   36.402   5.1312   32.406   7.3279   39.385   9.5390   22.359   11.446   42.517   5.4397   30.286   8.7021 12.23092 10.26239 
1 1 1   33   15    8 o   88.250   2.7998  163.785   10.035  156.343   12.978  174.848   15.823   85.970   3.6602   90.530   4.2377 -4.559540 5.599614 
1 1 1   33   15    9 o   19.947   5.4776   6.8097   6.3754   5.5718   8.3115   8.5792   9.9370   18.647   7.3473   21.248   8.1261 -2.600790 10.95520 
1 1 1   33   15   10 o   63.237   3.1361   85.133   8.1510   78.303   10.995   93.469   12.146   60.454   4.4096   66.020   4.4604 -5.566837 6.272148 
1 1 1   33   15   11 o   50.753   3.6469   55.605   7.5931   48.416   10.281   64.230   11.262   47.103   5.2923   54.403   5.0191 -7.300362 7.293787 
1 1 1   33   15   12 o   43.943   4.0314   42.967   7.2201   49.333   10.113   36.348   10.311   47.555   5.1563   40.331   6.1986 7.223236 8.062878 
1 1 1   33   15   13 o   26.536   5.7723   17.500   7.1200   20.812   9.1983   12.548   11.246   29.372   7.5512   23.701   8.7327 5.670757 11.54468 
1 1 1   33   15   14 o   51.085   4.4276   59.735   9.1269   48.833   13.301   69.435   12.547   46.063   7.0013   56.107   5.4218 -10.04397 8.855220 
1 1 1   33   15   15 o   14.821   4.8459  -7.3286   7.3270 -17.4757   11.436  -0.2625   9.5429   13.213   6.4446   16.430   7.2387 -3.216817 9.691787 
1 1 1   33   15   16 o   30.639   7.2542   25.757   9.9845   14.295   26.660   27.627   10.768   27.732   12.162   33.546   7.9114 -5.813503 14.50845 
1 1 1   33   15   17 o   56.738   7.5713   95.147   12.774   71.502   29.872  100.438   14.132   45.927   14.268   67.549   5.0723 -21.62142 15.14261 
1 1 1   33   15   18 o   31.160   8.0900   18.284   10.744   53.149   26.724   11.563   11.733   39.468   13.573   22.851   8.8074 16.61755 16.18004 
1 1 1   33   15   19 o   46.052   7.2353   71.425   12.722   35.178   28.199   80.688   14.255   32.401   13.262   59.703   5.7892 -27.30165 14.47055 
1 1 1   33   15   20 o   22.943   7.2533   6.4096   10.782   9.8664   28.130   5.8144   11.673   25.962   11.845   19.924   8.3751 6.038702 14.50659 
1 1 1   33   16    0 o   64.126   3.0349   87.396   11.235   87.396   11.235   87.396   11.235   64.126   4.2921   64.126   4.2921 0.000000 0.000000 
1 1 1   33   16    1 o   53.368   3.4752   61.782   7.5293   74.949   10.765   49.173   10.535   59.198   4.4090   47.539   5.3730 11.65881 6.950405 
1 1 1   33   16    2 o   47.951   4.0792   50.146   7.9372   48.852   10.295   52.042   12.462   47.433   5.2625   48.469   6.2341 -1.035786 8.158324 
1 1 1   33   16    3 o   22.554   5.3837   6.7961   6.9399  -3.8674   9.0271   22.206   10.852   14.821   6.7417   30.288   8.3956 -15.46640 10.76742 
1 1 1   33   16    4 o   19.449   5.4511   5.4925   6.8069   9.7808   8.8724  -0.6425   10.612   21.582   7.7860   17.316   7.6311 4.265928 10.90211 
1 1 1   33   16    5 o   70.582   3.2419  108.893   9.1793  117.785   12.019   96.444   14.220   74.480   3.9125   66.683   5.1703 7.796547 6.483831 
1 1 1   33   16    6 o   87.847   2.8754  165.447   10.247  171.558   13.497  157.133   15.743   90.053   3.6340   85.642   4.4570 4.411301 5.750714 
1 1 1   33   16    7 o   50.198   3.8763   53.971   7.9367   47.687   10.332   63.016   12.397   46.769   5.3561   53.626   5.6048 -6.856419 7.752559 
1 1 1   33   16    8 o   28.871   5.7670   19.906   7.0810   18.468   9.2055   21.989   11.082   27.782   7.7438   29.961   8.5480 -2.178442 11.53407 
1 1 1   33   16    9 o   88.582   2.6779  166.914   9.7468  169.197   13.280  164.249   14.350   89.363   3.6031   87.802   3.9627 1.561287 5.355857 
1 1 1   33   16   10 o   74.677   2.8838  119.669   8.8333  125.080   12.070  113.427   12.963   76.665   3.8170   72.689   4.3237 3.976204 5.767514 
1 1 1   33   16   11 o   25.359   5.3418   14.504   6.5745   6.1263   9.0617   23.816   9.5533   19.221   7.6404   31.498   7.4674 -12.27686 10.68355 
1 1 1   33   16   12 o   91.824   2.9812  183.147   11.137  164.730   16.597  198.231   15.020   87.212   4.6141   96.435   3.7763 -9.222458 5.962410 
1 1 1   33   16   13 o   85.715   3.2292  159.335   11.392  149.535   16.223  168.870   16.002   82.951   4.7417   88.479   4.3850 -5.527596 6.458497 
1 1 1   33   16   14 o   29.629   6.0162   22.525   8.2081   13.734   12.311   29.561   11.013   24.453   9.1120   34.804   7.8583 -10.35030 12.03248 
1 1 1   33   16   15 o   37.734   6.6191   37.479   9.9217   35.169   17.274   38.616   12.121   35.474   10.821   39.995   7.6261 -4.520775 13.23819 
1 1 1   33   16   16 o   37.208   6.6255   45.731   11.190   7.3836   27.261   53.502   12.272   25.872   11.748   48.544   6.1294 -22.67118 13.25098 
1 1 1   33   16   17 o   35.723   7.5307   37.475   11.019   31.978   26.874   38.586   12.081   31.768   12.968   39.679   7.6597 -7.910517 15.06147 
1 1 1   33   16   18 o   39.803   6.8511   52.148   15.103   0.0608   27.084   75.657   18.195   23.966   11.175   55.640   7.9288 -31.67422 13.70220 
1 1 1   33   16   19 o   20.822   8.5461   7.7864   11.750   0.0000   0.0000   7.7864   11.750  ?   ?    20.822   8.5461      ?      ? 
1 1 1   33   17    0 o   21.774   6.8000   15.064   9.0799   15.064   9.0799   15.064   9.0799   21.774   9.6167   21.774   9.6167 0.000000 0.000000 
1 1 1   33   17    1 o   28.235   5.4648   19.027   6.5482   18.492   9.1441   19.590   9.3817   27.844   7.7026   28.626   7.7542 -0.7819748 10.92967 
1 1 1   33   17    2 o   61.454   3.1296   81.101   7.8795   92.697   11.254   69.949   11.036   65.917   4.1392   56.990   4.6952 8.927906 6.259272 
1 1 1   33   17    3 o   74.514   3.1079  119.702   9.3651  123.018   12.222  114.987   14.575   76.073   3.8954   72.955   4.8438 3.117989 6.215824 
1 1 1   33   17    4 o   21.198   5.7686   8.1246   6.9871   6.2007   8.9653   11.101   11.151   19.339   7.6274   23.057   8.6562 -3.718172 11.53722 
1 1 1   33   17    5 f   40.311   4.8837   38.224   7.6333   42.209   9.9499   32.524   11.900   43.878   5.4981   36.744   8.0730 7.133610 9.767415 
1 1 1   33   17    6 o   23.943   5.4236   9.6200   6.9307  -0.5241   8.9370   24.927   10.978   15.958   7.0188   31.928   8.2703 -15.96959 10.84717 
1 1 1   33   17    7 o   48.494   3.9976   50.461   7.8840   42.030   10.231   62.786   12.370   43.627   5.6860   53.362   5.6207 -9.735104 7.995163 
1 1 1   33   17    8 o   50.165   3.7056   54.927   7.6479   52.516   10.381   57.789   11.310   49.024   5.1340   51.306   5.3450 -2.281403 7.411229 
1 1 1   33   17    9 o   40.889   4.2847   37.476   7.1996   38.219   9.8504   36.623   10.549   41.481   5.7575   40.297   6.3470 1.183979 8.569339 
1 1 1   33   17   10 o   48.675   3.7498   52.101   7.5020   51.921   10.198   52.313   11.075   48.711   5.0761   48.639   5.5205 0.7194138E-01 7.499551 
1 1 1   33   17   11 o   91.527   3.0188  179.927   11.289  183.042   17.228  177.583   14.943   91.967   4.5420   91.087   3.9777 0.8804169 6.037513 
1 1 1   33   17   12 o   54.714   4.2937   68.436   9.4702   57.780   14.090   77.218   12.790   50.179   6.8080   59.249   5.2339 -9.070351 8.587316 
1 1 1   33   17   13 f   25.151   6.3227   14.533   8.3376   20.631   12.627   9.8195   11.102   28.335   9.3267   21.968   8.5391 6.367548 12.64535 
1 1 1   33   17   14 o   72.288   5.1862  115.425   15.463  115.425   15.463   0.0000   0.0000   72.288   5.1862  ?   ?       ?      ? 
1 1 1   33   17   15 o   36.959   6.3721   43.979   10.957   9.5669   22.802   54.309   12.493   25.146   11.128   48.771   6.2108 -23.62520 12.74427 
1 1 1   33   17   16 o   26.700   7.0929   19.159   10.489   0.5948   26.636   22.565   11.410   24.017   11.160   29.384   8.7573 -5.367569 14.18571 
1 1 1   33   17   17 o   85.527   5.9348  194.186   16.280  152.547   33.269  207.296   18.668   73.885   10.917   97.169   4.6580 -23.28411 11.86960 
1 1 1   33   17   18 o   27.704   7.0451   22.152   10.822  -0.7990   26.820   26.616   11.828   23.614   11.047   31.795   8.7460 -8.181692 14.09015 
1 1 1   33   18    0 o   17.944   6.5861   10.733   8.9322   10.733   8.9322   10.733   8.9322   17.944   9.3141   17.944   9.3141 0.000000 0.000000 
1 1 1   33   18    1 o   74.839   2.7755  119.460   8.5663  118.401   12.157  120.503   12.072   74.489   3.9571   75.188   3.8929 -0.6989822 5.550967 
1 1 1   33   18    2 o   46.694   3.7319   47.753   7.1861   47.459   10.069   48.059   10.259   46.565   5.2427   46.822   5.3124 -0.2571526 7.463750 
1 1 1   33   18    3 o   29.932   5.3241   21.687   6.6207   24.947   9.2198   18.217   9.5132   32.491   7.0802   27.373   7.9533 5.117245 10.64816 
1 1 1   33   18    4 o   38.695   4.4733   34.108   6.9585   35.185   9.5714   32.902   10.134   39.789   5.8324   37.602   6.7842 2.187611 8.946645 
1 1 1   33   18    5 f   53.136   3.7282   60.957   8.0377   56.572   10.334   67.672   12.789   50.968   4.9158   55.305   5.6066 -4.336575 7.456459 
1 1 1   33   18    6 o   61.561   3.5561   85.286   8.6872   96.368   11.409   69.997   13.401   67.031   4.1268   56.091   5.7926 10.94058 7.112270 
1 1 1   33   18    7 o   71.128   3.3589  106.827   9.4778   99.119   11.719  121.403   16.115   67.931   4.1827   74.325   5.2568 -6.394707 6.717804 
1 1 1   33   18    8 o   52.929   3.5920   60.860   7.7603   49.907   10.534   73.856   11.475   47.581   5.3680   58.276   4.7742 -10.69548 7.183910 
1 1 1   33   18    9 o   61.928   3.2464   83.397   8.2580   88.022   11.415   78.318   11.961   63.901   4.3311   59.956   4.8370 3.945412 6.492743 
1 1 1   33   18   10 o   23.253   5.8145   12.469   7.2691   16.484   9.4717   6.7147   11.338   25.947   8.0297   20.560   8.4116 5.387440 11.62892 
1 1 1   33   18   11 o   60.233   4.1306   82.806   9.4380   76.696   16.551   85.750   11.489   57.530   6.9755   62.936   4.4260 -5.405792 8.261229 
1 1 1   33   18   12 o   40.358   5.5378   41.478   8.7999   28.083   13.217   52.145   11.794   32.637   9.3433   48.080   5.9476 -15.44218 11.07568 
1 1 1   33   18   13 f   38.890   5.6854   37.824   8.7895   34.689   12.956   40.496   11.963   36.798   8.6778   40.982   7.3478 -4.183334 11.37073 
1 1 1   33   18   14 o   21.310   6.3617   7.1217   8.8215   6.7860   17.128   7.2429   10.292   22.562   9.8248   20.059   8.0844 2.503733 12.72341 
1 1 1   33   18   15 o   26.947   7.5526   16.545   9.9995   24.695   25.785   15.103   10.848   29.320   12.393   24.574   8.6365 4.746143 15.10518 
1 1 1   33   18   16 o   47.795   7.1549   79.603   12.452   35.604   28.663   89.839   13.825   32.202   13.297   63.388   5.2880 -31.18569 14.30976 
1 1 1   33   19    0 o   32.394   5.7797   26.651   9.4441   26.651   9.4441   26.651   9.4441   32.394   8.1737   32.394   8.1737 0.000000 0.000000 
1 1 1   33   19    1 o   42.509   3.9952   40.072   6.9928   37.091   9.7516   43.227   10.033   40.805   5.7942   44.213   5.5021 -3.407394 7.990341 
1 1 1   33   19    2 o   62.415   3.0738   83.944   7.8891   75.772   11.016   92.549   11.303   59.192   4.5122   65.637   4.1754 -6.444912 6.147639 
1 1 1   33   19    3 o   15.115   4.7533  -3.0260   6.2126  -8.9897   8.7117   3.1453   8.8620   12.765   6.0692   17.465   7.3172 -4.700243 9.506659 
1 1 1   33   19    4 o   42.674   4.0136   40.416   7.0587   38.354   9.8204   42.619   10.153   41.517   5.7350   43.830   5.6164 -2.313152 8.027111 
1 1 1   33   19    5 o   33.179   5.7212   27.607   7.6407   29.281   9.6555   24.802   12.497   35.274   6.8838   31.084   9.1401 4.190651 11.44237 
1 1 1   33   19    6 o   69.637   3.3664  101.721   9.3524   91.405   11.608  120.811   15.790   65.108   4.3225   74.166   5.1620 -9.057693 6.732780 
1 1 1   33   19    7 o   17.583   5.2836   2.5422   6.6908   3.9293   9.7016   1.2840   9.2396   18.346   7.6685   16.821   7.2703 1.524290 10.56711 
1 1 1   33   19    8 o   50.736   3.7261   57.067   7.7563   61.713   10.795   52.109   11.151   53.089   4.9303   48.384   5.5880 4.704769 7.452111 
1 1 1   33   19    9 o   53.418   3.5393   62.410   7.7738   56.224   10.621   69.547   11.409   50.520   5.0972   56.316   4.9118 -5.796177 7.078652 
1 1 1   33   19   10 o   22.722   5.5119   11.821   6.5283   16.885   9.1571   6.5865   9.3095   26.087   7.8611   19.357   7.7285 6.730631 11.02388 
1 1 1   33   19   11 o  104.650   3.0144  237.740   12.975  218.672   18.371  256.721   18.328  100.237   4.4435  109.064   4.0745 -8.827492 6.028817 
1 1 1   33   19   12 o   31.172   5.8316   26.004   8.3707   12.824   12.618   36.365   11.187   23.597   9.1225   38.748   7.2671 -15.15130 11.66320 
1 1 1   33   19   13 o   64.307   4.8135  100.096   11.674   86.276   20.023  107.211   14.369   59.046   8.2221   69.569   5.0077 -10.52261 9.627021 
1 1 1   33   19   14 o   33.377   6.9990   30.550   9.8882   32.226   17.989   29.824   11.837   32.800   11.138   33.953   8.4782 -1.153057 13.99807 
1 1 1   33   19   15 o   28.398   7.6659   20.454   10.321   25.738   27.071   19.556   11.164   29.478   12.587   27.319   8.7536 2.159266 15.33174 
1 1 1   33   20    0 o   12.410   5.8372  -1.5211   11.340  -1.5211   11.340  -1.5211   11.340   12.410   8.2551   12.410   8.2551 0.000000 0.000000 
1 1 1   33   20    1 o   40.993   4.8363   39.234   7.8028   39.807   10.140   38.402   12.218   42.162   5.8311   39.824   7.7174 2.338005 9.672664 
1 1 1   33   20    2 o   39.023   4.8212   35.025   7.3145   54.630   11.103   19.992   9.7225   49.648   5.4223   28.399   7.9734 21.24851 9.642386 
1 1 1   33   20    3 o   27.495   5.0702   17.535   6.5798   30.417   9.5794   6.0299   9.0533   35.981   6.7016   19.009   7.6102 16.97252 10.14032 
1 1 1   33   20    4 o   35.552   4.9632   30.036   7.0152   28.452   9.7041   31.770   10.153   34.524   7.0533   36.579   6.9845 -2.054932 9.926320 
1 1 1   33   20    5 o   44.482   4.0275   44.317   7.3704   44.562   10.102   44.039   10.777   44.748   5.4735   44.216   5.9097 0.5316696 8.055073 
1 1 1   33   20    6 o   52.155   3.6109   60.057   7.7595   60.525   10.766   59.551   11.194   52.453   4.9763   51.857   5.2338 0.5958061 7.221885 
1 1 1   33   20    7 o   60.730   3.2858   80.855   8.1857   89.410   11.526   72.150   11.627   64.190   4.3537   57.269   4.9224 6.921673 6.571521 
1 1 1   33   20    8 o   23.385   5.6881   13.134   6.7046   10.694   9.5154   15.541   9.4485   21.771   8.0309   25.000   8.0575 -3.228918 11.37627 
1 1 1   33   20    9 o   40.268   4.5566   37.958   7.1522   50.022   10.367   27.000   9.8799   47.367   5.3066   33.169   7.4088 14.19778 9.113213 
1 1 1   33   20   10 o   34.368   5.5075   32.374   7.8398   18.370   13.109   40.172   9.7820   26.514   9.4752   42.223   5.6172 -15.70857 11.01505 
1 1 1   33   20   11 o   30.185   6.3215   23.272   8.3376   29.983   13.270   18.894   10.717   33.366   9.2964   27.005   8.5687 6.361917 12.64305 
1 1 1   33   20   12 o   53.956   5.4555   71.891   10.865   67.566   18.802   74.060   13.313   50.669   9.3410   57.244   5.6387 -6.575020 10.91098 
1 1 1   33   21    0 o   18.944   6.7435   12.306   9.1922   12.306   9.1922   12.306   9.1922   18.944   9.5368   18.944   9.5368 0.000000 0.000000 
1 1 1   33   21    1 o   31.511   5.2183   24.334   6.6628   24.911   9.4571   23.765   9.3886   31.919   7.3372   31.102   7.4222 0.8172874 10.43662 
1 1 1   33   21    2 o   28.547   5.3150   20.170   6.6015   27.296   9.4228   13.301   9.2514   33.666   7.0139   23.428   7.9876 10.23800 10.62995 
1 1 1   33   21    3 o   68.462   3.3002  102.317   9.1793  100.686   11.967  104.647   14.308   68.137   4.2582   68.787   5.0431 -0.6506271 6.600348 
1 1 1   33   21    4 o   54.468   3.8418   66.567   8.4930   67.662   11.155   65.057   13.100   55.414   4.8806   53.522   5.9345 1.891838 7.683617 
1 1 1   33   21    5 o   55.323   4.0186   68.965   8.9554   69.300   14.226   68.745   11.526   54.908   6.2818   55.738   5.0136 -0.8301888 8.037279 
1 1 1   33   21    6 o   36.478   5.7095   32.680   8.1386   37.186   13.442   30.071   10.226   37.862   8.7786   35.094   7.3026 2.768433 11.41892 
1 1 1   33   21    7 o   19.795   5.5142   7.1156   6.7473   10.973   9.7127   3.5174   9.3802   21.888   8.1058   17.703   7.4781 4.184881 11.02841 
1 1 1   33   21    8 o   51.806   3.7390   60.151   7.9138   50.937   11.112   69.637   11.274   47.460   5.6765   56.151   4.8680 -8.690353 7.477973 
1 1 1   33   21    9 o   22.226   5.9542   7.4967   7.4996   21.452   13.189   0.8279   9.1171   28.152   9.5373   16.300   7.1310 11.85239 11.90843 
1 1 1   33   21   10 o   39.526   6.2421   40.779   9.7109   39.059   16.500   41.691   12.011   37.041   10.383   42.011   6.9322 -4.969460 12.48425 
1 1 1   33   22    0 f   10.817   5.1223  -1.9686   8.9946  -1.9686   8.9946  -1.9686   8.9946   10.817   7.2440   10.817   7.2440 0.000000 0.000000 
1 1 1   33   22    1 o   35.369   4.9692   30.012   7.0894   22.091   9.7561   38.874   10.319   29.543   7.8667   41.196   6.0734 -11.65356 9.938390 
1 1 1   33   22    2 o   45.120   4.0703   45.781   7.5126   38.517   10.192   54.424   11.118   41.039   6.0211   49.201   5.4787 -8.161255 8.140613 
1 1 1   33   22    3 o   17.930   5.1668   2.2082   6.5888  -5.9216   9.0603   11.333   9.5990   13.805   6.4459   22.055   8.0767 -8.250031 10.33359 
1 1 1   33   22    4 o   72.340   3.0260  113.451   9.0109  106.573   12.292  121.441   13.248   69.998   4.2577   74.682   4.3010 -4.683838 6.052023 
1 1 1   33   22    5 o   47.921   3.9083   51.830   7.6950   56.489   10.865   47.141   10.900   50.292   5.2380   45.549   5.8020 4.743465 7.816609 
1 1 1   33   22    6 o   21.256   6.0536   8.6901   8.0445   7.1174   10.484   10.942   12.544   19.976   8.1212   22.535   8.9795 -2.558367 12.10719 
1 1 1   34    0    0 o   22.854   7.8852   16.420   12.397   16.420   12.397   16.420   12.397   22.854   11.151   22.854   11.151 0.000000 0.000000 
1 1 1   34    0    1 o   57.726   3.1204   70.730   10.365   70.730   10.365   70.730   10.365   57.726   4.4129   57.726   4.4129 0.000000 0.000000 
1 1 1   34    0    2 o   17.065   6.3894   9.1946   8.5334   9.1946   8.5334   9.1946   8.5334   17.065   9.0360   17.065   9.0360 0.000000 0.000000 
1 1 1   34    0    3 o   69.168   2.7556  100.535   11.036  100.535   11.036  100.535   11.036   69.168   3.8970   69.168   3.8970 0.000000 0.000000 
1 1 1   34    0    4 o   29.081   6.1211   22.136   9.0371   22.136   9.0371   22.136   9.0371   29.081   8.6566   29.081   8.6566 0.000000 0.000000 
1 1 1   34    0    5 o   25.614   6.5387   18.589   8.9556   18.589   8.9556   18.589   8.9556   25.614   9.2471   25.614   9.2471 0.000000 0.000000 
1 1 1   34    0    6 o   44.380   3.8442   43.171   9.5513   43.171   9.5513   43.171   9.5513   44.380   5.4365   44.380   5.4365 0.000000 0.000000 
1 1 1   34    0    7 o   10.863   5.0746  -1.3861   8.3357  -1.3861   8.3357  -1.3861   8.3357   10.863   7.1766   10.863   7.1766 0.000000 0.000000 
1 1 1   34    0    8 f   54.485   3.3588   63.571   10.488   63.571   10.488   63.571   10.488   54.485   4.7500   54.485   4.7500 0.000000 0.000000 
1 1 1   34    0    9 f   13.415   5.8107   3.6831   8.7077   3.6831   8.7077   3.6831   8.7077   13.415   8.2176   13.415   8.2176 0.000000 0.000000 
1 1 1   34    0   10 f   68.711   2.8131   99.485   11.188   99.485   11.188   99.485   11.188   68.711   3.9783   68.711   3.9783 0.000000 0.000000 
1 1 1   34    0   11 o   82.030   2.6086  141.055   12.424  141.055   12.424  141.055   12.424   82.030   3.6891   82.030   3.6891 0.000000 0.000000 
1 1 1   34    0   12 o   10.210   4.8593  -2.9962   8.2843  -2.9962   8.2843  -2.9962   8.2843   10.210   6.8720   10.210   6.8720 0.000000 0.000000 
1 1 1   34    0   13 o   20.945   7.1748   14.356   10.233   14.356   10.233   14.356   10.233   20.945   10.147   20.945   10.147 0.000000 0.000000 
1 1 1   34    0   14 o   14.541   6.3706   4.1872   10.749   4.1872   10.749   4.1872   10.749   14.541   9.0094   14.541   9.0094 0.000000 0.000000 
1 1 1   34    0   15 o   56.100   4.1588   69.029   13.266   69.029   13.266   69.029   13.266   56.100   5.8815   56.100   5.8815 0.000000 0.000000 
1 1 1   34    0   16 o   43.633   5.2429   44.223   12.186   44.223   12.186   44.223   12.186   43.633   7.4145   43.633   7.4145 0.000000 0.000000 
1 1 1   34    0   17 o   26.612   7.5183   21.699   11.310   21.699   11.310   21.699   11.310   26.612   10.633   26.612   10.633 0.000000 0.000000 
1 1 1   34    0   18 o   50.541   4.4916   57.073   12.674   57.073   12.674   57.073   12.674   50.541   6.3520   50.541   6.3520 0.000000 0.000000 
1 1 1   34    0   19 o   14.586   7.0414  -7.1267   18.678  -7.1267   18.678  -7.1267   18.678   14.586   9.9581   14.586   9.9581 0.000000 0.000000 
1 1 1   34    1    0 o   56.112   3.2100   67.008   10.348   67.008   10.348   67.008   10.348   56.112   4.5397   56.112   4.5397 0.000000 0.000000 
1 1 1   34    1    1 o   42.379   3.8179   38.372   6.6314   44.158   9.5582   33.002   9.2080   45.542   5.0887   39.216   5.6930 6.325836 7.635735 
1 1 1   34    1    2 o   63.847   2.8648   85.793   7.5435   86.882   10.744   84.734   10.594   64.246   4.0547   63.449   4.0482 0.7971611 5.729594 
1 1 1   34    1    3 o   72.089   2.7139  109.008   8.0571  117.754   11.629  100.935   11.173   74.890   3.7650   69.287   3.9098 5.602631 5.427882 
1 1 1   34    1    4 o   83.483   2.5472  146.169   8.7547  157.848   12.493  134.900   12.272   86.803   3.4895   80.163   3.7117 6.639679 5.094479 
1 1 1   34    1    5 o   40.315   4.0189   35.045   6.6372   30.282   9.3167   39.953   9.4579   37.420   6.0366   43.210   5.3070 -5.790024 8.037716 
1 1 1   34    1    6 o   69.242   2.8015  100.939   7.9954  106.161   11.458   95.983   11.162   71.004   3.9126   67.479   4.0106 3.524940 5.602967 
1 1 1   34    1    7 o   76.918   2.6379  124.421   8.3680  122.676   11.835  126.166   11.834   76.368   3.7573   77.468   3.7037 -1.100235 5.275857 
1 1 1   34    1    8 o   72.134   2.8007  109.784   8.3255  115.268   11.810  104.368   11.738   73.961   3.8716   70.308   4.0479 3.653572 5.601313 
1 1 1   34    1    9 o   70.454   2.8514  104.707   8.2738  112.821   11.910   97.139   11.502   73.123   3.9492   67.785   4.1141 5.337494 5.702819 
1 1 1   34    1   10 f  107.888   2.3510  244.055   10.461  246.173   14.843  241.964   14.746  108.355   3.3213  107.421   3.3282 0.9340897 4.701907 
1 1 1   34    1   11 o   93.496   2.7441  184.084   10.376  186.521   16.400  182.458   13.398   93.805   4.2390   93.188   3.4859 0.6174774 5.488226 
1 1 1   34    1   12 o   83.392   2.6122  146.535   8.9836  147.127   12.629  145.928   12.781   83.577   3.6638   83.207   3.7244 0.3702850 5.224367 
1 1 1   34    1   13 o  128.257   2.6756  347.244   14.150  336.454   19.855  358.379   20.171  126.209   3.8143  130.305   3.7532 -4.096367 5.351223 
1 1 1   34    1   14 o   54.622   4.0185   65.727   8.9446   72.695   12.255   57.785   13.085   58.032   5.1202   51.212   6.1948 6.819847 8.036904 
1 1 1   34    1   15 o   90.025   3.3190  174.078   12.323  173.070   17.323  175.111   17.533   89.773   4.6786   90.277   4.7089 -0.5044022 6.637980 
1 1 1   34    1   16 o   16.625   5.2349  -1.7232   7.2250  -1.5654   9.8133  -1.9101   10.677   16.350   7.2648   16.901   7.5392 -0.5512028 10.46980 
1 1 1   34    1   17 o   92.208   3.3263  182.820   12.648  187.078   17.905  178.579   17.868   93.322   4.6519   91.095   4.7559 2.226967 6.652663 
1 1 1   34    1   18 o   13.864   4.6364 -10.1762   7.0294 -14.2308   9.6484  -5.5895   10.262   12.448   6.0368   15.279   7.0387 -2.830982 9.272858 
1 1 1   34    1   19 o   29.453   7.0923   22.711   10.382   12.566   20.733   26.106   11.994   26.508   11.153   32.398   8.7641 -5.890070 14.18468 
1 1 1   34    1   20 o   56.710   10.412   83.879   23.457   0.0000   0.0000   83.879   23.457  ?   ?    56.710   10.412      ?      ? 
1 1 1   34    2    0 o   93.225   2.4384  181.296   13.218  181.296   13.218  181.296   13.218   93.225   3.4484   93.225   3.4484 0.000000 0.000000 
1 1 1   34    2    1 o   32.262   4.8506   23.446   6.3829   18.233   9.1412   28.406   8.9166   28.215   7.6589   36.309   5.9542 -8.094065 9.701139 
1 1 1   34    2    2 o   56.420   3.1509   67.356   7.3265   65.485   10.466   69.153   10.259   55.618   4.5626   57.223   4.3469 -1.604782 6.301816 
1 1 1   34    2    3 o   44.351   3.7466   42.010   6.8500   41.222   9.5101   42.859   9.8748   43.934   5.2483   44.768   5.3481 -0.8342590 7.493130 
1 1 1   34    2    4 o   16.250   4.9329   0.3136   5.9298  -0.7807   8.0903   1.5839   8.7168   15.416   6.7315   17.085   7.2124 -1.669063 9.865741 
1 1 1   34    2    5 o   22.796   5.4794   11.032   6.2057   9.0276   8.8401   12.979   8.7136   21.429   7.7655   24.164   7.7326 -2.734978 10.95885 
1 1 1   34    2    6 o   71.348   2.7696  107.212   8.1325   98.164   11.379  116.660   11.627   68.222   4.0440   74.474   3.7853 -6.252525 5.539189 
1 1 1   34    2    7 o   57.116   3.1390   69.180   7.3930   69.864   10.384   68.477   10.528   57.421   4.3847   56.810   4.4931 0.6110344 6.278001 
1 1 1   34    2    8 o   48.788   3.5199   50.798   7.0139   60.569   10.180   41.968   9.6774   53.366   4.6251   44.210   5.3073 9.156223 7.039754 
1 1 1   34    2    9 f  105.462   2.3771  233.257   10.338  229.105   14.632  237.396   14.609  104.507   3.3947  106.416   3.3284 -1.908997 4.754164 
1 1 1   34    2   10 o   52.926   3.3567   59.761   7.3220   62.603   10.394   56.961   10.316   54.212   4.6486   51.640   4.8435 2.571407 6.713353 
1 1 1   34    2   11 o   95.805   2.4568  192.723   9.7042  186.006   13.545  199.807   13.910   94.082   3.4905   97.527   3.4582 -3.444786 4.913511 
1 1 1   34    2   12 o   25.401   5.4941   14.861   6.2950   15.461   8.6187   14.176   9.2162   25.867   7.5858   24.936   7.9496 0.9306717 10.98824 
1 1 1   34    2   13 o   87.226   3.1377  161.661   11.237  157.571   15.115  166.716   16.803   86.108   4.2559   88.344   4.6116 -2.236145 6.275310 
1 1 1   34    2   14 o   31.979   5.9515   24.490   7.9363   22.792   10.753   26.522   11.762   30.825   8.2814   33.133   8.5497 -2.307688 11.90292 
1 1 1   34    2   15 f   66.986   3.7728   97.542   10.422   97.762   14.631   97.315   14.850   67.094   5.2872   66.879   5.3836 0.2154160 7.545681 
1 1 1   34    2   16 o   55.128   4.2142   66.861   9.5479   59.817   13.290   74.375   13.726   51.986   6.1983   58.269   5.7114 -6.283005 8.428423 
1 1 1   34    2   17 o   37.692   5.9022   37.338   9.2991   49.133   11.935   19.116   14.834   47.126   6.1406   28.258   10.082 18.86735 11.80448 
1 1 1   34    2   18 o   30.088   5.9010   21.956   7.8566   29.113   11.160   14.923   11.063   34.854   7.9403   25.323   8.7314 9.531271 11.80191 
1 1 1   34    2   19 o   55.594   5.5787   67.227   11.423   84.701   22.612   61.239   13.236   58.783   9.3266   52.405   6.1239 6.378845 11.15740 
1 1 1   34    2   20 o   33.042   11.566   30.495   19.447   0.0000   0.0000   30.495   19.447  ?   ?    33.042   11.566      ?      ? 
1 1 1   34    3    0 f   14.583   6.0368   5.6827   8.5982   5.6827   8.5982   5.6827   8.5982   14.583   8.5373   14.583   8.5373 0.000000 0.000000 
1 1 1   34    3    1 o   28.288   5.2729   18.292   6.2479   16.828   8.7435   19.820   8.9311   27.141   7.5406   29.435   7.3724 -2.294464 10.54577 
1 1 1   34    3    2 o   29.330   5.1361   19.660   6.2639   15.156   8.7965   24.293   8.9218   25.846   7.6859   32.813   6.8151 -6.967077 10.27223 
1 1 1   34    3    3 o   32.536   4.9163   24.125   6.4094   20.134   9.1198   28.020   9.0098   29.621   7.4670   35.452   6.3972 -5.830458 9.832607 
1 1 1   34    3    4 o   50.338   3.4079   53.882   7.0468   47.769   9.8210   60.368   10.117   47.327   5.0314   53.348   4.5979 -6.021572 6.815812 
1 1 1   34    3    5 o   46.796   3.5618   46.763   6.8658   43.954   9.6769   49.611   9.7428   45.336   5.1753   48.256   4.8952 -2.920055 7.123648 
1 1 1   34    3    6 o   54.933   3.2832   64.216   7.4268   67.636   10.439   60.711   10.569   56.472   4.4818   53.395   4.7990 3.077179 6.566328 
1 1 1   34    3    7 o   27.878   5.3038   17.950   6.3529   13.560   9.0266   22.258   8.9427   24.577   7.8708   31.180   7.1114 -6.602802 10.60765 
1 1 1   34    3    8 o   22.833   5.4268   11.157   6.1884   14.497   8.5995   7.5696   8.9121   25.210   7.6227   20.456   7.7261 4.754114 10.85354 
1 1 1   34    3    9 o   36.964   4.6478   30.689   6.7775   21.392   9.3749   40.868   9.8094   30.378   7.5221   43.550   5.4613 -13.17152 9.295524 
1 1 1   34    3   10 o   78.838   2.6466  130.939   8.6056  130.751   12.209  131.125   12.132   78.776   3.7576   78.901   3.7281 -0.1255493 5.293200 
1 1 1   34    3   11 o   20.773   5.3028   7.4658   6.1849   1.7649   8.5361   13.766   8.9738   16.914   7.1386   24.631   7.8435 -7.717012 10.60570 
1 1 1   34    3   12 o   48.084   4.1383   51.842   7.8640   57.511   10.188   43.487   12.368   51.864   4.7630   44.304   6.7687 7.559284 8.276549 
1 1 1   34    3   13 o   78.483   4.0119  127.904   12.057  118.214   14.359  151.079   22.205   74.327   4.6839   82.638   6.5148 -8.310883 8.023791 
1 1 1   34    3   14 o   22.426   5.9908   9.7075   7.6525   12.656   10.936   6.8784   10.712   24.076   8.6490   20.775   8.2917 3.300619 11.98156 
1 1 1   34    3   15 o   61.686   3.9089   83.082   9.9404   81.014   14.130   85.107   13.986   60.863   5.6290   62.508   5.4251 -1.645660 7.817745 
1 1 1   34    3   16 o   42.921   4.9754   42.030   8.5904   42.634   11.762   41.339   12.576   43.729   6.5216   42.113   7.5159 1.616428 9.950861 
1 1 1   34    3   17 o   51.121   4.3432   58.078   9.1094   62.899   12.691   52.956   13.083   53.535   5.7477   48.706   6.5128 4.828987 8.686322 
1 1 1   34    3   18 o   89.021   3.2937  170.684   12.090  165.451   17.025  176.007   17.170   87.600   4.7122   90.442   4.6030 -2.841484 6.587330 
1 1 1   34    3   19 o   35.105   8.0880   29.952   11.470   0.0000   0.0000   29.952   11.470  ?   ?    35.105   8.0880      ?      ? 
1 1 1   34    3   20 o   16.980   8.2473 -22.3902   18.195   0.0000   0.0000 -22.3902   18.195  ?   ?    16.980   8.2473      ?      ? 
1 1 1   34    4    0 o   68.341   2.8080   98.283   11.107   98.283   11.107   98.283   11.107   68.341   3.9712   68.341   3.9712 0.000000 0.000000 
1 1 1   34    4    1 o   40.254   3.9985   34.972   6.5975   30.756   9.3488   39.155   9.3119   37.722   6.0090   42.787   5.2766 -5.065773 7.996949 
1 1 1   34    4    2 o   49.232   3.4637   51.619   7.0222   48.078   9.8786   55.235   9.9840   47.478   5.0447   50.986   4.7477 -3.507694 6.927456 
1 1 1   34    4    3 f   25.739   5.3163   14.459   6.3447   7.8526   8.7298   21.856   9.2371   20.609   7.6744   30.869   7.3591 -10.26009 10.63258 
1 1 1   34    4    4 o   42.753   3.9473   39.373   6.9493   40.560   9.6649   38.101   9.9990   43.482   5.3893   42.025   5.7688 1.456924 7.894538 
1 1 1   34    4    5 o   60.431   3.0396   77.518   7.5454   84.640   10.612   70.234   10.731   63.330   4.0626   57.533   4.5224 5.797443 6.079202 
1 1 1   34    4    6 o   39.967   4.3839   35.845   6.8129   45.983   9.6419   25.737   9.6280   46.378   5.0406   33.557   7.1739 12.82151 8.767738 
1 1 1   34    4    7 o   49.253   3.6348   52.831   7.2235   63.382   10.058   41.592   10.381   54.645   4.4627   43.860   5.7385 10.78452 7.269525 
1 1 1   34    4    8 o   20.045   5.5251   6.4650   6.6674   8.9767   8.5096   2.4713   10.730   21.165   7.6267   18.925   7.9963 2.240156 11.05023 
1 1 1   34    4    9 o   38.217   4.6306   32.471   7.0342   40.411   10.252   25.409   9.6690   43.191   5.7552   33.242   7.2558 9.948826 9.261211 
1 1 1   34    4   10 f   76.272   2.8629  123.540   8.9570  116.670   13.128  129.524   12.251   74.162   4.2921   78.381   3.7897 -4.219460 5.725716 
1 1 1   34    4   11 o   35.308   4.8201   28.322   6.7625   26.365   9.4142   30.408   9.7203   33.956   6.9559   36.660   6.6746 -2.703789 9.640281 
1 1 1   34    4   12 o   82.934   2.7406  145.520   9.3515  147.619   12.843  143.150   13.644   83.650   3.7225   82.218   4.0234 1.431366 5.481281 
1 1 1   34    4   13 o   27.532   5.4356   15.691   7.3997   3.2635   9.9464   31.094   11.074   18.587   7.7667   36.477   7.6068 -17.88953 10.87128 
1 1 1   34    4   14 o   50.720   4.1611   55.757   8.6326   47.088   11.552   66.720   12.991   46.219   6.0598   55.220   5.7041 -9.000427 8.322141 
1 1 1   34    4   15 o   68.919   3.4281  102.354   9.7015  102.330   13.130  102.384   14.398   69.052   4.6102   68.786   5.0749 0.2655869 6.856230 
1 1 1   34    4   16 f   88.785   3.2940  169.343   12.049  159.455   16.949  179.445   17.132   86.076   4.7741   91.495   4.5398 -5.419571 6.587999 
1 1 1   34    4   17 o   42.073   5.0610   40.522   8.6062   38.869   11.893   42.339   12.470   40.867   7.3249   43.279   6.9858 -2.412437 10.12205 
1 1 1   34    4   18 f   46.124   4.6051   47.809   8.7479   49.085   12.177   46.447   12.576   46.883   6.2971   45.365   6.7212 1.518238 9.210235 
1 1 1   34    4   19 o   45.932   6.8465   48.108   12.970   0.0000   0.0000   48.108   12.970  ?   ?    45.932   6.8465      ?      ? 
1 1 1   34    4   20 o   83.472   7.6889  163.853   26.471   0.0000   0.0000  163.853   26.471  ?   ?    83.472   7.6889      ?      ? 
1 1 1   34    4   21 o   25.410   10.847   11.073   20.093   0.0000   0.0000   11.073   20.093  ?   ?    25.410   10.847      ?      ? 
1 1 1   34    5    0 o   28.968   6.3216   22.327   9.3467   22.327   9.3467   22.327   9.3467   28.968   8.9400   28.968   8.9400 0.000000 0.000000 
1 1 1   34    5    1 o   59.870   3.1004   75.874   7.6547   77.728   10.893   74.066   10.759   60.602   4.3582   59.139   4.4108 1.463043 6.200777 
1 1 1   34    5    2 o   29.410   5.2719   19.815   6.5741   13.659   9.1511   26.381   9.4504   24.709   7.9262   34.110   6.9532 -9.401114 10.54378 
1 1 1   34    5    3 o   15.978   4.9268  -0.5743   6.1102  -0.1954   8.4799  -0.9835   8.8120   16.004   6.9410   15.952   6.9939 0.5226231E-01 9.853539 
1 1 1   34    5    4 f   37.543   4.8896   32.150   7.2043   34.907   9.4053   28.237   11.206   40.230   5.6684   34.856   7.9688 5.373928 9.779190 
1 1 1   34    5    5 o   21.691   5.6205   8.8559   6.6618   12.234   9.6798   5.8160   9.1824   23.791   8.1695   19.590   7.7215 4.200138 11.24106 
1 1 1   34    5    6 o   21.648   5.5220   9.1728   6.4069   6.3038   9.0089   12.109   9.1135   19.753   7.6883   23.542   7.9283 -3.788929 11.04396 
1 1 1   34    5    7 o  100.562   2.4430  212.220   10.126  201.975   14.205  222.806   14.439   98.066   3.5120  103.059   3.3969 -4.993164 4.886009 
1 1 1   34    5    8 o   40.293   4.1260   35.213   6.8425   32.403   9.5924   38.124   9.7633   38.590   6.0268   41.996   5.6367 -3.405777 8.251987 
1 1 1   34    5    9 o   42.436   3.9408   38.924   6.8872   39.004   9.4991   38.834   10.000   42.536   5.4144   42.335   5.7273 0.2018661 7.881506 
1 1 1   34    5   10 o   19.173   5.2768   5.4608   6.1278   2.1426   8.5391   8.9837   8.7987   17.101   7.1745   21.244   7.7398 -4.142923 10.55362 
1 1 1   34    5   11 o   64.134   3.0072   87.392   7.9464   91.202   11.187   83.512   11.289   65.596   4.1349   62.672   4.3675 2.924252 6.014408 
1 1 1   34    5   12 o   24.859   5.8731   13.582   6.9267   11.720   8.8118   16.591   11.206   23.031   7.7958   26.688   8.7864 -3.657797 11.74628 
1 1 1   34    5   13 o   51.612   4.0632   58.494   8.6043   61.854   11.840   54.735   12.526   53.371   5.3787   49.853   6.0917 3.518299 8.126452 
1 1 1   34    5   14 o   23.615   5.9354   12.086   7.4903   16.007   10.122   7.3406   11.137   26.052   8.3337   21.177   8.4537 4.875071 11.87079 
1 1 1   34    5   15 o   39.899   5.0463   35.809   8.0735   30.669   10.668   42.701   12.352   36.214   7.3923   43.584   6.8713 -7.370670 10.09265 
1 1 1   34    5   16 o   47.427   4.5210   50.122   8.7937   44.099   12.356   56.302   12.517   44.331   6.7580   50.522   6.0072 -6.190567 9.041936 
1 1 1   34    5   17 o   29.953   6.1330   21.958   8.0195   23.655   11.531   20.368   11.161   31.030   8.6731   28.876   8.6735 2.153538 12.26596 
1 1 1   34    5   18 o   27.823   6.0984   18.780   8.8084   5.0712   13.446   29.085   11.658   21.139   8.9427   34.508   8.2940 -13.36862 12.19681 
1 1 1   34    5   19 o   37.649   8.1945   34.652   12.363   0.0000   0.0000   34.652   12.363  ?   ?    37.649   8.1945      ?      ? 
1 1 1   34    5   20 o   20.104   9.3228  -6.4425   18.444   0.0000   0.0000  -6.4425   18.444  ?   ?    20.104   9.3228      ?      ? 
1 1 1   34    5   21 o   20.106   9.2720  -4.8745   17.875   0.0000   0.0000  -4.8745   17.875  ?   ?    20.106   9.2720      ?      ? 
1 1 1   34    6    0 o   44.318   4.5341   44.020   11.007   44.020   11.007   44.020   11.007   44.318   6.4122   44.318   6.4122 0.000000 0.000000 
1 1 1   34    6    1 o   26.900   6.0209   16.921   7.4042   12.864   13.136   18.810   8.9640   25.252   9.4117   28.547   7.5116 -3.295429 12.04180 
1 1 1   34    6    2 o   65.445   2.9695   90.557   8.0148   91.811   11.405   89.334   11.265   65.893   4.1965   64.996   4.2024 0.8973541 5.938926 
1 1 1   34    6    3 o   59.343   3.1402   74.693   7.6844   72.687   10.807   76.745   10.929   58.524   4.4772   60.163   4.4043 -1.639149 6.280366 
1 1 1   34    6    4 o   19.099   5.2292   5.1065   6.1240   0.4212   8.6815   9.7472   8.6400   16.437   7.0758   21.761   7.7014 -5.324297 10.45842 
1 1 1   34    6    5 o   55.170   3.2684   64.821   7.4254   60.867   10.514   68.755   10.488   53.434   4.7708   56.905   4.4686 -3.470905 6.536767 
1 1 1   34    6    6 o   33.613   4.8915   25.537   6.6716   30.162   9.4425   20.928   9.4278   37.202   6.1539   30.024   7.6049 7.177824 9.782924 
1 1 1   34    6    7 o  102.627   2.4018  220.991   10.166  223.745   14.454  218.295   14.300  103.261   3.3938  101.993   3.3994 1.268349 4.803500 
1 1 1   34    6    8 o   31.436   5.4370   24.293   7.4361   13.166   11.903   31.415   9.5232   24.913   9.0135   37.960   6.0827 -13.04710 10.87392 
1 1 1   34    6    9 o   16.330   4.9814   0.2382   6.1190   1.6803   8.8532  -1.0808   8.4668   17.125   7.2511   15.535   6.8321 1.590279 9.962731 
1 1 1   34    6   10 o   15.271   4.7766  -1.8633   5.9856   0.6940   8.5461  -4.3257   8.3860   16.387   7.0367   14.154   6.4614 2.232406 9.553245 
1 1 1   34    6   11 o   58.722   3.3338   73.225   8.0215   62.509   10.886   85.957   11.866   53.976   4.8898   63.469   4.5328 -9.492691 6.667606 
1 1 1   34    6   12 o   22.126   5.5676   9.7120   7.0628   15.976   9.0866   0.1515   11.226   26.112   7.8222   18.140   7.9250 7.972521 11.13518 
1 1 1   34    6   13 o   22.068   5.8959   9.5211   7.4116   11.703   10.144   7.0220   10.855   23.244   8.3321   20.891   8.3441 2.352776 11.79185 
1 1 1   34    6   14 o   25.309   5.4697   12.275   7.3561   0.0259   9.9818   26.835   10.883   17.111   7.4743   33.506   7.9877 -16.39520 10.93932 
1 1 1   34    6   15 o   38.725   5.4854   35.515   8.4264   37.423   11.488   33.294   12.398   40.213   7.1902   37.236   8.2861 2.976238 10.97077 
1 1 1   34    6   16 o   32.762   6.8321   28.205   9.9155   31.627   11.925   20.540   17.849   36.289   8.1648   29.235   10.956 7.053024 13.66412 
1 1 1   34    6   17 o   24.889   6.0167   13.381   7.7587   21.066   11.469   6.8971   10.535   29.244   8.7945   20.534   8.2134 8.710144 12.03340 
1 1 1   34    6   18 o   27.562   8.7492   18.714   11.173   0.0000   0.0000   18.714   11.173  ?   ?    27.562   8.7492      ?      ? 
1 1 1   34    6   19 o   81.961   4.9653  146.587   16.785   0.0000   0.0000  146.587   16.785  ?   ?    81.961   4.9653      ?      ? 
1 1 1   34    6   20 o   20.459   9.4021  -4.2343   18.160   0.0000   0.0000  -4.2343   18.160  ?   ?    20.459   9.4021      ?      ? 
1 1 1   34    6   21 o   89.156   7.4627  187.050   27.442   0.0000   0.0000  187.050   27.442  ?   ?    89.156   7.4627      ?      ? 
1 1 1   34    7    0 o   73.236   2.7427  112.746   11.641  112.746   11.641  112.746   11.641   73.236   3.8788   73.236   3.8788 0.000000 0.000000 
1 1 1   34    7    1 o   39.835   3.9838   34.258   6.5447   34.074   9.2963   34.439   9.2156   39.716   5.6752   39.954   5.5924 -0.2383652 7.967601 
1 1 1   34    7    2 o  101.336   2.3933  215.362   10.003  214.877   14.193  215.840   14.099  101.215   3.3999  101.456   3.3693 -0.2418594 4.786577 
1 1 1   34    7    3 o   56.649   3.1725   68.200   7.4064   71.166   10.462   65.220   10.487   57.924   4.3791   55.375   4.5916 2.549015 6.345026 
1 1 1   34    7    4 f   95.505   2.6320  192.200   10.296  193.721   13.812  190.298   15.447   96.050   3.4865   94.960   3.9439 1.089745 5.264092 
1 1 1   34    7    5 o   70.631   3.0316  106.793   8.7224  114.812   11.762   96.996   13.002   73.785   3.8650   67.476   4.6718 6.309174 6.063282 
1 1 1   34    7    6 o   60.504   3.5018   77.676   8.5675   81.661   13.654   75.088   11.003   61.578   5.3759   59.431   4.4890 2.147461 7.003694 
1 1 1   34    7    7 o  105.245   2.4092  232.546   10.454  224.472   14.725  240.752   14.844  103.377   3.4535  107.113   3.3601 -3.735100 4.818402 
1 1 1   34    7    8 o   48.871   3.6098   51.308   7.2702   53.565   10.275   49.046   10.288   49.994   4.9832   47.749   5.2240 2.244709 7.219608 
1 1 1   34    7    9 f   33.266   4.9595   25.407   6.5905   26.419   9.2823   24.379   9.3588   34.020   6.8524   32.513   7.1716 1.506271 9.919060 
1 1 1   34    7   10 o   20.729   5.5049   7.8683   6.5171   10.940   8.9954   4.4753   9.4548   22.555   7.8679   18.903   7.7015 3.652111 11.00988 
1 1 1   34    7   11 o   50.046   4.5040   54.304   9.1461   49.713   11.744   61.382   14.581   47.609   5.9807   52.483   6.7361 -4.873920 9.007963 
1 1 1   34    7   12 o   19.729   5.9914   3.2464   8.0636   5.0819   9.2759  -2.4314   16.314   19.005   7.6697   20.454   9.2066 -1.449389 11.98270 
1 1 1   34    7   13 f   16.864   5.2606  -0.8372   7.1464  -0.5952   9.8847  -1.1022   10.344   16.784   7.3819   16.944   7.4970 -0.1594391 10.52127 
1 1 1   34    7   14 o   81.659   3.2438  141.286   10.853  127.681   14.383  159.280   16.541   77.197   4.5172   86.121   4.6566 -8.923889 6.487666 
1 1 1   34    7   15 o   61.409   3.7834   82.853   9.4620   88.964   12.766   75.403   14.095   64.251   4.8174   58.566   5.8352 5.685303 7.566818 
1 1 1   34    7   16 o   83.978   3.1985  151.380   11.003  150.731   14.724  152.200   16.556   83.969   4.2516   83.986   4.7796 -0.1748657E-01 6.396930 
1 1 1   34    7   17 o   29.297   6.6257   21.660   9.0290   19.630   14.339   22.993   11.622   28.183   9.9271   30.411   8.7778 -2.227863 13.25135 
1 1 1   34    7   18 o   40.529   7.5679   39.133   12.185   0.0000   0.0000   39.133   12.185  ?   ?    40.529   7.5679      ?      ? 
1 1 1   34    7   19 o   22.553   8.4420   10.995   10.590   0.0000   0.0000   10.995   10.590  ?   ?    22.553   8.4420      ?      ? 
1 1 1   34    7   20 o   80.278   7.8697  153.135   26.057   0.0000   0.0000  153.135   26.057  ?   ?    80.278   7.8697      ?      ? 
1 1 1   34    7   21 o   55.905   10.355   83.395   22.997   0.0000   0.0000   83.395   22.997  ?   ?    55.905   10.355      ?      ? 
1 1 1   34    8    0 o   25.036   6.6315   18.156   9.0371   18.156   9.0371   18.156   9.0371   25.036   9.3784   25.036   9.3784 0.000000 0.000000 
1 1 1   34    8    1 o   38.007   4.3029   32.020   6.5310   36.082   9.1642   27.828   9.3099   40.927   5.4290   35.088   6.6771 5.839531 8.605706 
1 1 1   34    8    2 o   46.648   3.5792   46.609   6.8853   45.540   9.6583   47.713   9.8183   46.098   5.0798   47.198   5.0437 -1.099827 7.158469 
1 1 1   34    8    3 o   21.579   5.3580   9.0782   6.2244   14.137   8.6978   3.7678   8.9113   24.910   7.6923   18.247   7.4605 6.662851 10.71591 
1 1 1   34    8    4 o   50.397   3.5438   54.817   7.2772   63.918   10.257   45.591   10.327   54.812   4.5370   45.982   5.4451 8.829830 7.087531 
1 1 1   34    8    5 o   28.596   5.2060   18.892   6.5318   27.292   9.2750   10.627   9.2002   34.692   6.7250   22.500   7.9488 12.19163 10.41197 
1 1 1   34    8    6 o   49.911   3.7458   53.348   7.6888   57.696   11.409   49.730   10.407   51.744   5.3459   48.077   5.2483 3.667252 7.491589 
1 1 1   34    8    7 o   21.385   5.7730   7.8830   7.0025   5.6867   9.0763   11.113   11.007   19.369   7.6632   23.401   8.6363 -4.031729 11.54605 
1 1 1   34    8    8 o   16.827   5.0491   0.4265   6.2610  -3.8966   8.6172   5.2605   9.1122   14.527   6.5997   19.128   7.6431 -4.601076 10.09816 
1 1 1   34    8    9 o   27.213   5.6126   17.652   6.9275   22.116   9.2458   11.940   10.460   30.799   7.3759   23.627   8.4618 7.171864 11.22525 
1 1 1   34    8   10 o   47.125   4.1308   48.262   7.8930   46.824   10.211   50.396   12.442   46.487   5.3254   47.762   6.3162 -1.274689 8.261583 
1 1 1   34    8   11 o   93.438   2.9409  183.117   11.245  209.795   17.257  163.429   14.824   99.224   4.2168   87.653   4.1006 11.57156 5.881804 
1 1 1   34    8   12 o   90.373   2.9522  174.064   10.693  174.164   13.624  173.905   17.256   90.756   3.6396   89.989   4.6492 0.7671661 5.904397 
1 1 1   34    8   13 o   93.469   3.0661  186.741   11.737  187.677   15.732  185.565   17.626   93.932   4.0608   93.006   4.5950 0.9267273 6.132190 
1 1 1   34    8   14 o   62.601   3.6052   83.543   9.2332   74.047   12.166   96.441   14.179   58.504   5.0420   66.697   5.1544 -8.193054 7.210378 
1 1 1   34    8   15 o   23.825   5.9736   12.639   7.3466   11.826   10.112   13.549   10.692   23.223   8.3195   24.428   8.5745 -1.205408 11.94722 
1 1 1   34    8   16 o   63.207   3.6075   86.539   9.3737   82.375   12.653   91.605   13.956   61.607   4.9795   64.807   5.2211 -3.199547 7.214989 
1 1 1   34    8   17 o   29.525   8.7252   21.762   11.364   0.0000   0.0000   21.762   11.364  ?   ?    29.525   8.7252      ?      ? 
1 1 1   34    8   18 o   36.976   7.8243   33.111   11.560   0.0000   0.0000   33.111   11.560  ?   ?    36.976   7.8243      ?      ? 
1 1 1   34    8   19 o   64.562   5.3992   92.016   14.377   0.0000   0.0000   92.016   14.377  ?   ?    64.562   5.3992      ?      ? 
1 1 1   34    8   20 o   62.483   8.8563   96.579   22.823   0.0000   0.0000   96.579   22.823  ?   ?    62.483   8.8563      ?      ? 
1 1 1   34    8   21 o   68.200   8.5694  115.225   24.105   0.0000   0.0000  115.225   24.105  ?   ?    68.200   8.5694      ?      ? 
1 1 1   34    8   22 o   17.878   8.5534 -13.8717   17.875   0.0000   0.0000 -13.8717   17.875  ?   ?    17.878   8.5534      ?      ? 
1 1 1   34    9    0 o   14.408   6.0171   5.4666   8.6771   5.4666   8.6771   5.4666   8.6771   14.408   8.5094   14.408   8.5094 0.000000 0.000000 
1 1 1   34    9    1 o   36.316   4.8339   30.516   6.9408   22.772   10.219   37.149   9.4570   31.165   7.9303   41.468   5.5294 -10.30310 9.667706 
1 1 1   34    9    2 o   63.757   3.4521   87.196   9.0275   89.741   12.262   84.184   13.339   64.913   4.5802   62.601   5.1663 2.311565 6.904212 
1 1 1   34    9    3 o   52.448   3.7358   58.128   7.9676   53.091   10.283   65.696   12.604   49.768   5.0095   55.127   5.5434 -5.359306 7.471534 
1 1 1   34    9    4 o   25.723   5.5221   15.240   6.3742   15.801   9.0915   14.697   8.9394   26.138   7.8231   25.308   7.7957 0.8302345 11.04416 
1 1 1   34    9    5 o   16.150   4.8931  -0.1957   6.0039  -4.5320   8.4893   4.1435   8.4921   14.184   6.4849   18.117   7.3290 -3.933064 9.786119 
1 1 1   34    9    6 o   26.277   5.4683   15.937   6.4526   11.974   9.1141   19.919   9.1365   23.337   7.9282   29.217   7.5334 -5.880400 10.93663 
1 1 1   34    9    7 o   23.584   5.5719   12.407   6.3686   12.039   9.0161   12.773   8.9970   23.326   7.8857   23.841   7.8741 -0.5151501 11.14386 
1 1 1   34    9    8 o   61.221   3.0502   79.836   7.6973   77.824   10.973   81.785   10.800   60.420   4.4035   62.021   4.2220 -1.600418 6.100483 
1 1 1   34    9    9 o   57.369   3.3501   71.107   7.8676   76.651   10.806   64.851   11.478   59.932   4.3714   54.805   5.0777 5.127037 6.700153 
1 1 1   34    9   10 o   51.859   3.4812   57.979   7.4322   57.747   10.201   58.242   10.851   51.817   4.7730   51.902   5.0689 -0.8517838E-01 6.962425 
1 1 1   34    9   11 o   61.632   3.5140   81.833   8.6884   81.159   11.068   82.914   14.024   61.626   4.3547   61.639   5.5163 -0.1336288E-01 7.028077 
1 1 1   34    9   12 o   29.621   5.7936   20.662   7.5180   14.313   10.230   28.117   11.085   24.919   8.4000   34.323   7.9815 -9.403978 11.58723 
1 1 1   34    9   13 o   58.021   3.9411   75.269   9.1762   87.332   12.424   60.791   13.611   63.717   4.7276   52.324   6.3072 11.39284 7.882284 
1 1 1   34    9   14 o   25.494   5.9392   15.306   7.2697   16.716   9.9491   13.691   10.648   26.472   8.2358   24.517   8.5598 1.954508 11.87848 
1 1 1   34    9   15 o   20.669   5.7307   6.9488   7.3233   2.3963   10.303   11.598   10.411   18.248   7.7779   23.090   8.4183 -4.842413 11.46137 
1 1 1   34    9   16 o   24.194   7.2564   9.5523   10.247   3.1361   26.970   10.635   11.078   25.758   11.692   22.629   8.5977 3.128159 14.51281 
1 1 1   34    9   17 o   46.551   6.4456   49.053   12.375   0.0000   0.0000   49.053   12.375  ?   ?    46.551   6.4456      ?      ? 
1 1 1   34    9   18 o   28.658   8.8451   20.712   11.502   0.0000   0.0000   20.712   11.502  ?   ?    28.658   8.8451      ?      ? 
1 1 1   34    9   19 o   17.979   7.7931   1.7031   10.678   0.0000   0.0000   1.7031   10.678  ?   ?    17.979   7.7931      ?      ? 
1 1 1   34    9   20 o   28.989   11.295   22.640   19.457   0.0000   0.0000   22.640   19.457  ?   ?    28.989   11.295      ?      ? 
1 1 1   34    9   21 o   31.600   11.497   29.658   19.405   0.0000   0.0000   29.658   19.405  ?   ?    31.600   11.497      ?      ? 
1 1 1   34    9   22 o   36.112   11.671   40.156   19.813   0.0000   0.0000   40.156   19.813  ?   ?    36.112   11.671      ?      ? 
1 1 1   34   10    0 o   72.797   2.7968  111.608   11.795  111.608   11.795  111.608   11.795   72.797   3.9552   72.797   3.9552 0.000000 0.000000 
1 1 1   34   10    1 o   92.952   2.5009  181.589   9.5790  171.024   13.337  192.846   13.767   90.136   3.5874   95.768   3.4854 -5.632759 5.001760 
1 1 1   34   10    2 o   57.458   3.5669   70.118   8.3637   76.159   12.986   65.835   10.933   59.433   5.2976   55.484   4.7777 3.949192 7.133821 
1 1 1   34   10    3 o   79.886   2.8023  135.152   9.2014  137.083   12.562  132.917   13.515   80.593   3.7793   79.178   4.1386 1.414383 5.604572 
1 1 1   34   10    4 o   58.840   3.1808   73.892   7.7079   69.967   10.961   77.731   10.841   57.229   4.6438   60.450   4.3481 -3.220982 6.361677 
1 1 1   34   10    5 o   46.926   3.7130   47.663   7.1413   53.888   10.147   41.555   10.052   50.102   4.9104   43.751   5.5707 6.351673 7.425969 
1 1 1   34   10    6 o   75.545   3.0895  123.148   9.3437  114.488   14.809  128.877   12.044   72.984   4.9196   78.106   3.7386 -5.122292 6.178944 
1 1 1   34   10    7 o   55.084   3.2753   65.097   7.4288   61.903   10.611   68.168   10.404   53.684   4.7925   56.484   4.4657 -2.799915 6.550580 
1 1 1   34   10    8 o   59.746   3.2670   77.376   7.9474   88.138   11.015   65.691   11.478   64.348   4.1504   55.143   5.0465 9.204842 6.534029 
1 1 1   34   10    9 o   22.968   5.6097   11.679   6.4939   13.235   9.0659   10.040   9.3062   24.022   7.9027   21.915   7.9637 2.106260 11.21933 
1 1 1   34   10   10 f   16.914   5.1015   1.3119   6.3464   3.6542   8.6335  -1.4416   9.3608   17.800   7.3180   16.027   7.1097 1.773176 10.20295 
1 1 1   34   10   11 o   28.281   5.7717   19.028   7.0132   18.474   9.0600   19.858   11.078   27.916   7.6445   28.647   8.6495 -0.7313042 11.54346 
1 1 1   34   10   12 o   46.587   4.3529   48.200   8.2941   49.556   11.158   46.526   12.399   47.554   5.6890   45.620   6.5898 1.934078 8.705716 
1 1 1   34   10   13 o   22.859   5.8796   11.222   7.1697   11.439   9.8368   10.975   10.472   22.907   8.2056   22.812   8.4230 0.9486389E-01 11.75920 
1 1 1   34   10   14 o   20.639   5.5225   7.1143   7.0339   13.752   9.4527  -1.1206   10.529   24.293   8.0733   16.986   7.5373 7.306866 11.04492 
1 1 1   34   10   15 o   16.734   5.1656  -2.1405   7.2434   5.7903   9.8978 -11.2858   10.629   19.534   7.9088   13.934   6.6470 5.599575 10.33112 
1 1 1   34   10   16 o   19.508   5.8073   4.2653   7.8900   4.9869   12.028   3.7203   10.453   20.226   8.5017   18.790   7.9134 1.435982 11.61465 
1 1 1   34   10   17 f   32.853   8.7006   27.212   11.976   0.0000   0.0000   27.212   11.976  ?   ?    32.853   8.7006      ?      ? 
1 1 1   34   10   18 o   48.965   6.3166   54.308   12.757   0.0000   0.0000   54.308   12.757  ?   ?    48.965   6.3166      ?      ? 
1 1 1   34   10   19 o   20.012   8.1775   6.4381   10.700   0.0000   0.0000   6.4381   10.700  ?   ?    20.012   8.1775      ?      ? 
1 1 1   34   10   20 f   45.981   11.314   60.755   21.309   0.0000   0.0000   60.755   21.309  ?   ?    45.981   11.314      ?      ? 
1 1 1   34   10   21 o   40.565   11.623   49.596   20.446   0.0000   0.0000   49.596   20.446  ?   ?    40.565   11.623      ?      ? 
1 1 1   34   10   22 o   59.365   9.2461   91.426   22.639   0.0000   0.0000   91.426   22.639  ?   ?    59.365   9.2461      ?      ? 
1 1 1   34   11    0 o   59.362   3.1229   75.062   10.675   75.062   10.675   75.062   10.675   59.362   4.4164   59.362   4.4164 0.000000 0.000000 
1 1 1   34   11    1 o   20.404   5.1361   6.6758   6.1477  -1.6906   8.7287   14.911   8.6602   15.454   6.8600   25.353   7.6459 -9.899080 10.27225 
1 1 1   34   11    2 o   72.377   2.7922  110.998   8.3287  105.705   11.740  116.361   11.818   70.599   4.0317   74.156   3.8639 -3.556633 5.584336 
1 1 1   34   11    3 o   37.151   4.4891   30.907   6.7158   28.952   9.5515   32.819   9.4446   35.590   6.7540   38.712   5.9153 -3.121414 8.978125 
1 1 1   34   11    4 o   29.935   5.2579   21.041   6.4631   21.173   9.1203   20.908   9.1602   30.040   7.4077   29.829   7.4638 0.2110939 10.51581 
1 1 1   34   11    5 o   32.419   4.9069   24.222   6.5332   31.693   9.3290   17.031   9.1521   37.979   5.9556   26.859   7.8000 11.12029 9.813725 
1 1 1   34   11    6 o   21.635   5.5349   9.7517   6.3595   8.8185   9.1195   10.635   8.8729   21.087   7.8455   22.183   7.8095 -1.095644 11.06974 
1 1 1   34   11    7 o   54.727   3.8125   66.337   8.4283   55.298   12.431   75.730   11.466   50.083   6.0179   59.371   4.6826 -9.287830 7.625060 
1 1 1   34   11    8 o   44.279   4.2868   44.505   7.3903   54.918   10.317   33.529   10.592   50.431   4.9599   38.126   6.9933 12.30502 8.573574 
1 1 1   34   11    9 o   76.733   2.8527  125.236   9.0075  125.907   12.353  124.474   13.162   77.035   3.8880   76.431   4.1754 0.6036987 5.705331 
1 1 1   34   11   10 o   53.844   3.5056   62.590   7.7773   62.229   10.750   62.985   11.266   53.733   4.8505   53.954   5.0627 -0.2212410 7.011278 
1 1 1   34   11   11 o   37.843   5.0585   32.588   7.5223   28.913   9.7777   37.918   11.775   35.332   6.9572   40.354   7.3452 -5.021263 10.11704 
1 1 1   34   11   12 o   25.394   5.9111   14.992   7.4898   20.199   10.281   9.1022   10.934   28.879   8.2311   21.909   8.4860 6.969986 11.82210 
1 1 1   34   11   13 o   57.668   3.8485   74.043   8.9793   83.393   12.185   62.932   13.283   62.121   4.7558   53.216   6.0520 8.904766 7.697001 
1 1 1   34   11   14 o   31.632   5.6150   25.079   7.6736   33.488   10.471   15.325   11.278   37.868   6.9609   25.397   8.8125 12.47141 11.23002 
1 1 1   34   11   15 o   88.535   4.6291  169.764   16.904   0.0000   0.0000  169.764   16.904  ?   ?    88.535   4.6291      ?      ? 
1 1 1   34   11   16 o   42.760   7.6148   47.676   11.166   52.092   27.448   46.800   12.224   40.142   13.758   45.378   6.5312 -5.235245 15.22958 
1 1 1   34   11   17 o   62.389   5.4982   86.233   14.148   0.0000   0.0000   86.233   14.148  ?   ?    62.389   5.4982      ?      ? 
1 1 1   34   11   18 o   15.374   7.1367  -6.0262   10.848   0.0000   0.0000  -6.0262   10.848  ?   ?    15.374   7.1367      ?      ? 
1 1 1   34   11   19 o   72.229   5.3161  116.020   15.837   0.0000   0.0000  116.020   15.837  ?   ?    72.229   5.3161      ?      ? 
1 1 1   34   11   20 f   18.797   8.9002 -10.3054   18.363   0.0000   0.0000 -10.3054   18.363  ?   ?    18.797   8.9002      ?      ? 
1 1 1   34   11   21 o   22.756   10.091   6.0035   18.846   0.0000   0.0000   6.0035   18.846  ?   ?    22.756   10.091      ?      ? 
1 1 1   34   12    0 o   43.927   3.9686   42.774   9.7145   42.774   9.7145   42.774   9.7145   43.927   5.6124   43.927   5.6124 0.000000 0.000000 
1 1 1   34   12    1 o   59.232   3.1157   75.212   7.5714   66.563   10.701   83.883   10.714   55.688   4.6589   62.775   4.1382 -7.087009 6.231397 
1 1 1   34   12    2 o   54.052   3.3200   62.749   7.3997   60.894   10.409   64.644   10.522   53.223   4.7416   54.881   4.6485 -1.657753 6.640094 
1 1 1   34   12    3 o   26.486   5.2632   15.994   6.4775   7.7392   9.0218   24.777   9.3059   20.366   7.7538   32.607   7.1193 -12.24074 10.52645 
1 1 1   34   12    4 o   34.667   4.8219   28.419   6.7021   39.641   9.4036   16.835   9.5544   42.697   5.3400   26.637   8.0305 16.05965 9.643861 
1 1 1   34   12    5 f   22.579   5.5608   11.056   6.4241   13.634   9.1273   8.5260   9.0433   24.308   7.9262   20.850   7.8017 3.457699 11.12165 
1 1 1   34   12    6 o   15.890   4.8865  -1.2366   6.2391   3.9423   8.6611  -6.8228   8.9952   17.975   7.3526   13.805   6.4382 4.169951 9.772998 
1 1 1   34   12    7 o   17.209   5.1651   1.8481   6.3695   0.9274   8.7307   2.8957   9.3132   16.524   7.1043   17.895   7.4994 -1.371510 10.33017 
1 1 1   34   12    8 o   98.469   2.5887  204.472   10.484  197.147   14.214  213.214   15.527   96.603   3.5674  100.335   3.7521 -3.732552 5.177312 
1 1 1   34   12    9 o   44.388   4.0347   43.654   7.2937   48.336   9.9836   38.296   10.681   47.223   5.1259   41.553   6.2324 5.669823 8.069500 
1 1 1   34   12   10 o   48.486   4.0200   51.443   7.9024   50.729   10.259   52.485   12.392   48.339   5.1458   48.633   6.1777 -0.2944565 8.040092 
1 1 1   34   12   11 o   31.403   5.6088   22.999   7.6232   13.310   10.216   35.174   11.452   24.134   8.3865   38.671   7.4500 -14.53772 11.21762 
1 1 1   34   12   12 o   32.259   6.2658   25.635   8.5696   29.853   12.944   22.344   11.434   34.508   9.0008   30.010   8.7194 4.498571 12.53162 
1 1 1   34   12   13 o   49.940   4.6197   56.312   9.3841   57.075   14.514   55.763   12.301   49.861   7.0575   50.018   5.9629 -0.1568069 9.239302 
1 1 1   34   12   14 o   60.564   4.2434   83.321   10.374   73.051   15.641   91.387   13.862   56.593   6.7010   64.535   5.2080 -7.941814 8.486816 
1 1 1   34   12   15 o   46.066   7.1363   70.524   11.659   29.731   28.626   78.636   12.766   32.271   13.303   59.862   5.1705 -27.59090 14.27253 
1 1 1   34   12   16 o   51.103   7.5568   77.393   12.719   56.614   28.479   82.570   14.215   41.287   14.015   60.919   5.6576 -19.63121 15.11367 
1 1 1   34   12   17 o   23.300   7.4507   0.4476   10.665   23.212   28.248  -3.3365   11.517   29.915   12.818   16.686   7.5995 13.22901 14.90135 
1 1 1   34   12   18 o  100.550   4.8045  221.807   19.925   0.0000   0.0000  221.807   19.925  ?   ?   100.550   4.8045      ?      ? 
1 1 1   34   12   19 o   22.607   8.7615   11.334   11.661   0.0000   0.0000   11.334   11.661  ?   ?    22.607   8.7615      ?      ? 
1 1 1   34   12   20 o   54.383   10.745   82.778   23.246   0.0000   0.0000   82.778   23.246  ?   ?    54.383   10.745      ?      ? 
1 1 1   34   13    0 o   41.287   4.2956   38.451   9.6879   38.451   9.6879   38.451   9.6879   41.287   6.0749   41.287   6.0749 0.000000 0.000000 
1 1 1   34   13    1 o   95.895   2.4743  194.054   9.7848  189.659   13.776  198.529   13.901   94.784   3.5239   97.006   3.4743 -2.222511 4.948569 
1 1 1   34   13    2 o   23.939   5.4006   12.829   6.4209   6.3439   9.2692   18.811   8.9029   19.673   7.7567   28.206   7.5168 -8.533295 10.80127 
1 1 1   34   13    3 o   64.965   2.9800   89.986   7.9845   89.225   11.305   90.744   11.278   64.679   4.2380   65.251   4.1907 -0.5722046 5.960067 
1 1 1   34   13    4 o   81.551   2.7818  139.700   9.3067  158.948   14.013  124.510   12.448   86.528   3.9266   76.575   3.9415 9.953560 5.563640 
1 1 1   34   13    5 o   57.376   3.3338   70.625   7.8757   68.232   10.764   73.383   11.554   56.374   4.6294   58.378   4.7986 -2.003731 6.667688 
1 1 1   34   13    6 o   63.252   3.1732   85.461   8.2631   81.620   11.275   89.916   12.145   61.753   4.4270   64.751   4.5475 -2.997456 6.346496 
1 1 1   34   13    7 o   25.437   5.6434   15.268   6.6175   16.607   9.0406   13.723   9.7127   26.464   7.7717   24.411   8.1850 2.053476 11.28686 
1 1 1   34   13    8 o   40.404   4.3223   36.168   7.2001   35.666   10.020   36.703   10.353   40.142   6.0522   40.666   6.1724 -0.5235062 8.644554 
1 1 1   34   13    9 o   44.713   4.0395   44.264   7.3946   48.318   10.238   39.843   10.692   47.075   5.2729   42.351   6.1211 4.724258 8.079083 
1 1 1   34   13   10 o   91.184   2.9555  179.437   10.800  185.255   13.887  170.531   17.181   93.494   3.6014   88.874   4.6871 4.620033 5.910928 
1 1 1   34   13   11 o   18.461   5.2243   1.3886   7.0545   12.223   9.6265 -11.1796   10.368   23.186   8.1363   13.735   6.5556 9.451036 10.44868 
1 1 1   34   13   12 o   72.500   3.4065  114.040   10.126  112.407   13.572  116.092   15.209   72.105   4.5635   72.894   5.0587 -0.7885818 6.812901 
1 1 1   34   13   13 o   56.368   3.9127   70.416   9.0731   72.490   12.531   68.131   13.154   57.405   5.2927   55.332   5.7640 2.073318 7.825346 
1 1 1   34   13   14 o   20.827   5.9171   4.9000   8.1104   15.002   12.500  -2.4441   10.658   25.199   9.2186   16.454   7.4205 8.744915 11.83411 
1 1 1   34   13   15 o   27.514   6.9131   20.405   10.287  -5.9448   26.540   25.063   11.159   23.434   10.971   31.594   8.4137 -8.159985 13.82613 
1 1 1   34   13   16 o   22.609   6.9241   7.6281   10.239  -4.4487   26.022   9.8402   11.137   23.318   10.900   21.901   8.5417 1.416204 13.84817 
1 1 1   34   13   17 o   30.593   7.7899   25.044   11.029   27.881   26.241   24.435   12.155   30.674   12.699   30.512   9.0261 0.1619339 15.57980 
1 1 1   34   13   18 o   49.405   6.6618   56.836   13.575   0.0000   0.0000   56.836   13.575  ?   ?    49.405   6.6618      ?      ? 
1 1 1   34   13   19 o   57.423   10.323   90.236   23.550   0.0000   0.0000   90.236   23.550  ?   ?    57.423   10.323      ?      ? 
1 1 1   34   13   20 o   26.253   10.997   16.679   20.008   0.0000   0.0000   16.679   20.008  ?   ?    26.253   10.997      ?      ? 
1 1 1   34   14    0 o   11.520   5.3055  -0.0014   8.6336  -0.0014   8.6336  -0.0014   8.6336   11.520   7.5032   11.520   7.5032 0.000000 0.000000 
1 1 1   34   14    1 o   48.435   3.6123   50.981   7.1405   42.369   9.9874   59.986   10.213   44.052   5.4969   52.817   4.6882 -8.765156 7.224597 
1 1 1   34   14    2 o   15.789   4.7557  -2.9062   6.0740   7.0715   8.7679 -12.1127   8.4223   19.802   7.6187   11.777   5.6940 8.024939 9.511432 
1 1 1   34   14    3 o   54.111   3.3276   63.026   7.3934   55.715   10.329   70.709   10.588   50.781   4.9315   57.441   4.4691 -6.660645 6.655228 
1 1 1   34   14    4 o   53.161   3.6199   62.926   7.6638   77.790   10.586   46.554   11.110   60.346   4.2530   45.975   5.8590 14.37070 7.239895 
1 1 1   34   14    5 o   45.000   3.9056   44.336   7.2247   44.528   9.8480   44.113   10.632   45.217   5.2805   44.783   5.7559 0.4342880 7.811167 
1 1 1   34   14    6 o   70.719   2.9885  106.396   8.6908  100.503   11.750  113.515   12.914   68.610   4.1521   72.827   4.2994 -4.216591 5.977041 
1 1 1   34   14    7 o   70.416   3.0402  105.389   8.7951   95.455   11.853  117.559   13.119   66.749   4.3054   74.083   4.2937 -7.333572 6.080475 
1 1 1   34   14    8 o   63.530   3.2445   86.992   8.4842   86.604   11.629   87.433   12.406   63.465   4.4427   63.595   4.7297 -0.1298637 6.488997 
1 1 1   34   14   10 o   30.119   5.9053   22.138   7.6489   17.729   10.323   27.505   11.389   26.874   8.3939   33.363   8.3085 -6.488279 11.81052 
1 1 1   34   14   11 o   48.750   4.2977   51.781   8.5032   41.540   11.079   66.459   13.264   42.934   6.2567   54.567   5.8937 -11.63286 8.595436 
1 1 1   34   14   12 o   53.390   4.0376   62.884   8.8491   55.418   11.982   71.842   13.125   49.850   5.8278   56.930   5.5898 -7.079853 8.075214 
1 1 1   34   14   13 o   48.281   5.1308   55.886   9.6166   45.935   14.479   63.741   12.864   43.146   8.4385   53.416   5.8389 -10.26979 10.26168 
1 1 1   34   14   14 o   31.294   7.9676   16.807   9.8767   52.386   26.453   11.044   10.647   40.109   13.508   22.479   8.4545 17.63015 15.93526 
1 1 1   34   14   15 o   31.566   6.4192   31.348   10.795  -9.5493   25.745   40.073   11.891   22.272   10.544   40.860   7.3250 -18.58819 12.83835 
1 1 1   34   14   16 o   41.337   7.8364   46.384   11.767   54.295   28.213   44.719   12.947   39.186   13.911   43.487   7.2184 -4.300545 15.67274 
1 1 1   34   14   17 o   20.044   6.6382  -2.5316   10.173   2.1597   25.227  -3.4426   11.117   23.878   11.013   16.211   7.4151 7.667006 13.27643 
1 1 1   34   14   18 o   40.881   8.0865   41.981   13.152   0.0000   0.0000   41.981   13.152  ?   ?    40.881   8.0865      ?      ? 
1 1 1   34   15    0 o   60.390   3.1272   77.903   10.880   77.903   10.880   77.903   10.880   60.390   4.4225   60.390   4.4225 0.000000 0.000000 
1 1 1   34   15    1 o   22.571   5.5304   11.245   6.4066   14.290   8.9157   7.9938   9.2123   24.647   7.8149   20.496   7.8276 4.151302 11.06086 
1 1 1   34   15    2 o   76.942   2.8437  126.137   8.9949  125.149   12.221  127.305   13.288   76.711   3.8625   77.173   4.1747 -0.4611816 5.687424 
1 1 1   34   15    3 o   21.345   5.5968   9.0910   6.5898   6.5903   8.9662   12.029   9.7180   19.526   7.6506   23.164   8.1709 -3.637608 11.19359 
1 1 1   34   15    4 o   60.314   3.2507   78.893   8.0159   83.106   10.853   73.835   11.890   62.301   4.2237   58.328   4.9425 3.973385 6.501425 
1 1 1   34   15    5 o   20.624   5.0865   7.1535   6.3295   16.491   8.5836  -3.9744   9.3705   26.262   7.5330   14.987   6.8371 11.27467 10.17308 
1 1 1   34   15    6 o   59.903   3.2618   77.419   8.0416   75.938   10.979   79.132   11.811   59.361   4.4845   60.446   4.7377 -1.084763 6.523517 
1 1 1   34   15    7 o   25.817   5.5964   15.661   6.7377   10.421   9.2461   21.593   9.8386   21.881   7.9399   29.754   7.8890 -7.872927 11.19279 
1 1 1   34   15    8 o   49.083   3.7248   52.844   7.5305   51.715   10.344   54.118   10.985   48.586   5.1618   49.581   5.3716 -0.9955368 7.449697 
1 1 1   34   15    9 o   40.361   4.9476   37.299   7.9959   31.422   10.637   44.935   12.124   36.298   7.3570   44.424   6.6173 -8.126118 9.895153 
1 1 1   34   15   10 o   86.757   3.1400  163.401   11.118  169.531   14.887  155.670   16.719   88.929   4.0588   84.585   4.7922 4.343887 6.280097 
1 1 1   34   15   11 o   61.634   3.7325   83.972   9.4065   86.685   12.657   80.627   14.058   63.043   4.8679   60.225   5.6596 2.817265 7.465092 
1 1 1   34   15   12 f   73.943   3.8355  120.640   11.639  125.435   17.467  116.810   15.610   75.051   5.6427   72.835   5.1964 2.215973 7.670907 
1 1 1   34   15   13 o   50.996   4.8725   61.899   9.6249   46.921   13.934   75.569   13.311   43.760   8.0156   58.231   5.5422 -14.47164 9.745064 
1 1 1   34   15   14 f   30.334   6.5340   28.470   10.786 -11.7046   26.705   36.302   11.791   22.165   10.563   38.502   7.6940 -16.33691 13.06807 
1 1 1   34   15   15 o   66.419   7.3936  136.922   14.513   81.368   29.660  154.410   16.641   49.048   13.981   83.790   4.8153 -34.74194 14.78713 
1 1 1   34   15   16 o   58.249   6.9810   86.617   12.974   95.008   28.441   84.412   14.579   55.474   12.704   61.023   5.7924 -5.549408 13.96203 
1 1 1   34   15   17 o   27.211   6.8791   21.148   10.926  -6.8184   25.784   27.269   12.062   22.289   10.552   32.134   8.8292 -9.845699 13.75826 
1 1 1   34   16    0 o   75.428   3.0373  120.903   13.264  120.903   13.264  120.903   13.264   75.428   4.2954   75.428   4.2954 0.000000 0.000000 
1 1 1   34   16    1 o   33.740   5.2553   27.058   7.1207   23.410   9.7372   31.251   10.440   31.124   7.6414   36.356   7.2168 -5.231962 10.51065 
1 1 1   34   16    2 o   35.892   4.9329   30.747   7.0596   38.712   9.7747   22.061   10.207   41.807   5.6688   29.976   8.0747 11.83116 9.865841 
1 1 1   34   16    3 o   31.794   4.9657   24.791   6.9269   38.351   9.6222   10.204   9.9799   41.634   5.6035   21.955   8.1995 19.67957 9.931334 
1 1 1   34   16    4 o   23.356   5.6606   12.595   6.5733   11.216   9.0222   14.155   9.5965   22.313   7.8728   24.398   8.1357 -2.085165 11.32126 
1 1 1   34   16    5 o   27.653   5.2804   17.502   6.6586   8.4506   8.9379   28.791   9.9818   20.484   7.7371   34.823   7.1882 -14.33902 10.56089 
1 1 1   34   16    6 o   38.429   4.6870   34.599   7.0906   42.351   9.9073   26.458   10.152   43.774   5.4875   33.084   7.6000 10.69024 9.374050 
1 1 1   34   16    7 o   28.847   5.7026   20.544   7.0503   19.879   10.235   21.144   9.7256   28.324   8.2553   29.370   7.8696 -1.046070 11.40527 
1 1 1   34   16    8 o   31.277   5.0872   22.801   7.1288   37.999   10.468   9.6539   9.7354   41.075   6.1788   21.479   8.0834 19.59648 10.17436 
1 1 1   34   16    9 f   67.158   3.6653   99.205   10.135  106.018   14.379   92.480   14.287   69.588   5.0100   64.728   5.3514 4.859146 7.330626 
1 1 1   34   16   10 o   42.331   5.1320   44.074   8.3477   55.153   11.283   30.679   12.407   49.856   5.4873   34.805   8.6741 15.05025 10.26407 
1 1 1   34   16   11 o   25.063   5.8411   15.244   7.4577   21.306   10.139   8.1002   11.007   29.161   8.1268   20.965   8.3921 8.196394 11.68210 
1 1 1   34   16   12 o   32.211   6.3440   26.855   8.7156   29.837   13.012   24.429   11.738   33.723   9.1308   30.698   8.8099 3.025501 12.68802 
1 1 1   34   16   13 o   29.788   6.4496   27.290   10.883 -15.2107   26.106   36.230   11.973   21.316   10.235   38.259   7.8510 -16.94292 12.89927 
1 1 1   34   16   14 o   19.763   6.2337   1.5260   10.233 -28.6155   24.259   8.0505   11.287   18.697   9.1750   20.829   8.4412 -2.132578 12.46737 
1 1 1   34   16   15 o   89.419   5.2555  192.455   16.190  188.372   32.795  193.771   18.616   85.102   9.3432   93.737   4.8152 -8.634354 10.51106 
1 1 1   34   16   16 o   21.794   6.9373   4.3603   10.548   5.2518   25.418   4.1749   11.593   24.402   11.180   19.185   8.2158 5.216219 13.87454 
1 1 1   34   17    0 o  102.774   2.7143  222.555   16.220  222.555   16.220  222.555   16.220  102.774   3.8385  102.774   3.8385 0.000000 0.000000 
1 1 1   34   17    1 o   82.650   2.8875  146.357   9.8349  154.903   14.130  138.327   13.697   85.030   4.0292   80.270   4.1372 4.759697 5.774993 
1 1 1   34   17    2 o   78.583   2.9777  132.763   9.6508  133.766   13.706  131.777   13.591   78.876   4.2130   78.290   4.2091 0.5856857 5.955351 
1 1 1   34   17    3 o   34.402   5.0437   28.505   7.2867   13.376   10.114   44.833   10.507   23.885   8.3421   44.920   5.6714 -21.03527 10.08736 
1 1 1   34   17    4 o   17.230   5.2009   2.1316   6.5320   1.7960   9.3526   2.4511   9.1268   17.159   7.3645   17.300   7.3459 -0.1412659 10.40184 
1 1 1   34   17    5 o   75.251   3.0765  122.592   9.4896  107.678   13.427  137.477   13.414   70.448   4.6211   80.053   4.0626 -9.604485 6.152994 
1 1 1   34   17    6 o   79.140   3.0068  134.978   9.8102  130.782   13.886  139.158   13.861   77.854   4.3245   80.426   4.1787 -2.572571 6.013549 
1 1 1   34   17    7 o   86.991   2.8768  162.594   10.313  161.951   14.864  163.191   14.321   86.750   4.1543   87.231   3.9806 -0.4805374 5.753559 
1 1 1   34   17    8 o   68.553   3.5048  103.095   9.8627  103.218   13.339  102.947   14.649   68.804   4.7005   68.301   5.2000 0.5032654 7.009609 
1 1 1   34   17    9 o   25.599   5.5642   13.781   7.3981   2.4833   9.8981   28.082   11.136   17.706   7.5872   33.491   8.1411 -15.78516 11.12845 
1 1 1   34   17   10 o   33.027   5.8617   27.026   8.1562   18.766   10.911   37.485   12.278   27.099   8.6510   38.956   7.9120 -11.85641 11.72345 
1 1 1   34   17   11 o   26.468   5.9477   14.173   8.5124   32.442   13.043   0.6164   11.235   35.221   8.9577   17.714   7.8269 17.50663 11.89541 
1 1 1   34   17   12 o   34.226   8.0985   27.783   10.841   53.370   26.320   22.556   11.897   39.242   13.471   29.210   8.9925 10.03266 16.19691 
1 1 1   34   17   13 o   25.858   7.6492   4.2142   12.267   41.081   25.370  -7.0340   14.013   34.631   13.046   17.085   7.9903 17.54621 15.29834 
1 1 1   34   17   14 o   39.388   8.0478   39.011   12.632   0.0000   0.0000   39.011   12.632  ?   ?    39.388   8.0478      ?      ? 
1 1 1   34   18    0 o   27.808   6.7927   22.291   9.9274   22.291   9.9274   22.291   9.9274   27.808   9.6064   27.808   9.6064 0.000000 0.000000 
1 1 1   34   18    1 o   27.339   5.7854   18.609   7.0317   18.351   9.9939   18.862   9.8956   27.148   8.2195   27.530   8.1440 -0.3822689 11.57089 
1 1 1   34   18    2 o   19.094   5.4424   5.9024   6.6007   5.2629   9.3488   6.5381   9.3208   18.761   7.6526   19.427   7.7405 -0.6652679 10.88475 
1 1 1   34   18    3 o   16.791   5.0704  -0.0032   6.5768   7.1177   9.4523  -6.6856   9.1567   19.796   7.8241   13.786   6.4513 6.009804 10.14084 
1 1 1   34   18    4 o   54.198   3.6895   64.779   8.2215   71.926   11.878   58.205   11.392   57.187   5.0358   51.209   5.3936 5.977524 7.379003 
1 1 1   34   18    5 o   35.749   5.1096   30.643   7.3834   26.722   10.631   34.296   10.262   32.793   7.9442   38.705   6.4282 -5.911930 10.21918 
1 1 1   34   18    6 o   52.865   3.8160   62.315   8.2942   60.160   12.061   64.248   11.424   51.814   5.6439   53.915   5.1374 -2.101353 7.631955 
1 1 1   34   18    7 o   32.937   5.5421   27.091   7.4296   24.948   10.781   29.030   10.253   31.375   8.2292   34.499   7.4257 -3.124340 11.08425 
1 1 1   34   18    8 o   52.384   4.2774   61.728   9.1825   53.649   12.299   71.902   13.802   48.471   6.1522   56.296   5.9443 -7.824387 8.554803 
1 1 1   34   18    9 o   38.914   6.5065   37.322   9.7567   31.918   11.794   49.038   17.367   35.497   8.2178   42.331   10.090 -6.833652 13.01296 
1 1 1   34   18   10 o   88.236   4.0805  178.469   14.137  167.523   23.324  184.826   17.773   84.738   6.6735   91.733   4.6976 -6.994820 8.161095 
1 1 1   34   18   11 o   68.293   4.0478  106.009   11.217  102.863   17.262  108.308   14.757   66.810   6.2646   69.776   5.1279 -2.966209 8.095682 
1 1 1   34   18   12 o   48.864   7.5553   67.988   11.954   65.629   28.242   68.502   13.194   42.842   13.941   54.887   5.8284 -12.04490 15.11057 
1 1 1   34   19    0 o   14.584   6.2231   5.7731   9.6700   5.7731   9.6700   5.7731   9.6700   14.584   8.8008   14.584   8.8008 0.000000 0.000000 
1 1 1   34   19    1 o   22.929   5.4749   11.098   7.0363   20.895   9.8396   0.8454   10.066   28.797   7.9988   17.061   7.4778 11.73536 10.94979 
1 1 1   34   19    2 o   23.003   5.5222   11.355   6.9224   2.8102   9.6592   20.377   9.9257   17.623   7.5218   28.382   8.0872 -10.75911 11.04443 
1 1 1   34   19    3 o   20.168   5.5860   7.2540   6.9424   12.132   10.075   2.8436   9.5800   22.760   8.2836   17.577   7.4963 5.182051 11.17192 
1 1 1   34   19    4 o   14.334   4.8012  -8.7440   7.4901  -5.6161   9.4520 -14.0231   12.280   14.278   6.6390   14.391   6.9375 -0.1131144 9.602304 
1 1 1   34   19    5 o   17.835   5.4502   1.6502   7.3247   6.0310   11.204  -1.6193   9.6795   19.875   8.2687   15.796   7.1025 4.078301 10.90032 
1 1 1   34   19    6 f   16.784   5.2003   0.8760   6.8732   0.7719   9.9829   0.9699   9.4771   16.917   7.4298   16.652   7.2780 0.2650738 10.40050 
1 1 1   34   19    7 o   38.849   5.4140   36.974   8.3480   32.840   11.314   41.914   12.368   36.314   7.7876   41.384   7.5232 -5.069664 10.82796 
1 1 1   34   19    8 o   59.950   3.8057   79.664   9.3583   71.415   12.489   90.224   14.131   56.467   5.3627   63.433   5.4013 -6.965572 7.611362 
1 1 1   34   19    9 o   38.030   6.0387   37.848   9.2454   32.410   13.804   42.273   12.451   34.575   9.4224   41.485   7.5552 -6.909389 12.07731 
1 1 1   34   19   10 o   46.684   5.0037   51.454   9.6005   55.513   14.331   48.150   12.931   48.233   7.2041   45.136   6.9460 3.096184 10.00730 
1 1 1   34   20    0 o   78.203   3.5760  132.418   16.155  132.418   16.155  132.418   16.155   78.203   5.0572   78.203   5.0572 0.000000 0.000000 
1 1 1   34   20    1 o   22.934   6.2536   11.601   8.0392   14.216   13.752   10.244   9.9086   24.383   9.4967   21.485   8.1388 2.898458 12.50714 
1 1 1   34   20    2 o   35.933   5.9223   35.401   8.7832   23.811   14.735   41.788   10.939   29.254   10.077   42.612   6.2241 -13.35885 11.84459 
1 1 1   34   20    3 o   38.924   5.0607   37.434   7.7427   25.408   11.087   48.882   10.817   31.331   8.4056   46.517   5.6382 -15.18576 10.12143 
1 1 1   34   20    4 o   50.903   4.1923   57.097   8.6513   72.855   13.741   46.749   11.135   56.557   5.8907   45.249   5.9667 11.30796 8.384595 
1 1 1   34   20    5 o   19.879   5.3705   4.8811   7.0147   16.274   10.174  -5.4426   9.6846   25.288   8.3743   14.471   6.7259 10.81710 10.74091 
1 1 1   34   20    6 o   58.583   3.5543   75.170   8.5269   88.275   12.886   64.961   11.373   63.128   4.9492   54.037   5.1028 9.091537 7.108689 
1 1 1   35    0    1 o   52.047   3.4485   58.313   10.258   58.313   10.258   58.313   10.258   52.047   4.8769   52.047   4.8769 0.000000 0.000000 
1 1 1   35    0    2 f   13.700   5.8434   4.3934   8.5182   4.3934   8.5182   4.3934   8.5182   13.700   8.2639   13.700   8.2639 0.000000 0.000000 
1 1 1   35    0    3 o   41.303   4.2646   38.246   9.6340   38.246   9.6340   38.246   9.6340   41.303   6.0311   41.303   6.0311 0.000000 0.000000 
1 1 1   35    0    4 o   19.776   6.7360   12.629   9.0065   12.629   9.0065   12.629   9.0065   19.776   9.5261   19.776   9.5261 0.000000 0.000000 
1 1 1   35    0    5 o   77.775   2.7183  127.116   12.263  127.116   12.263  127.116   12.263   77.775   3.8442   77.775   3.8442 0.000000 0.000000 
1 1 1   35    0    6 o   75.400   2.7314  119.573   11.941  119.573   11.941  119.573   11.941   75.400   3.8628   75.400   3.8628 0.000000 0.000000 
1 1 1   35    0    7 o   12.898   5.8065   1.7505   9.6083   1.7505   9.6083   1.7505   9.6083   12.898   8.2116   12.898   8.2116 0.000000 0.000000 
1 1 1   35    0    8 o   7.0326   3.6361 -22.1278   9.2525 -22.1278   9.2525 -22.1278   9.2525   7.0326   5.1422   7.0326   5.1422 0.000000 0.000000 
1 1 1   35    0    9 o   64.297   3.7533   89.107   13.855   89.107   13.855   89.107   13.855   64.297   5.3079   64.297   5.3079 0.000000 0.000000 
1 1 1   35    0   10 o   13.259   6.0039   1.6517   10.460   1.6517   10.460   1.6517   10.460   13.259   8.4909   13.259   8.4909 0.000000 0.000000 
1 1 1   35    0   11 o   22.312   7.4584   16.443   10.989   16.443   10.989   16.443   10.989   22.312   10.548   22.312   10.548 0.000000 0.000000 
1 1 1   35    0   12 o   21.257   7.4660   15.150   11.195   15.150   11.195   15.150   11.195   21.257   10.559   21.257   10.559 0.000000 0.000000 
1 1 1   35    0   13 o   32.810   7.1324   29.334   11.937   29.334   11.937   29.334   11.937   32.810   10.087   32.810   10.087 0.000000 0.000000 
1 1 1   35    0   14 o   44.905   5.2273   46.730   12.576   46.730   12.576   46.730   12.576   44.905   7.3925   44.905   7.3925 0.000000 0.000000 
1 1 1   35    0   15 o   77.593   3.5379  128.896   15.859  128.896   15.859  128.896   15.859   77.593   5.0034   77.593   5.0034 0.000000 0.000000 
1 1 1   35    0   16 f   83.198   5.6424  156.365   26.803  156.365   26.803  156.365   26.803   83.198   7.9795   83.198   7.9795 0.000000 0.000000 
1 1 1   35    1    0 o   49.339   3.5585   52.694   9.9966   52.694   9.9966   52.694   9.9966   49.339   5.0324   49.339   5.0324 0.000000 0.000000 
1 1 1   35    1    1 o   76.717   2.6944  124.109   8.5166  131.682   12.142  116.775   11.949   79.058   3.7237   74.375   3.8953 4.683174 5.388806 
1 1 1   35    1    2 o   27.350   5.3931   17.322   6.4079   13.605   9.0265   21.099   9.0983   24.526   7.8725   30.174   7.3734 -5.648111 10.78626 
1 1 1   35    1    3 o  111.779   2.3468  261.652   10.804  243.195   14.961  281.767   15.619  107.637   3.3701  115.921   3.2668 -8.283371 4.693559 
1 1 1   35    1    4 o   43.899   3.8771   41.704   7.0034   44.631   9.8704   38.736   9.9385   45.534   5.2557   42.264   5.7014 3.270023 7.754248 
1 1 1   35    1    5 o   80.193   2.6414  135.781   8.7137  124.524   12.305  147.105   12.341   76.782   3.8856   83.604   3.5790 -6.821777 5.282732 
1 1 1   35    1    6 o   25.841   5.5489   15.595   6.5860   11.474   9.8932   18.874   8.8259   23.215   8.2383   28.467   7.4357 -5.252275 11.09777 
1 1 1   35    1    7 o   43.755   4.4460   41.918   8.0040   38.454   10.923   45.935   11.763   41.790   6.3370   45.720   6.2379 -3.929588 8.892066 
1 1 1   35    1    8 o   28.141   6.1554   18.839   7.8764   17.663   10.982   20.083   11.302   27.339   8.6739   28.944   8.7361 -1.605070 12.31081 
1 1 1   35    1    9 o   75.249   3.4550  121.835   10.721  119.523   15.001  124.248   15.328   74.523   4.8806   75.975   4.8915 -1.451622 6.909907 
1 1 1   35    1   10 o   35.343   5.7691   30.039   8.2957   24.581   11.726   35.507   11.738   31.746   8.6982   38.940   7.5809 -7.193892 11.53820 
1 1 1   35    1   11 o   58.317   4.0065   74.444   9.6360   74.121   13.679   74.763   13.576   58.170   5.7016   58.464   5.6302 -0.2939644 8.012943 
1 1 1   35    1   12 o   45.882   4.8441   47.859   8.8500   56.012   12.633   40.000   12.402   50.370   6.0807   41.393   7.5424 8.977398 9.688249 
1 1 1   35    1   13 o   19.084   5.6923   3.2119   7.6710   2.1096   10.652   4.3995   11.056   18.453   7.8879   19.716   8.2092 -1.263441 11.38465 
1 1 1   35    1   14 o   62.549   3.9179   85.515   10.078   77.219   14.005   94.425   14.514   59.282   5.7281   65.815   5.3468 -6.533367 7.835733 
1 1 1   35    1   15 o   19.460   5.7296   4.0517   7.6642   1.1716   10.510   7.3227   11.201   17.866   7.7379   21.053   8.4520 -3.187208 11.45913 
1 1 1   35    1   16 o   30.921   11.539   25.327   19.757   0.0000   0.0000   25.327   19.757  ?   ?    30.921   11.539      ?      ? 
1 1 1   35    2    0 o   52.908   3.4125   60.169   10.330   60.169   10.330   60.169   10.330   52.908   4.8260   52.908   4.8260 0.000000 0.000000 
1 1 1   35    2    1 o   71.862   2.7666  108.865   8.1686  122.473   11.811   96.387   11.310   76.226   3.7567   67.499   4.0625 8.726883 5.533245 
1 1 1   35    2    2 o   54.705   3.2511   63.828   7.3117   57.657   10.272   70.164   10.410   51.945   4.7947   57.465   4.3920 -5.519180 6.502221 
1 1 1   35    2    3 o  100.052   2.4321  210.292   10.034  215.588   14.244  205.075   14.138  101.319   3.4087   98.785   3.4700 2.533569 4.864139 
1 1 1   35    2    4 o   13.500   4.3948  -6.2615   5.7675 -10.8262   8.0322  -1.4028   8.2868   11.775   5.6598   15.225   6.7248 -3.450643 8.789531 
1 1 1   35    2    5 o   60.521   3.0594   77.742   7.6212   84.722   10.958   71.203   10.606   63.199   4.2041   57.843   4.4458 5.356434 6.118767 
1 1 1   35    2    6 f   32.600   5.4167   24.849   7.1623   23.566   10.041   26.179   10.219   31.691   7.7473   33.509   7.5723 -1.817638 10.83331 
1 1 1   35    2    7 o   21.155   5.6560   7.9736   7.0488   12.317   9.4320   2.4787   10.609   23.595   8.0651   18.716   7.9319 4.878263 11.31198 
1 1 1   35    2    8 o   18.846   5.4947   4.0300   6.9233   5.4289   9.2868   2.2798   10.388   19.255   7.7080   18.437   7.8329 0.8180351 10.98948 
1 1 1   35    2    9 o   33.845   5.9412   27.599   8.2484   27.282   11.380   27.950   11.973   33.714   8.2508   33.976   8.5508 -0.2615662 11.88241 
1 1 1   35    2   10 o   35.618   5.5178   29.442   8.2505   17.360   11.199   43.784   12.201   26.999   8.7786   44.237   6.6873 -17.23774 11.03555 
1 1 1   35    2   11 o   24.764   6.1814   13.603   7.9113   10.866   10.872   16.683   11.534   22.950   8.5608   26.577   8.9193 -3.626537 12.36289 
1 1 1   35    2   12 o   40.912   5.4333   39.232   8.8206   38.712   12.144   39.813   12.832   40.727   7.5064   41.096   7.8572 -0.3685684 10.86651 
1 1 1   35    2   13 o   25.856   5.7558   13.895   7.9866   1.0769   11.298   26.699   11.292   18.462   8.0093   33.250   8.2685 -14.78836 11.51158 
1 1 1   35    2   14 o   34.778   5.9220   29.386   8.3946   30.178   11.911   28.604   11.833   35.286   8.3199   34.270   8.4298 1.015770 11.84404 
1 1 1   35    2   15 o   26.139   7.0936   13.371   9.6371   21.803   19.008   10.454   11.181   29.623   11.261   22.654   8.6302 6.968796 14.18729 
1 1 1   35    3    0 o   95.740   2.4789  191.610   13.801  191.610   13.801  191.610   13.801   95.740   3.5057   95.740   3.5057 0.000000 0.000000 
1 1 1   35    3    1 o   65.062   2.9740   89.954   7.9522   81.748   11.276   98.075   11.217   62.015   4.4083   68.109   3.9930 -6.093613 5.947924 
1 1 1   35    3    2 o   80.728   2.6400  137.390   8.7721  148.913   12.517  126.268   12.297   84.112   3.6081   77.343   3.8550 6.769684 5.280073 
1 1 1   35    3    3 o   19.494   5.2601   5.8186   6.1101   1.3457   8.4975   10.607   8.7921   16.665   7.0824   22.323   7.7790 -5.658459 10.52012 
1 1 1   35    3    4 o   40.240   4.3954   36.619   6.7996   24.220   9.5052   49.612   9.7308   32.356   7.2968   48.124   4.9025 -15.76881 8.790752 
1 1 1   35    3    5 o   21.393   5.5815   8.9193   6.6069   11.405   8.8973   5.8639   9.8643   22.876   7.8331   19.910   7.9534 2.965672 11.16303 
1 1 1   35    3    6 o   18.130   5.3115   2.3775   6.6978  -2.1694   9.3748   7.1182   9.5725   15.849   7.0676   20.412   7.9306 -4.563540 10.62291 
1 1 1   35    3    7 o  107.140   2.9605  242.909   12.918  237.614   16.903  250.344   20.028  105.975   3.8673  108.306   4.4836 -2.331108 5.920986 
1 1 1   35    3    8 o   46.092   4.4371   46.433   8.3581   43.402   10.974   50.620   12.898   44.459   5.9846   47.726   6.5527 -3.266838 8.874277 
1 1 1   35    3    9 o   36.543   5.6533   31.713   8.3068   37.127   11.955   26.658   11.551   39.876   7.5452   33.210   8.4209 6.665718 11.30667 
1 1 1   35    3   10 o   53.586   4.3191   63.498   9.5219   58.485   13.435   68.558   13.497   51.316   6.3477   55.856   5.8589 -4.539948 8.638288 
1 1 1   35    3   11 o   41.499   5.3571   40.143   8.8891   46.925   12.554   33.325   12.588   45.811   6.6443   37.186   8.4051 8.625088 10.71418 
1 1 1   35    3   12 o   32.776   6.5653   24.015   9.2809   15.605   11.547   39.363   15.598   25.910   8.9213   39.642   9.6345 -13.73197 13.13058 
1 1 1   35    3   13 o   53.395   4.3257   63.288   9.4794   69.513   13.340   56.938   13.473   56.270   5.7479   50.521   6.4658 5.748768 8.651326 
1 1 1   35    3   14 o   61.834   3.9908   83.609   10.111   71.458   13.867   97.399   14.773   56.874   5.9117   66.794   5.3626 -9.920033 7.981596 
1 1 1   35    3   15 o   35.403   8.5716   30.890   12.382   0.0000   0.0000   30.890   12.382  ?   ?    35.403   8.5716      ?      ? 
1 1 1   35    3   16 o   44.860   10.866   54.162   19.891   0.0000   0.0000   54.162   19.891  ?   ?    44.860   10.866      ?      ? 
1 1 1   35    3   17 o   16.968   8.1619 -17.3690   16.775   0.0000   0.0000 -17.3690   16.775  ?   ?    16.968   8.1619      ?      ? 
1 1 1   35    4    0 o   16.285   6.3435   8.2763   8.7391   8.2763   8.7391   8.2763   8.7391   16.285   8.9711   16.285   8.9711 0.000000 0.000000 
1 1 1   35    4    1 f   42.045   4.2602   39.338   7.0768   47.151   9.9967   31.489   10.020   46.821   5.1766   37.269   6.7677 9.552567 8.520480 
1 1 1   35    4    2 o   37.267   4.5743   30.932   6.8879   29.858   9.6679   32.040   9.8157   36.293   6.7057   38.242   6.2233 -1.948597 9.148510 
1 1 1   35    4    3 o   41.064   4.1845   36.749   7.0793   36.710   9.7888   36.792   10.250   41.093   5.7756   41.034   6.0567 0.5905914E-01 8.369016 
1 1 1   35    4    4 o   44.820   3.9746   43.894   7.2763   46.657   9.8605   40.590   10.782   46.564   5.1344   43.076   6.0686 3.487843 7.949177 
1 1 1   35    4    5 o   41.114   4.5703   37.653   7.5323   43.077   10.881   32.662   10.437   44.404   5.9414   37.824   6.9463 6.580276 9.140633 
1 1 1   35    4    6 o   55.759   3.9262   67.941   8.9346   71.135   12.006   63.977   13.376   57.473   5.0649   54.044   6.0006 3.428822 7.852404 
1 1 1   35    4    7 o   54.216   4.8239   64.687   9.8822   63.233   11.796   68.110   18.096   54.037   5.2928   54.394   8.0663 -0.3566589 9.647787 
1 1 1   35    4    8 o   58.244   4.7943   77.743   10.505   81.107   12.738   70.592   18.573   61.287   5.0394   55.201   8.1577 6.086639 9.588680 
1 1 1   35    4    9 o   47.948   4.5849   51.211   9.0576   48.549   12.778   53.899   12.841   46.605   6.6478   49.292   6.3160 -2.686810 9.169856 
1 1 1   35    4   10 o   28.502   6.3258   19.712   8.2831   19.355   11.805   20.059   11.625   28.271   8.9954   28.733   8.8966 -0.4621944 12.65169 
1 1 1   35    4   11 o   17.931   5.2985  -1.5143   7.4641   10.110   10.398 -13.8734   10.721   22.350   8.3651   13.511   6.5056 8.838773 10.59707 
1 1 1   35    4   12 o   81.655   3.4132  143.639   11.493  140.083   16.120  147.315   16.390   80.611   4.8486   82.698   4.8052 -2.086761 6.826355 
1 1 1   35    4   13 o   35.791   5.8475   30.990   8.4954   26.485   11.969   35.564   12.060   32.846   8.6975   38.736   7.8182 -5.890030 11.69493 
1 1 1   35    4   14 o   74.416   3.5663  120.298   10.939  117.302   15.603  123.194   15.340   73.423   5.1525   75.409   4.9322 -1.986443 7.132663 
1 1 1   35    4   15 o   32.560   8.5153   26.234   11.565   0.0000   0.0000   26.234   11.565  ?   ?    32.560   8.5153      ?      ? 
1 1 1   35    4   16 o   23.324   10.085   6.3999   17.792   0.0000   0.0000   6.3999   17.792  ?   ?    23.324   10.085      ?      ? 
1 1 1   35    4   17 o   34.593   11.834   34.459   20.308   0.0000   0.0000   34.459   20.308  ?   ?    34.593   11.834      ?      ? 
1 1 1   35    5    0 o   13.588   5.9083   3.7406   9.0806   3.7406   9.0806   3.7406   9.0806   13.588   8.3556   13.588   8.3556 0.000000 0.000000 
1 1 1   35    5    1 o   36.554   4.7053   30.123   6.8508   37.817   9.8677   22.963   9.5187   41.709   5.7362   31.400   7.4603 10.30872 9.410628 
1 1 1   35    5    2 f   28.709   5.4201   19.196   6.5914   22.837   9.5281   15.855   9.1279   31.296   7.4829   26.123   7.8433 5.173107 10.84028 
1 1 1   35    5    3 o   17.441   5.3933   0.1316   7.0696   1.0333   8.6646  -1.6641   12.228   16.621   7.1098   18.261   8.1119 -1.639559 10.78665 
1 1 1   35    5    4 o   73.159   3.3427  114.279   10.025  117.215   15.101  111.965   13.406   73.864   4.9568   72.454   4.4860 1.409729 6.685324 
1 1 1   35    5    5 o   17.711   5.1921   0.9015   6.7442  -7.1887   9.7393   8.3549   9.3481   14.433   6.7203   20.990   7.9164 -6.556998 10.38424 
1 1 1   35    5    6 o   27.638   5.5426   17.911   7.5587   28.561   10.228   5.0955   11.220   35.051   7.3117   20.225   8.3318 14.82579 11.08512 
1 1 1   35    5    7 o   28.135   5.9916   18.946   7.5039   18.731   10.155   19.204   11.137   28.007   8.2401   28.263   8.7005 -0.2555561 11.98327 
1 1 1   35    5    8 f   41.417   4.9220   39.572   8.0706   44.187   10.984   34.156   11.898   44.817   5.9422   38.016   7.8482 6.801300 9.844023 
1 1 1   35    5    9 o   18.081   5.3320   1.9502   6.9896   7.7138   9.4747  -4.9317   10.353   20.558   7.9170   15.604   7.1444 4.953904 10.66399 
1 1 1   35    5   10 o   25.810   6.0808   14.872   7.9099   21.825   11.446   8.5151   10.944   29.929   8.7319   21.690   8.4651 8.238850 12.16153 
1 1 1   35    5   11 o   54.094   4.8907   66.717   9.7725  101.275   14.506   38.001   13.223   68.365   5.1446   39.823   8.3191 28.54189 9.781361 
1 1 1   35    5   12 o   52.819   4.4743   62.315   9.6712   54.362   13.745   70.115   13.611   49.184   6.7756   56.455   5.8454 -7.271168 8.948568 
1 1 1   35    5   13 o   29.623   6.1871   21.615   8.2999   15.993   11.966   26.827   11.522   26.083   9.0759   33.163   8.4114 -7.079893 12.37428 
1 1 1   35    5   14 o   53.977   5.4841   70.761   11.013   58.758   18.132   77.778   13.863   48.537   9.3970   59.417   5.6567 -10.88008 10.96820 
1 1 1   35    5   15 o   58.246   5.8786   75.440   14.122   0.0000   0.0000   75.440   14.122  ?   ?    58.246   5.8786      ?      ? 
1 1 1   35    5   16 o   59.799   9.0702   88.093   22.370   0.0000   0.0000   88.093   22.370  ?   ?    59.799   9.0702      ?      ? 
1 1 1   35    5   17 o   19.094   8.9462  -9.2130   17.701   0.0000   0.0000  -9.2130   17.701  ?   ?    19.094   8.9462      ?      ? 
1 1 1   35    6    0 o   11.369   5.4178  -3.6210   10.360  -3.6210   10.360  -3.6210   10.360   11.369   7.6619   11.369   7.6619 0.000000 0.000000 
1 1 1   35    6    1 o   81.277   3.0993  141.840   10.098  146.006   12.975  135.440   16.082   83.132   3.7841   79.422   4.9095 3.709885 6.198609 
1 1 1   35    6    2 o   26.787   6.3755   15.583   8.0435   21.437   13.672   12.485   9.9470   29.756   9.7008   23.818   8.2755 5.937984 12.75108 
1 1 1   35    6    3 o   59.699   3.4636   76.675   8.5113   71.661   12.075   81.626   11.998   57.667   5.0770   61.730   4.7126 -4.062939 6.927108 
1 1 1   35    6    4 f   53.986   3.7716   63.757   8.2588   51.268   11.715   76.098   11.645   48.402   5.8682   59.569   4.7396 -11.16743 7.543210 
1 1 1   35    6    5 o   20.838   5.5715   7.1255   6.8621   13.220   9.9607   1.6202   9.4671   24.222   8.2880   17.454   7.4481 6.768232 11.14294 
1 1 1   35    6    6 o   50.285   4.3253   57.083   8.7025   68.333   11.926   44.270   12.727   56.194   5.1457   44.376   6.9538 11.81753 8.650656 
1 1 1   35    6    7 o   35.647   5.6118   30.590   8.0306   33.872   10.843   26.603   11.952   38.261   7.1335   33.032   8.6649 5.229515 11.22351 
1 1 1   35    6    8 o   58.207   3.7710   73.466   9.0189   71.385   12.171   76.000   13.431   57.402   5.1409   59.012   5.5183 -1.610634 7.541915 
1 1 1   35    6    9 o   42.752   5.1755   43.463   8.5631   56.280   11.859   29.497   12.378   50.709   5.6700   34.794   8.6598 15.91516 10.35091 
1 1 1   35    6   10 o   67.452   3.7330   98.808   10.354  108.883   14.831   89.227   14.462   70.940   5.0689   63.965   5.4817 6.975079 7.466086 
1 1 1   35    6   11 o   65.404   3.7824   93.130   10.201   95.025   14.396   91.219   14.457   66.117   5.2791   64.690   5.4184 1.426476 7.564874 
1 1 1   35    6   12 o   37.871   5.7276   34.466   8.6807   37.644   12.186   31.192   12.369   39.956   7.6734   35.786   8.5053 4.169731 11.45521 
1 1 1   35    6   13 o   35.154   5.9515   30.335   8.5595   34.393   11.992   26.121   12.221   37.903   7.9259   32.405   8.8804 5.497562 11.90300 
1 1 1   35    6   14 o   37.600   6.4005   34.598   9.5987   40.023   15.584   31.282   12.184   39.528   9.6444   35.672   8.4172 3.856041 12.80092 
1 1 1   35    6   15 o   26.676   10.934   15.049   19.202   0.0000   0.0000   15.049   19.202  ?   ?    26.676   10.934      ?      ? 
1 1 1   35    6   16 o   24.009   10.442   7.1091   19.301   0.0000   0.0000   7.1091   19.301  ?   ?    24.009   10.442      ?      ? 
1 1 1   35    6   17 o   24.426   10.398   9.6300   18.368   0.0000   0.0000   9.6300   18.368  ?   ?    24.426   10.398      ?      ? 
1 1 1   35    6   18 o   32.183   11.821   30.025   20.585   0.0000   0.0000   30.025   20.585  ?   ?    32.183   11.821      ?      ? 
1 1 1   35    7    0 o   41.955   4.7566   40.244   10.743   40.244   10.743   40.244   10.743   41.955   6.7269   41.955   6.7269 0.000000 0.000000 
1 1 1   35    7    1 o   33.992   5.3195   27.076   7.2650   28.989   10.325   25.201   10.224   35.301   7.3314   32.682   7.7096 2.619408 10.63892 
1 1 1   35    7    2 o   82.183   2.9466  143.678   9.9873  142.531   14.133  144.821   14.116   81.843   4.1868   82.522   4.1473 -0.6787033 5.893150 
1 1 1   35    7    3 o   40.669   4.6619   37.464   7.5770   33.848   10.985   40.745   10.465   38.240   7.2301   43.097   5.8872 -4.857235 9.323770 
1 1 1   35    7    4 o   56.202   3.5900   68.264   8.3205   66.817   11.727   69.732   11.807   55.582   5.1154   56.822   5.0382 -1.239384 7.179919 
1 1 1   35    7    5 o   31.280   5.4126   23.606   7.7442   35.189   10.571   10.189   11.377   39.780   6.4430   22.779   8.6991 17.00119 10.82523 
1 1 1   35    7    6 o   25.612   6.4571   12.736   8.7095   23.450   14.138   6.1831   11.056   30.659   9.8539   20.565   8.3475 10.09423 12.91428 
1 1 1   35    7    7 o   48.921   5.4652   57.498   10.228   44.886   15.707   66.782   13.476   42.760   9.1808   55.082   5.9320 -12.32243 10.93046 
1 1 1   35    7    8 o   21.539   5.9028   8.3327   7.4751   6.4580   10.102   10.601   11.112   20.190   8.0541   22.887   8.6314 -2.697071 11.80550 
1 1 1   35    7    9 o   22.986   5.9492   11.051   7.4903   14.023   10.245   7.6387   10.978   24.725   8.4059   21.246   8.4210 3.478983 11.89837 
1 1 1   35    7   10 o   18.720   5.5465   2.2837   7.4699   7.8583   10.527  -3.3702   10.601   21.125   8.2862   16.314   7.3751 4.810394 11.09290 
1 1 1   35    7   11 o   66.538   4.6184   95.908   11.911   90.035   14.394  108.662   21.213   64.213   5.4350   68.864   7.4686 -4.651047 9.236798 
1 1 1   35    7   12 o   68.484   3.7955  102.613   10.683  112.735   15.183   92.688   15.034   72.013   5.1119   64.956   5.6117 7.057060 7.590928 
1 1 1   35    7   13 o   56.889   4.8581   72.111   10.883   78.814   18.605   68.624   13.419   58.126   7.7606   55.652   5.8461 2.473621 9.716127 
1 1 1   35    7   14 f   65.076   5.4164   93.220   14.538   0.0000   0.0000   93.220   14.538  ?   ?    65.076   5.4164      ?      ? 
1 1 1   35    7   15 o   34.916   8.4140   30.284   11.974   0.0000   0.0000   30.284   11.974  ?   ?    34.916   8.4140      ?      ? 
1 1 1   35    7   16 o   60.676   9.4555   92.292   23.663   0.0000   0.0000   92.292   23.663  ?   ?    60.676   9.4555      ?      ? 
1 1 1   35    7   17 o   74.290   8.4081  133.974   25.763   0.0000   0.0000  133.974   25.763  ?   ?    74.290   8.4081      ?      ? 
1 1 1   35    7   18 o   39.133   11.944   45.940   21.042   0.0000   0.0000   45.940   21.042  ?   ?    39.133   11.944      ?      ? 
1 1 1   35    8    0 o   10.881   5.1671  -2.8548   9.2665  -2.8548   9.2665  -2.8548   9.2665   10.881   7.3073   10.881   7.3073 0.000000 0.000000 
1 1 1   35    8    1 o   19.791   5.4246   5.4828   6.7205  -0.8064   9.4579   11.897   9.5511   16.372   7.2101   23.210   8.1067 -6.838730 10.84910 
1 1 1   35    8    2 o   72.618   3.1080  112.734   9.2922  121.448   13.250  104.301   13.034   75.459   4.2575   69.777   4.5291 5.681496 6.216044 
1 1 1   35    8    3 o   32.278   5.3283   24.739   7.3612   15.201   10.540   33.824   10.286   25.544   8.5264   39.012   6.3925 -13.46736 10.65665 
1 1 1   35    8    4 f   53.020   3.7819   61.389   8.1865   51.508   11.512   71.500   11.644   48.465   5.7590   57.575   4.9037 -9.109818 7.563843 
1 1 1   35    8    5 o   74.041   3.0780  117.321   9.3832  110.824   13.365  123.635   13.177   71.924   4.5054   76.157   4.1950 -4.233147 6.155998 
1 1 1   35    8    6 o   92.564   3.0995  182.086   11.726  175.402   15.460  191.141   17.994   90.760   4.1299   94.369   4.6230 -3.608986 6.199060 
1 1 1   35    8    7 o   48.423   6.1129   62.721   10.148   71.656   12.045   40.860   18.841   57.549   5.0746   39.297   11.123 18.25269 12.22574 
1 1 1   35    8    8 o   23.921   5.8104   12.137   7.4839   19.288   10.318   4.1970   10.872   28.321   8.2983   19.520   8.1351 8.800974 11.62075 
1 1 1   35    8    9 o   18.715   5.2760   0.8955   7.2261   12.634   9.9323 -12.3049   10.533   23.735   8.2681   13.696   6.5561 10.03853 10.55201 
1 1 1   35    8   10 o   65.815   3.5624   93.365   9.6185   89.280   12.849   98.570   14.506   64.306   4.8447   67.324   5.2240 -3.018028 7.124704 
1 1 1   35    8   11 o   51.396   4.5413   59.057   9.6205   61.353   13.908   56.951   13.322   52.340   6.4428   50.452   6.4019 1.887424 9.082654 
1 1 1   35    8   12 o   93.429   4.2472  191.459   15.081  200.998   27.342  187.289   18.079   93.772   7.0696   93.086   4.7090 0.6862640 8.494374 
1 1 1   35    8   13 o   47.668   5.6171   55.136   10.197   49.552   16.662   58.480   12.893   44.221   9.4237   51.116   6.1156 -6.895138 11.23414 
1 1 1   35    8   15 o   24.996   8.8816   14.869   11.502   0.0000   0.0000   14.869   11.502  ?   ?    24.996   8.8816      ?      ? 
1 1 1   35    8   16 o   80.626   8.0696  155.631   26.834   0.0000   0.0000  155.631   26.834  ?   ?    80.626   8.0696      ?      ? 
1 1 1   35    8   17 o   30.042   11.634   24.989   20.549   0.0000   0.0000   24.989   20.549  ?   ?    30.042   11.634      ?      ? 
1 1 1   35    8   18 o   24.884   10.628   11.675   19.305   0.0000   0.0000   11.675   19.305  ?   ?    24.884   10.628      ?      ? 
1 1 1   35    9    0 o   19.004   6.9402   11.996   9.8806   11.996   9.8806   11.996   9.8806   19.004   9.8149   19.004   9.8149 0.000000 0.000000 
1 1 1   35    9    1 o   46.537   4.1240   47.868   7.8286   55.237   11.032   40.393   11.111   50.415   5.3056   42.660   6.3150 7.755165 8.247947 
1 1 1   35    9    2 o   79.345   3.6259  137.071   11.789  145.821   16.170  127.142   17.225   82.324   4.7624   76.367   5.4687 5.956978 7.251701 
1 1 1   35    9    3 o   64.572   3.3879   89.937   8.9790   79.737   12.645  100.309   12.752   60.722   5.0492   68.422   4.5187 -7.700733 6.775882 
1 1 1   35    9    4 o   56.475   3.6073   68.780   8.3180   82.615   12.157   56.600   11.406   61.971   4.7562   50.978   5.4248 10.99328 7.214575 
1 1 1   35    9    5 o   87.446   3.1141  162.613   11.147  156.354   14.770  170.898   16.991   85.656   4.1807   89.236   4.6166 -3.579643 6.228292 
1 1 1   35    9    6 o   56.655   3.8718   69.095   8.9879   61.600   11.927   78.944   13.672   53.166   5.4393   60.144   5.5116 -6.977871 7.743628 
1 1 1   35    9    7 o   67.332   3.5899  100.349   9.7153  116.026   13.158   81.559   14.405   73.683   4.3298   60.981   5.7275 12.70170 7.179899 
1 1 1   35    9    8 o   23.353   5.7776   11.464   7.4642   18.183   10.003   3.0218   11.212   27.526   8.1983   19.180   8.1430 8.345978 11.55513 
1 1 1   35    9    9 o   42.061   5.0396   41.894   8.2323   52.689   11.362   29.962   11.945   49.004   5.6214   35.118   8.3660 13.88618 10.07923 
1 1 1   35    9   10 f   25.944   6.1846   16.006   7.8324   15.902   10.753   16.124   11.432   25.847   8.6116   26.041   8.8791 -0.1935921 12.36925 
1 1 1   35    9   11 o   28.445   6.3320   20.065   8.2863   20.201   12.005   19.941   11.452   28.503   9.0716   28.386   8.8365 0.1177177 12.66402 
1 1 1   35    9   12 o   55.272   4.8662   66.161   10.676   84.099   18.387   57.037   13.113   60.198   7.4057   50.346   6.3149 9.851593 9.732495 
1 1 1   35    9   13 o   26.142   6.4827   16.738   8.6191   14.275   14.085   18.212   10.898   25.170   9.6629   27.113   8.6446 -1.943413 12.96539 
1 1 1   35    9   14 o   66.333   5.3608   96.991   14.667   0.0000   0.0000   96.991   14.667  ?   ?    66.333   5.3608      ?      ? 
1 1 1   35    9   15 o   24.971   8.9450   14.877   11.689   0.0000   0.0000   14.877   11.689  ?   ?    24.971   8.9450      ?      ? 
1 1 1   35    9   16 o   58.373   9.5651   86.830   23.029   0.0000   0.0000   86.830   23.029  ?   ?    58.373   9.5651      ?      ? 
1 1 1   35    9   17 o   23.193   10.159   6.7229   18.552   0.0000   0.0000   6.7229   18.552  ?   ?    23.193   10.159      ?      ? 
1 1 1   35    9   18 o   76.811   8.5261  147.115   27.011   0.0000   0.0000  147.115   27.011  ?   ?    76.811   8.5261      ?      ? 
1 1 1   35   10    0 o   13.704   6.0499   3.3413   9.8818   3.3413   9.8818   3.3413   9.8818   13.704   8.5558   13.704   8.5558 0.000000 0.000000 
1 1 1   35   10    1 o   35.799   5.2806   30.147   7.5477   26.689   10.701   33.570   10.648   33.468   7.8823   38.131   7.0292 -4.663162 10.56126 
1 1 1   35   10    2 o   24.202   5.9093   10.116   7.6575   23.151   12.283   1.8278   9.7939   30.665   9.0737   17.740   7.5729 12.92511 11.81864 
1 1 1   35   10    3 o   64.960   3.7657   92.953   9.8025   85.849   15.431   97.759   12.692   62.402   5.9955   67.517   4.5579 -5.114658 7.531330 
1 1 1   35   10    4 f   23.510   5.3089   10.722   6.8851   22.041   9.6599  -0.9656   9.8159   30.443   7.6908   16.576   7.3204 13.86704 10.61771 
1 1 1   35   10    5 o   86.265   3.1562  159.396   11.141  159.308   14.865  159.509   16.828   86.443   4.1693   86.086   4.7394 0.3561172 6.312303 
1 1 1   35   10    6 o   49.464   4.2404   53.441   8.6003   46.788   11.528   61.791   12.914   45.986   6.0783   52.943   5.9143 -6.956596 8.480811 
1 1 1   35   10    7 o   19.593   5.6064   4.0670   7.3804  -2.2743   10.254   10.882   10.631   16.389   7.3442   22.796   8.4728 -6.406649 11.21272 
1 1 1   35   10    8 o   65.022   3.6133   91.495   9.6298   88.450   12.838   95.413   14.561   63.944   4.8677   66.100   5.3412 -2.155521 7.226576 
1 1 1   35   10    9 f   37.028   5.5143   32.875   8.1095   33.607   10.862   31.952   12.189   37.860   7.2197   36.195   8.3369 1.665379 11.02852 
1 1 1   35   10   10 o   25.369   6.1224   15.308   7.6915   14.529   10.819   16.103   10.936   24.866   8.6313   25.872   8.6853 -1.005722 12.24475 
1 1 1   35   10   11 o   66.738   4.4679   96.678   11.672  112.362   20.484   89.137   14.204   69.849   7.1102   63.628   5.4124 6.221840 8.935822 
1 1 1   35   10   12 o   49.935   5.1843   54.348   10.254   72.119   17.807   45.532   12.542   55.274   7.8108   44.595   6.8190 10.67939 10.36855 
1 1 1   35   10   13 o   66.705   5.2721   97.880   14.505   0.0000   0.0000   97.880   14.505  ?   ?    66.705   5.2721      ?      ? 
1 1 1   35   10   14 o   53.338   5.8841   63.659   12.944   0.0000   0.0000   63.659   12.944  ?   ?    53.338   5.8841      ?      ? 
1 1 1   35   10   15 o   60.021   8.8486   89.223   21.905   0.0000   0.0000   89.223   21.905  ?   ?    60.021   8.8486      ?      ? 
1 1 1   35   10   16 o   29.734   11.436   24.739   19.750   0.0000   0.0000   24.739   19.750  ?   ?    29.734   11.436      ?      ? 
1 1 1   35   10   17 o   45.666   11.929   62.443   22.715   0.0000   0.0000   62.443   22.715  ?   ?    45.666   11.929      ?      ? 
1 1 1   35   10   18 o   21.894   9.9377   1.6796   19.481   0.0000   0.0000   1.6796   19.481  ?   ?    21.894   9.9377      ?      ? 
1 1 1   35   11    0 o  117.272   2.6374  288.328   18.000  288.328   18.000  288.328   18.000  117.272   3.7299  117.272   3.7299 0.000000 0.000000 
1 1 1   35   11    1 o   30.354   5.6378   22.274   7.3005   16.765   10.455   27.515   10.198   26.526   8.4684   34.181   7.4447 -7.655376 11.27552 
1 1 1   35   11    2 o   93.232   2.8376  184.839   10.908  191.075   15.635  178.924   15.226   94.773   3.9998   91.692   4.0261 3.081512 5.675216 
1 1 1   35   11    3 o   27.561   5.7448   18.039   7.0841   22.509   10.244   13.942   9.8075   30.574   8.0226   24.547   8.2248 6.026981 11.48955 
1 1 1   35   11    4 o   25.337   5.9824   15.035   7.5157   18.585   10.198   10.814   11.119   27.755   8.2808   22.920   8.6362 4.834517 11.96472 
1 1 1   35   11    5 o   22.732   5.3944   6.7453   7.1748  -5.4251   9.4590   23.234   11.010   14.628   6.7454   30.836   8.4200 -16.20877 10.78875 
1 1 1   35   11    6 o   36.100   5.4329   30.301   8.0273   22.312   10.844   39.985   11.940   30.196   8.4006   42.004   6.8917 -11.80837 10.86578 
1 1 1   35   11    7 o   61.435   4.1681   83.650   10.499   83.180   15.667   84.033   14.144   61.034   6.2238   61.835   5.5458 -0.8010635 8.336116 
1 1 1   35   11    8 o   70.358   3.8384  107.935   11.079  116.199   16.746  101.502   14.775   72.604   5.5921   68.111   5.2595 4.492813 7.676848 
1 1 1   35   11    9 o   26.305   6.0328   16.527   7.6541   11.829   10.610   21.626   11.052   23.132   8.4885   29.478   8.5747 -6.346006 12.06565 
1 1 1   35   11   10 o   46.865   4.4216   49.405   8.5283   48.864   11.668   50.026   12.496   46.711   6.0563   47.018   6.4439 -0.3069649 8.843175 
1 1 1   35   11   11 o   22.731   6.3670   10.069   9.0081   4.3870   14.821   13.398   11.344   21.338   9.2153   24.124   8.7883 -2.785740 12.73410 
1 1 1   35   11   12 o   37.280   6.0411   38.939   9.6901   17.883   16.222   50.619   12.082   27.149   10.383   47.411   6.1788 -20.26184 12.08226 
1 1 1   35   11   13 o   26.150   8.9186   16.899   11.534   0.0000   0.0000   16.899   11.534  ?   ?    26.150   8.9186      ?      ? 
1 1 1   35   11   14 o   41.792   7.6348   42.187   12.675   0.0000   0.0000   42.187   12.675  ?   ?    41.792   7.6348      ?      ? 
1 1 1   35   11   15 o   34.122   11.605   34.665   19.527   0.0000   0.0000   34.665   19.527  ?   ?    34.122   11.605      ?      ? 
1 1 1   35   11   16 o   29.014   11.596   23.506   20.982   0.0000   0.0000   23.506   20.982  ?   ?    29.014   11.596      ?      ? 
1 1 1   35   11   17 o   64.538   9.2616  107.649   24.653   0.0000   0.0000  107.649   24.653  ?   ?    64.538   9.2616      ?      ? 
1 1 1   35   11   18 o   15.844   7.8094 -27.6318   18.213   0.0000   0.0000 -27.6318   18.213  ?   ?    15.844   7.8094      ?      ? 
1 1 1   35   12    0 o  102.427   2.7608  220.705   16.440  220.705   16.440  220.705   16.440  102.427   3.9043  102.427   3.9043 0.000000 0.000000 
1 1 1   35   12    1 o   50.785   3.9277   56.720   8.2049   52.823   11.694   60.499   11.515   48.927   5.7947   52.642   5.3038 -3.714520 7.855464 
1 1 1   35   12    2 o   65.798   3.2772   93.290   8.8929   94.493   12.683   92.126   12.473   66.210   4.6443   65.387   4.6250 0.8227386 6.554413 
1 1 1   35   12    3 o   27.187   5.5944   17.332   6.9938   10.366   9.6625   24.999   10.136   22.093   8.1014   32.282   7.7174 -10.18896 11.18889 
1 1 1   35   12    4 f   95.667   3.0178  195.833   11.800  193.996   15.651  198.251   17.962   95.384   3.9783   95.950   4.5388 -0.5659866 6.035542 
1 1 1   35   12    5 o   52.309   4.0737   60.033   8.7519   54.924   11.749   66.402   13.118   49.858   5.7134   54.760   5.8083 -4.901787 8.147303 
1 1 1   35   12    6 o   80.616   3.1878  139.960   10.522  138.763   14.044  141.492   15.887   80.431   4.2336   80.801   4.7671 -0.3701324 6.375580 
1 1 1   35   12    7 o   25.265   5.9887   14.810   7.5035   10.239   10.228   20.137   11.042   22.075   8.2897   28.454   8.6452 -6.379360 11.97743 
1 1 1   35   12    8 o   53.701   4.0631   63.456   8.9414   54.570   12.067   74.276   13.315   49.455   5.9159   57.946   5.5713 -8.491379 8.126288 
1 1 1   35   12    9 o   19.460   5.6476   4.0445   7.5697  -2.0951   10.540   10.586   10.879   16.501   7.4161   22.418   8.5195 -5.917473 11.29516 
1 1 1   35   12   10 o   32.581   6.2279   27.607   8.8607   19.664   13.354   33.856   11.844   27.872   9.5940   37.291   7.9437 -9.418991 12.45578 
1 1 1   35   12   11 o   51.369   5.4176   64.303   10.486   55.410   17.092   69.670   13.279   46.824   9.1785   55.913   5.7581 -9.088200 10.83518 
1 1 1   35   12   12 o   43.964   5.9462   45.992   10.007   54.706   17.051   41.414   12.358   46.338   9.2459   41.591   7.4794 4.747345 11.89235 
1 1 1   35   12   13 o   40.047   7.5404   38.751   11.998   0.0000   0.0000   38.751   11.998  ?   ?    40.047   7.5404      ?      ? 
1 1 1   35   12   14 f   58.675   5.8469   77.680   14.150   0.0000   0.0000   77.680   14.150  ?   ?    58.675   5.8469      ?      ? 
1 1 1   35   12   15 o   33.455   11.625   33.960   19.630   0.0000   0.0000   33.960   19.630  ?   ?    33.455   11.625      ?      ? 
1 1 1   35   12   16 o   21.993   9.8102   4.0244   18.074   0.0000   0.0000   4.0244   18.074  ?   ?    21.993   9.8102      ?      ? 
1 1 1   35   12   17 o   26.754   11.062   18.147   19.875   0.0000   0.0000   18.147   19.875  ?   ?    26.754   11.062      ?      ? 
1 1 1   35   13    0 o   28.086   6.9020   22.663   10.211   22.663   10.211   22.663   10.211   28.086   9.7609   28.086   9.7609 0.000000 0.000000 
1 1 1   35   13    1 o   99.089   2.7585  209.385   11.254  193.724   15.750  225.727   16.088   95.210   4.0107  102.969   3.7882 -7.758499 5.516921 
1 1 1   35   13    2 o   23.400   5.6160   12.038   6.7966   18.148   9.7404   6.2397   9.4883   27.279   8.0823   19.521   7.7995 7.757320 11.23194 
1 1 1   35   13    3 o   21.055   5.5127   6.1215   7.1293  -3.2792   9.6462   17.438   10.584   15.423   6.9974   26.687   8.5202 -11.26410 11.02532 
1 1 1   35   13    4 o   36.354   5.4620   31.574   7.9140   28.572   10.654   35.271   11.821   34.408   7.6995   38.301   7.7494 -3.892372 10.92404 
1 1 1   35   13    5 o   23.472   5.9543   12.518   7.2947   12.028   9.7906   13.130   10.937   23.016   8.1926   23.928   8.6427 -0.9116764 11.90854 
1 1 1   35   13    6 o   43.364   4.6171   42.361   8.2208   37.533   11.127   48.165   12.199   40.592   6.6462   46.135   6.4108 -5.543358 9.234186 
1 1 1   35   13    7 o   65.421   3.5375   93.539   9.5062   93.575   12.893   93.495   14.072   65.607   4.7646   65.236   5.2302 0.3707733 7.075041 
1 1 1   35   13    8 o   33.206   5.6491   26.649   7.7705   19.168   10.489   35.750   11.569   27.773   8.4232   38.639   7.5299 -10.86605 11.29824 
1 1 1   35   13    9 o   69.564   3.9986  107.094   11.413  112.009   17.165  103.199   15.280   70.785   5.8795   68.342   5.4210 2.442924 7.997182 
1 1 1   35   13   10 o   35.482   6.3561   32.720   9.3536   28.260   14.253   36.094   12.396   32.633   9.8016   38.332   8.0949 -5.699520 12.71214 
1 1 1   35   13   11 f   17.711   5.6233  -1.4324   8.5637  -8.9355   14.530   2.5615   10.601   17.188   8.0697   18.235   7.8338 -1.046669 11.24669 
1 1 1   35   13   12 o   68.695   5.3926  104.926   15.279   0.0000   0.0000  104.926   15.279  ?   ?    68.695   5.3926      ?      ? 
1 1 1   35   13   13 o   16.039   7.3735  -4.3451   11.182   0.0000   0.0000  -4.3451   11.182  ?   ?    16.039   7.3735      ?      ? 
1 1 1   35   13   14 o   43.509   11.386   55.498   20.669   0.0000   0.0000   55.498   20.669  ?   ?    43.509   11.386      ?      ? 
1 1 1   35   13   15 o   25.448   10.589   14.814   18.379   0.0000   0.0000   14.814   18.379  ?   ?    25.448   10.589      ?      ? 
1 1 1   35   13   16 o   18.895   8.8499  -6.8903   17.299   0.0000   0.0000  -6.8903   17.299  ?   ?    18.895   8.8499      ?      ? 
1 1 1   35   14    0 o   45.309   4.4036   46.421   11.013   46.421   11.013   46.421   11.013   45.309   6.2276   45.309   6.2276 0.000000 0.000000 
1 1 1   35   14    1 o   53.913   3.6375   63.710   8.0848   66.165   11.495   61.306   11.373   54.988   5.0684   52.839   5.2188 2.149170 7.274919 
1 1 1   35   14    2 o   33.354   5.3226   26.808   7.1494   27.858   10.171   25.783   10.051   34.064   7.4473   32.643   7.6065 1.420601 10.64528 
1 1 1   35   14    3 f  105.038   2.9442  237.690   12.611  242.448   16.747  231.459   19.164  106.596   3.8092  103.479   4.4902 3.116707 5.888345 
1 1 1   35   14    4 o   17.296   5.2491   1.2333   6.9139   5.2467   9.2804  -3.7726   10.365   18.804   7.6422   15.789   7.1980 3.015627 10.49829 
1 1 1   35   14    5 o   43.738   4.7559   44.784   8.1758   49.393   10.962   39.007   12.273   47.173   5.6342   40.302   7.6635 6.871105 9.511807 
1 1 1   35   14    6 o   32.406   5.8471   25.712   7.8218   22.114   10.416   30.363   11.844   29.840   8.2072   34.971   8.3304 -5.131233 11.69418 
1 1 1   35   14    7 o   39.597   5.1073   36.192   8.1111   30.998   10.685   43.255   12.460   35.915   7.4572   43.279   6.9805 -7.364601 10.21457 
1 1 1   35   14    8 o   21.564   5.6914   6.0332   8.2313  -9.7338   12.157   19.381   11.185   15.413   7.2809   27.715   8.7496 -12.30208 11.38277 
1 1 1   35   14    9 o   31.531   6.6875   26.284   9.4105   24.550   13.898   27.752   12.788   30.389   9.7699   32.672   9.1345 -2.282637 13.37496 
1 1 1   35   14   10 o   48.126   5.2018   54.558   9.9118   68.283   14.667   43.021   13.447   54.521   6.5224   41.730   8.1052 12.79025 10.40361 
1 1 1   35   14   11 o   34.922   6.7107   31.567   9.6794   37.674   15.868   27.948   12.215   37.047   10.105   32.798   8.8329 4.248951 13.42134 
1 1 1   35   14   12 o   29.548   9.0549   23.056   12.078   0.0000   0.0000   23.056   12.078  ?   ?    29.548   9.0549      ?      ? 
1 1 1   35   14   13 o   21.991   8.6287   10.327   11.419   0.0000   0.0000   10.327   11.419  ?   ?    21.991   8.6287      ?      ? 
1 1 1   35   14   14 o   50.017   10.521   69.608   21.016   0.0000   0.0000   69.608   21.016  ?   ?    50.017   10.521      ?      ? 
1 1 1   35   14   15 o   15.421   7.5519 -22.3609   16.171   0.0000   0.0000 -22.3609   16.171  ?   ?    15.421   7.5519      ?      ? 
1 1 1   35   15    0 f   60.888   3.5138   80.208   12.288   80.208   12.288   80.208   12.288   60.888   4.9693   60.888   4.9693 0.000000 0.000000 
1 1 1   35   15    1 o   49.567   3.9195   54.424   7.9746   47.853   11.082   61.479   11.484   46.301   5.8034   52.834   5.2700 -6.533485 7.839092 
1 1 1   35   15    2 o   78.787   3.3082  136.214   10.589  144.883   14.140  125.146   15.978   82.078   4.1771   75.497   5.1312 6.580765 6.616457 
1 1 1   35   15    3 o   41.762   4.8528   39.766   8.1004   33.421   10.702   48.278   12.395   37.505   7.1798   46.018   6.5307 -8.512844 9.705632 
1 1 1   35   15    4 o   18.424   5.4446   2.2839   7.0542  -2.8704   9.2659   9.3900   10.880   15.172   6.8736   21.676   8.4456 -6.503547 10.88918 
1 1 1   35   15    5 o   29.145   5.9289   21.942   7.7448   26.220   10.094   15.820   12.076   32.808   7.6077   25.483   9.0955 7.325081 11.85775 
1 1 1   35   15    6 o   28.880   6.0984   21.389   7.8781   23.527   10.491   18.624   11.930   30.670   8.1530   27.090   9.0715 3.579498 12.19687 
1 1 1   35   15    7 f   53.681   5.0217   69.571   10.215   47.613   14.690   90.131   14.215   43.674   8.4608   63.687   5.4115 -20.01374 10.04337 
1 1 1   35   15    8 o   39.830   5.9005   39.975   9.3048   38.111   14.169   41.389   12.338   38.307   9.1022   41.352   7.5109 -3.045059 11.80098 
1 1 1   35   15    9 o   20.731   5.9366   6.6166   8.3986  -1.7941   12.649   13.248   11.232   17.808   8.0526   23.654   8.7253 -5.846298 11.87328 
1 1 1   35   15   10 o   21.503   5.9275   7.5294   8.3461  -2.6359   11.952   17.203   11.660   17.061   7.7594   25.945   8.9628 -8.883295 11.85499 
1 1 1   35   15   11 f   49.727   6.4656   57.245   13.261   0.0000   0.0000   57.245   13.261  ?   ?    49.727   6.4656      ?      ? 
1 1 1   35   15   12 o   45.234   6.9686   48.312   13.001   0.0000   0.0000   48.312   13.001  ?   ?    45.234   6.9686      ?      ? 
1 1 1   35   15   13 o   17.514   7.7231   0.9232   10.886   0.0000   0.0000   0.9232   10.886  ?   ?    17.514   7.7231      ?      ? 
1 1 1   35   16    0 o  103.016   2.7270  224.041   16.334  224.041   16.334  224.041   16.334  103.016   3.8566  103.016   3.8566 0.000000 0.000000 
1 1 1   35   16    1 o   38.299   5.0853   36.740   7.8170   15.892   10.984   58.139   11.127   25.347   8.7023   51.250   5.2642 -25.90323 10.17069 
1 1 1   35   16    2 o   37.376   5.3858   34.303   8.0826   38.672   10.883   28.929   12.069   41.109   6.4189   33.643   8.6500 7.465591 10.77152 
1 1 1   35   16    3 o   40.469   5.1907   38.568   8.3062   26.228   11.137   54.035   12.468   32.204   8.3244   48.734   6.2032 -16.52932 10.38148 
1 1 1   35   16    4 o   28.373   5.8037   20.696   7.6442   27.622   10.337   12.338   11.356   33.516   7.6468   23.230   8.7326 10.28599 11.60743 
1 1 1   35   16    5 o   19.205   5.4231   3.9524   7.3123   13.009   9.9209  -6.8191   10.820   23.349   8.2537   15.062   7.0366 8.287784 10.84610 
1 1 1   35   16    6 o   56.999   4.4061   74.341   10.288   73.725   15.386   74.839   13.836   56.435   6.6100   57.564   5.8277 -1.128693 8.812160 
1 1 1   35   16    7 o   24.830   6.3247   15.283   8.4183   11.614   12.561   18.275   11.343   23.021   9.0444   26.639   8.8433 -3.618723 12.64934 
1 1 1   35   16    8 o   47.668   5.1114   54.798   9.6390   49.742   14.418   58.883   12.961   44.658   8.1273   50.678   6.2009 -6.019718 10.22276 
1 1 1   35   16    9 o   45.646   5.4715   52.624   9.6103   36.458   14.028   66.922   13.192   37.042   9.2188   54.251   5.8959 -17.20897 10.94292 
1 1 1   35   16   10 o   27.619   6.5105   20.054   8.6649   22.935   12.973   17.734   11.643   29.098   9.4478   26.141   8.9603 2.957052 13.02107 
1 1 1   35   16   11 o   64.363   5.6877   93.774   15.099   0.0000   0.0000   93.774   15.099  ?   ?    64.363   5.6877      ?      ? 
1 1 1   35   17    0 o   25.367   7.1503   20.161   10.236   20.161   10.236   20.161   10.236   25.367   10.112   25.367   10.112 0.000000 0.000000 
1 1 1   35   17    1 o   18.462   5.5110   3.9016   7.1778   2.4906   9.7238   5.5909   10.640   17.499   7.5099   19.424   8.0675 -1.924986 11.02192 
1 1 1   35   17    2 f   62.799   3.6873   87.227   9.4996   83.359   12.693   92.152   14.323   61.398   5.0124   64.200   5.4092 -2.801952 7.374558 
1 1 1   35   17    3 o   24.705   6.1329   15.162   7.7096   14.482   10.417   15.987   11.465   24.222   8.4657   25.187   8.8760 -0.9642467 12.26583 
1 1 1   35   17    4 o   35.798   5.3272   30.475   8.0562   15.012   10.670   50.977   12.286   24.549   8.5688   47.046   6.3319 -22.49650 10.65444 
1 1 1   35   17    5 o   19.913   5.8787   5.1614   8.4175  -2.1623   12.835   10.689   11.150   17.719   8.0518   22.108   8.5677 -4.388231 11.75737 
1 1 1   35   17    6 o   24.412   6.4018   14.668   8.5459   14.148   13.013   15.062   11.332   24.257   9.2938   24.567   8.8065 -0.3099518 12.80353 
1 1 1   35   17    7 o   41.081   5.7289   42.875   9.4204   33.864   13.731   50.887   12.948   35.550   9.2693   46.612   6.7351 -11.06247 11.45778 
1 1 1   35   17    8 o   31.848   6.1420   27.799   9.0617   14.823   13.687   37.924   12.091   24.635   9.5077   39.061   7.7782 -14.42603 12.28403 
1 1 1   35   17    9 o   26.929   6.2552   17.799   8.6296   28.620   12.694   8.5015   11.767   32.713   9.0850   21.146   8.6008 11.56656 12.51044 
1 1 1   35   18    0 o   17.427   7.0791   10.243   11.480   10.243   11.480   10.243   11.480   17.427   10.011   17.427   10.011 0.000000 0.000000 
1 1 1   35   18    1 o   22.914   5.4637   10.656   7.5021   22.570   10.121  -3.8740   11.177   29.741   8.0529   16.086   7.3864 13.65550 10.92737 
1 1 1   35   18    2 o   21.768   5.8451   9.7690   7.3604   5.2991   9.8461   15.431   11.081   18.797   7.7801   24.738   8.7254 -5.941113 11.69023 
1 1 1   35   18    3 o   27.200   6.0145   18.801   8.6206   5.4220   12.775   29.987   11.681   20.255   8.6478   34.144   8.3614 -13.88967 12.02902 
1 1 1   35   18    4 o   49.653   4.8883   58.460   9.9332   53.193   14.391   63.253   13.727   47.030   7.4193   52.276   6.3668 -5.246349 9.776602 
1 1 1   35   18    5 o   38.575   5.9749   38.619   9.2248   34.109   13.750   42.311   12.440   35.645   9.2665   41.505   7.5450 -5.859692 11.94972 
1 1 1   35   18    6 o   25.222   6.4199   15.619   8.6292   21.427   12.898   10.912   11.611   28.171   9.4320   22.273   8.7118 5.898390 12.83972 
1 1 1   36    0    0 o   50.335   7.2100   60.270   18.744   60.270   18.744   60.270   18.744   50.335   10.196   50.335   10.196 0.000000 0.000000 
1 1 1   36    0    1 o   41.131   5.6046   40.201   12.005   40.201   12.005   40.201   12.005   41.131   7.9260   41.131   7.9260 0.000000 0.000000 
1 1 1   36    0    2 o   31.149   7.2766   27.207   11.748   27.207   11.748   27.207   11.748   31.149   10.291   31.149   10.291 0.000000 0.000000 
1 1 1   36    0    3 o   14.663   6.4344   4.2979   11.011   4.2979   11.011   4.2979   11.011   14.663   9.0996   14.663   9.0996 0.000000 0.000000 
1 1 1   36    0    4 o   85.885   3.4425  156.963   17.119  156.963   17.119  156.963   17.119   85.885   4.8685   85.885   4.8685 0.000000 0.000000 
1 1 1   36    0    5 f   11.652   5.5941  -4.7755   11.454  -4.7755   11.454  -4.7755   11.454   11.652   7.9113   11.652   7.9113 0.000000 0.000000 
1 1 1   36    0    6 o   86.682   3.4623  159.949   17.378  159.949   17.378  159.949   17.378   86.682   4.8964   86.682   4.8964 0.000000 0.000000 
1 1 1   36    0    7 o   15.958   6.7782   6.7288   11.367   6.7288   11.367   6.7288   11.367   15.958   9.5858   15.958   9.5858 0.000000 0.000000 
1 1 1   36    0    8 o   71.835   3.7603  111.061   15.557  111.061   15.557  111.061   15.557   71.835   5.3179   71.835   5.3179 0.000000 0.000000 
1 1 1   36    0    9 o   18.257   7.1447   10.935   11.144   10.935   11.144   10.935   11.144   18.257   10.104   18.257   10.104 0.000000 0.000000 
1 1 1   36    0   10 o   42.344   9.0177   50.580   19.418   50.580   19.418   50.580   19.418   42.344   12.753   42.344   12.753 0.000000 0.000000 
1 1 1   36    0   11 f   23.801   9.2707   20.746   18.663   20.746   18.663   20.746   18.663   23.801   13.111   23.801   13.111 0.000000 0.000000 
1 1 1   36    1    0 o   26.985   7.7561   22.589   11.976   22.589   11.976   22.589   11.976   26.985   10.969   26.985   10.969 0.000000 0.000000 
1 1 1   36    1    1 o   41.698   5.3832   41.066   8.8474   55.025   12.612   27.540   12.415   49.897   6.1282   33.500   8.8521 16.39632 10.76639 
1 1 1   36    1    2 f   56.348   4.1760   69.867   9.6859   75.158   13.771   64.687   13.626   58.581   5.6996   54.115   6.1050 4.465790 8.352003 
1 1 1   36    1    3 o   24.710   6.2861   13.559   8.1970   14.863   11.374   12.150   11.823   25.442   8.8488   23.978   8.9308 1.463793 12.57220 
1 1 1   36    1    4 o   32.513   6.1009   25.710   8.4383   31.433   12.084   20.264   11.788   36.164   8.2803   28.862   8.9622 7.301468 12.20184 
1 1 1   36    1    5 f   95.938   3.2999  197.647   13.055  202.717   18.655  192.782   18.275   97.153   4.6556   94.724   4.6778 2.428635 6.599730 
1 1 1   36    1    6 o   30.319   6.2704   22.460   8.5821   28.659   12.087   16.157   12.187   34.320   8.5662   26.318   9.1592 8.001888 12.54080 
1 1 1   36    1    7 o   19.308   5.6425   2.3143   7.8525   10.433   10.948  -6.2867   11.269   22.702   8.5660   15.913   7.3468 6.789098 11.28500 
1 1 1   36    1    8 f   52.753   4.5064   62.285   9.7401   68.999   13.656   55.334   13.896   55.930   5.9199   49.576   6.7961 6.353912 9.012895 
1 1 1   36    1    9 o   19.058   5.5979   0.2430   7.9985 -10.4598   11.129   11.676   11.503   14.620   6.9243   23.497   8.7976 -8.877379 11.19570 
1 1 1   36    1   10 o   97.658   4.1060  197.923   15.313  178.496   18.133  246.219   28.591   90.808   4.8415  104.507   6.6330 -13.69934 8.211997 
1 1 1   36    1   11 o   63.213   8.6816   96.124   22.635   0.0000   0.0000   96.124   22.635  ?   ?    63.213   8.6816      ?      ? 
1 1 1   36    2    0 f   58.869   4.1548   75.830   13.940   75.830   13.940   75.830   13.940   58.869   5.8757   58.869   5.8757 0.000000 0.000000 
1 1 1   36    2    1 f   36.162   5.9239   31.547   8.6641   30.454   12.345   32.607   12.162   35.429   8.5471   36.896   8.2046 -1.466591 11.84772 
1 1 1   36    2    3 o   59.033   4.0726   76.406   9.8915   83.318   14.138   69.778   13.844   61.775   5.5488   56.292   5.9629 5.483238 8.145273 
1 1 1   36    2    4 o   35.785   5.8901   30.959   8.6786   40.015   12.435   22.360   12.117   41.386   7.5640   30.185   9.0310 11.20070 11.78024 
1 1 1   36    2    5 o   58.033   4.1512   73.976   9.8954   82.889   14.237   65.645   13.764   61.571   5.6063   54.495   6.1236 7.075630 8.302376 
1 1 1   36    2    7 o   30.571   6.2415   22.898   8.3722   19.525   11.762   26.361   11.919   28.334   8.9753   32.809   8.6757 -4.474968 12.48296 
1 1 1   36    2    8 o   86.684   3.3838  161.793   12.087  153.018   16.743  171.342   17.466   84.205   4.8210   89.163   4.7495 -4.957581 6.767506 
1 1 1   36    2    9 o   73.298   3.6399  116.836   11.004  115.781   15.524  117.901   15.599   72.957   5.1592   73.639   5.1358 -0.6824493 7.279725 
1 1 1   36    2   10 o   61.537   5.6680   83.450   14.386   0.0000   0.0000   83.450   14.386  ?   ?    61.537   5.6680      ?      ? 
1 1 1   36    2   11 o   48.560   10.725   62.370   20.906   0.0000   0.0000   62.370   20.906  ?   ?    48.560   10.725      ?      ? 
1 1 1   36    3    0 o   7.8627   4.0302 -19.3459   10.010 -19.3459   10.010 -19.3459   10.010   7.8627   5.6996   7.8627   5.6996 0.000000 0.000000 
1 1 1   36    3    1 o   25.985   6.3352   15.690   8.2288   15.481   12.040   15.873   11.272   25.918   9.0992   26.052   8.8171 -0.1340542 12.67034 
1 1 1   36    3    2 o   18.933   5.6117   1.8845   7.7538  -5.0858   11.038   8.6746   10.894   16.113   7.3773   21.753   8.4580 -5.639740 11.22336 
1 1 1   36    3    3 o   26.375   6.0906   15.879   8.1980   23.759   11.348   7.2756   11.857   31.254   8.5539   21.496   8.6726 9.757963 12.18124 
1 1 1   36    3    4 o   55.775   4.3100   68.766   9.9064   70.604   13.874   66.854   14.149   56.629   5.9403   54.921   6.2464 1.707928 8.619967 
1 1 1   36    3    5 o   30.727   6.1591   23.212   8.4137   29.201   11.652   16.687   12.162   34.829   8.2401   26.625   9.1563 8.204309 12.31816 
1 1 1   36    3    6 o   19.805   5.8074   3.7199   7.9760  -1.2971   11.088   9.1004   11.482   17.412   7.7302   22.198   8.6688 -4.785847 11.61482 
1 1 1   36    3    7 f   51.472   4.5691   59.588   9.5973   51.571   13.792   67.114   13.363   47.745   7.0038   55.198   5.8698 -7.453007 9.138237 
1 1 1   36    3    8 o   16.092   5.1533  -5.8444   7.7002 -14.0116   10.935   2.1891   10.845   13.626   6.5630   18.558   7.9468 -4.932753 10.30652 
1 1 1   36    3    9 o   39.887   5.5085   37.966   8.8125   28.523   12.494   47.316   12.432   33.897   8.8434   45.876   6.5704 -11.97880 11.01708 
1 1 1   36    3   10 o   33.427   8.7253   27.780   12.158   0.0000   0.0000   27.780   12.158  ?   ?    33.427   8.7253      ?      ? 
1 1 1   36    3   12 o   29.473   11.388   22.317   19.654   0.0000   0.0000   22.317   19.654  ?   ?    29.473   11.388      ?      ? 
1 1 1   36    4    0 o   24.905   7.6723   19.864   11.564   19.864   11.564   19.864   11.564   24.905   10.850   24.905   10.850 0.000000 0.000000 
1 1 1   36    4    1 o   63.489   3.9503   88.190   10.306   97.179   14.652   79.389   14.498   66.866   5.3129   60.112   5.8475 6.754047 7.900651 
1 1 1   36    4    2 o   59.644   4.1536   78.274   9.9305  102.727   14.506   56.708   13.623   68.880   5.1061   50.408   6.5526 18.47234 8.307141 
1 1 1   36    4    3 o  123.393   3.1506  325.903   16.033  321.400   22.500  330.548   22.852  122.531   4.4521  124.255   4.4591 -1.724449 6.301183 
1 1 1   36    4    4 f  104.975   3.2421  236.427   14.035  242.611   19.979  230.403   19.720  106.357   4.5545  103.593   4.6154 2.764214 6.484277 
1 1 1   36    4    5 o  109.050   3.1987  254.983   14.385  260.162   20.416  249.877   20.272  110.178   4.4928  107.922   4.5542 2.255714 6.397379 
1 1 1   36    4    6 o   29.009   6.1875   20.281   8.4000   27.763   11.861   12.753   11.898   33.747   8.5203   24.270   8.9748 9.476608 12.37506 
1 1 1   36    4    7 o   26.452   6.6905   16.514   9.2999   19.135   11.545   11.671   15.695   28.032   8.8932   24.872   9.9980 3.160219 13.38093 
1 1 1   36    4    8 o   18.515   5.6119   1.3835   7.8244   5.9624   11.071  -3.1857   11.059   20.358   8.3186   16.671   7.5350 3.686504 11.22385 
1 1 1   36    4    9 o   25.785   6.7475   13.113   9.1314   23.212   16.003   8.2368   11.119   30.120   10.495   21.451   8.4835 8.668756 13.49498 
1 1 1   36    4   10 o   26.835   10.600   16.062   17.341   0.0000   0.0000   16.062   17.341  ?   ?    26.835   10.600      ?      ? 
1 1 1   36    4   11 o   19.405   8.9188  -5.0330   16.347   0.0000   0.0000  -5.0330   16.347  ?   ?    19.405   8.9188      ?      ? 
1 1 1   36    4   12 o   22.817   9.8688   5.8729   17.050   0.0000   0.0000   5.8729   17.050  ?   ?    22.817   9.8688      ?      ? 
1 1 1   36    5    0 o   21.984   7.6380   16.245   11.665   16.245   11.665   16.245   11.665   21.984   10.802   21.984   10.802 0.000000 0.000000 
1 1 1   36    5    1 o   40.551   5.4915   38.482   8.9742   35.215   12.895   41.550   12.497   38.231   8.4065   42.870   7.0680 -4.639118 10.98301 
1 1 1   36    5    2 o   38.329   6.7071   37.330   10.255   39.024   12.618   34.033   17.600   40.688   7.8027   35.970   10.911 4.718292 13.41428 
1 1 1   36    5    3 o   35.130   5.7254   29.463   8.6962   16.355   12.134   43.307   12.470   26.412   9.1421   43.849   6.8950 -17.43638 11.45073 
1 1 1   36    5    4 o   40.064   5.5183   37.829   8.8936   41.993   12.295   33.260   12.880   43.157   6.9074   36.971   8.6079 6.186272 11.03663 
1 1 1   36    5    5 o   29.150   6.3976   20.866   8.5517   18.212   12.242   23.396   11.951   27.491   9.1892   30.809   8.9038 -3.318192 12.79523 
1 1 1   36    5    6 o   60.262   4.1379   80.058   10.279   76.806   14.467   83.374   14.608   58.961   5.9490   61.563   5.7530 -2.602184 8.275767 
1 1 1   36    5    7 o   63.342   3.9867   88.230   10.402   92.579   14.666   83.828   14.757   65.030   5.4680   61.654   5.8031 3.375408 7.973395 
1 1 1   36    5    8 o   33.602   6.1950   28.015   8.6746   27.510   12.272   28.520   12.263   33.268   8.8061   33.935   8.7158 -0.6670837 12.39004 
1 1 1   36    5    9 o   91.745   4.0662  187.689   14.582  180.590   24.534  191.567   18.132   89.335   6.6585   94.155   4.6690 -4.820923 8.132344 
1 1 1   36    5   10 o   89.761   7.1620  185.582   26.515   0.0000   0.0000  185.582   26.515  ?   ?    89.761   7.1620      ?      ? 
1 1 1   36    5   11 o   30.576   11.219   25.018   18.535   0.0000   0.0000   25.018   18.535  ?   ?    30.576   11.219      ?      ? 
1 1 1   36    5   12 o   25.761   10.602   13.469   18.144   0.0000   0.0000   13.469   18.144  ?   ?    25.761   10.602      ?      ? 
1 1 1   36    6    0 o   19.858   7.4317   13.284   11.540   13.284   11.540   13.284   11.540   19.858   10.510   19.858   10.510 0.000000 0.000000 
1 1 1   36    6    1 o   86.905   3.3846  162.833   12.123  157.167   17.216  168.407   17.075   85.321   4.8923   88.489   4.6785 -3.168083 6.769220 
1 1 1   36    6    2 f   76.471   4.3224  124.227   12.837  145.573   22.950  114.507   15.487   80.311   6.9285   72.631   5.1698 7.680786 8.644719 
1 1 1   36    6    3 o   35.923   6.7392   27.655   9.8437   50.286   17.979   17.967   11.763   44.526   10.031   27.321   9.0027 17.20467 13.47847 
1 1 1   36    6    4 o   17.407   5.3205  -3.7139   7.8299 -16.3582   11.252   8.1577   10.903   13.403   6.5044   21.410   8.4217 -8.007026 10.64105 
1 1 1   36    6    5 o   45.581   5.0087   47.829   9.1148   41.353   12.902   54.283   12.879   41.828   7.7644   49.333   6.3296 -7.505222 10.01744 
1 1 1   36    6    6 o   50.167   4.5956   56.372   9.4963   52.599   13.201   60.418   13.671   48.354   6.6192   51.979   6.3768 -3.625401 9.191174 
1 1 1   36    6    7 o   44.307   5.0975   45.303   9.0634   39.838   12.568   51.224   13.082   40.972   7.7208   47.642   6.6578 -6.670406 10.19493 
1 1 1   36    6    8 o   91.632   4.0722  182.318   14.674  197.475   25.156  174.501   18.067   93.593   6.5169   89.671   4.8850 3.922112 8.144492 
1 1 1   36    6    9 o   27.006   6.8680   17.731   9.6197   16.914   15.777   18.215   12.137   26.841   10.245   27.172   9.1494 -0.3317604 13.73600 
1 1 1   36    6   10 o   31.323   11.299   26.633   18.684   0.0000   0.0000   26.633   18.684  ?   ?    31.323   11.299      ?      ? 
1 1 1   36    6   11 o   37.319   11.430   39.407   19.249   0.0000   0.0000   39.407   19.249  ?   ?    37.319   11.430      ?      ? 
1 1 1   36    6   12 f   30.954   11.198   26.075   18.369   0.0000   0.0000   26.075   18.369  ?   ?    30.954   11.198      ?      ? 
1 1 1   36    6   13 o   31.011   11.362   26.531   19.001   0.0000   0.0000   26.531   19.001  ?   ?    31.011   11.362      ?      ? 
1 1 1   36    7    0 o   22.573   7.7426   17.190   11.923   17.190   11.923   17.190   11.923   22.573   10.950   22.573   10.950 0.000000 0.000000 
1 1 1   36    7    1 o   37.161   5.7316   33.181   8.5401   35.085   12.089   31.285   12.066   38.380   7.9003   35.943   8.3060 2.437531 11.46320 
1 1 1   36    7    2 o   13.463   4.5689 -12.6279   7.3411 -12.1715   10.351 -13.0898   10.413   13.543   6.4873   13.382   6.4354 0.1610174 9.137792 
1 1 1   36    7    3 o   34.606   6.1084   29.425   8.6923   29.832   12.316   29.021   12.270   34.864   8.6146   34.349   8.6624 0.5153236 12.21678 
1 1 1   36    7    4 o   20.405   5.7008   4.1106   7.8795   14.515   11.186  -6.1355   11.101   25.043   8.7717   15.768   7.2839 9.274806 11.40165 
1 1 1   36    7    5 o   55.489   4.2695   68.465   9.7570   70.881   13.628   65.925   13.976   56.626   5.8351   54.353   6.2343 2.273056 8.538959 
1 1 1   36    7    6 o   41.859   5.5017   41.814   9.1582   31.054   12.893   52.774   13.011   35.300   8.8669   48.419   6.5155 -13.11824 11.00338 
1 1 1   36    7    7 o   31.430   9.0309   24.901   12.327   0.0000   0.0000   24.901   12.327  ?   ?    31.430   9.0309      ?      ? 
1 1 1   36    7    8 o   54.089   6.3469   65.882   14.159   0.0000   0.0000   65.882   14.159  ?   ?    54.089   6.3469      ?      ? 
1 1 1   36    7    9 o   41.272   7.9365   41.128   13.019   0.0000   0.0000   41.128   13.019  ?   ?    41.272   7.9365      ?      ? 
1 1 1   36    7   10 o   34.544   11.269   33.446   18.448   0.0000   0.0000   33.446   18.448  ?   ?    34.544   11.269      ?      ? 
1 1 1   36    7   11 o   16.286   7.8509 -17.4571   15.723   0.0000   0.0000 -17.4571   15.723  ?   ?    16.286   7.8509      ?      ? 
1 1 1   36    7   12 o   31.625   11.154   27.646   18.108   0.0000   0.0000   27.646   18.108  ?   ?    31.625   11.154      ?      ? 
1 1 1   36    7   13 o   34.824   11.719   35.487   19.910   0.0000   0.0000   35.487   19.910  ?   ?    34.824   11.719      ?      ? 
1 1 1   36    8    0 o   51.796   4.6721   60.290   13.488   60.290   13.488   60.290   13.488   51.796   6.6074   51.796   6.6074 0.000000 0.000000 
1 1 1   36    8    1 o   86.744   3.4395  162.754   12.253  143.847   17.025  183.074   17.650   81.339   5.0748   92.149   4.6439 -10.80929 6.878923 
1 1 1   36    8    2 o   76.111   3.6317  126.191   11.394  121.611   16.126  130.758   16.101   74.651   5.2375   77.571   5.0326 -2.920303 7.263482 
1 1 1   36    8    3 o   70.892   3.7394  109.861   10.907  119.498   15.564  100.558   15.291   74.094   5.0929   67.691   5.4768 6.402863 7.478854 
1 1 1   36    8    4 o   35.494   6.0200   31.019   8.7045   32.493   12.335   29.556   12.285   36.440   8.3821   34.547   8.6430 1.892513 12.03995 
1 1 1   36    8    5 o   27.042   6.3366   17.824   8.2251   16.478   11.233   19.380   12.077   26.133   8.8020   27.950   9.1177 -1.817690 12.67312 
1 1 1   36    8    6 o   56.335   6.2975   78.278   13.951   93.995   19.643   62.282   19.817   63.597   7.4887   49.073   10.127 14.52353 12.59500 
1 1 1   36    8    7 o   19.333   6.1338  -2.4381   10.489   4.6028   13.893 -11.7707   15.995   21.037   9.0008   17.630   8.3354 3.406620 12.26763 
1 1 1   36    8    8 o   55.703   5.1573   73.631   11.270   64.675   18.144   79.257   14.380   51.768   8.4979   59.638   5.8462 -7.870045 10.31464 
1 1 1   36    8    9 o   32.534   11.480   29.584   19.186   0.0000   0.0000   29.584   19.186  ?   ?    32.534   11.480      ?      ? 
1 1 1   36    8   10 o   76.693   7.7407  138.775   24.485   0.0000   0.0000  138.775   24.485  ?   ?    76.693   7.7407      ?      ? 
1 1 1   36    8   11 o   25.518   10.461   13.419   17.577   0.0000   0.0000   13.419   17.577  ?   ?    25.518   10.461      ?      ? 
1 1 1   36    8   12 o   41.674   11.228   48.965   19.733   0.0000   0.0000   48.965   19.733  ?   ?    41.674   11.228      ?      ? 
1 1 1   36    8   13 o   25.396   10.547   13.475   18.184   0.0000   0.0000   13.475   18.184  ?   ?    25.396   10.547      ?      ? 
1 1 1   36    9    0 o   13.356   6.1024   1.2819   11.120   1.2819   11.120   1.2819   11.120   13.356   8.6301   13.356   8.6301 0.000000 0.000000 
1 1 1   36    9    1 o   19.177   5.7571   3.3959   7.9285   3.1420   11.350   3.6380   11.081   19.152   8.1633   19.201   8.1203 -0.4952812E-01 11.51429 
1 1 1   36    9    2 o   46.018   6.2461   53.959   10.769   58.422   13.244   45.250   18.502   51.012   6.2948   41.024   10.790 9.987755 12.49214 
1 1 1   36    9    3 o   49.744   4.6120   55.813   9.3831   65.394   13.602   47.115   12.960   54.085   6.0978   45.403   6.9209 8.681572 9.223941 
1 1 1   36    9    4 o   19.291   5.7020   3.0077   7.8584   9.5097   11.352  -2.9750   10.889   22.078   8.6201   16.504   7.4664 5.573776 11.40408 
1 1 1   36    9    5 o   39.587   6.3259   41.232   10.197   29.805   16.498   48.296   12.972   33.213   10.641   45.960   6.8431 -12.74667 12.65178 
1 1 1   36    9    6 f   68.525   4.6987  107.918   12.518  102.936   21.148  110.604   15.531   66.129   7.7537   70.921   5.3095 -4.792061 9.397342 
1 1 1   36    9    7 o   26.461   6.0696   16.155   9.3449  -3.7410   14.930   28.972   11.982   18.882   8.6203   34.039   8.5471 -15.15719 12.13927 
1 1 1   36    9    8 o   94.400   3.9690  194.583   14.693  207.752   25.245  187.838   18.068   95.798   6.3894   93.001   4.7103 2.797531 7.937952 
1 1 1   36    9    9 o   38.677   11.546   42.666   19.822   0.0000   0.0000   42.666   19.822  ?   ?    38.677   11.546      ?      ? 
1 1 1   36    9   10 o   57.592   9.3139   83.042   22.124   0.0000   0.0000   83.042   22.124  ?   ?    57.592   9.3139      ?      ? 
1 1 1   36    9   11 o   38.715   11.474   43.195   19.627   0.0000   0.0000   43.195   19.627  ?   ?    38.715   11.474      ?      ? 
1 1 1   36    9   12 o   32.384   11.644   30.700   19.825   0.0000   0.0000   30.700   19.825  ?   ?    32.384   11.644      ?      ? 
1 1 1   36    9   13 o   50.583   10.881   71.120   22.028   0.0000   0.0000   71.120   22.028  ?   ?    50.583   10.881      ?      ? 
1 1 1   36   10    0 o   13.792   6.2497   2.1966   11.358   2.1966   11.358   2.1966   11.358   13.792   8.8384   13.792   8.8384 0.000000 0.000000 
1 1 1   36   10    1 o   19.204   5.5699   1.9904   7.7890   12.236   11.007  -8.2852   11.023   23.421   8.6380   14.987   7.0341 8.434074 11.13971 
1 1 1   36   10    2 o   41.806   5.3553   41.572   8.9456   34.583   12.658   48.545   12.644   37.420   8.4065   46.192   6.6368 -8.772007 10.71057 
1 1 1   36   10    3 o   44.808   6.1209   48.650   10.424   51.020   18.156   47.485   12.732   44.031   10.198   45.584   6.7718 -1.552578 12.24173 
1 1 1   36   10    4 o   18.523   5.8117  -0.0274   8.5249   1.2101   14.191  -0.7260   10.663   19.956   8.8079   17.091   7.5844 2.864969 11.62337 
1 1 1   36   10    5 o   24.107   6.5954   11.773   9.0151   16.767   15.113   9.0149   11.232   26.515   10.050   21.699   8.5440 4.815819 13.19088 
1 1 1   36   10    6 o   46.258   5.8297   49.182   10.401   61.254   18.058   43.189   12.723   49.314   9.2171   43.202   7.1405 6.111973 11.65940 
1 1 1   36   10    7 o   56.368   5.0569   71.957   11.170   79.137   19.289   68.334   13.701   57.533   8.1289   55.204   6.0176 2.328537 10.11388 
1 1 1   36   10    8 o   17.015   8.1469 -15.2988   16.287   0.0000   0.0000 -15.2988   16.287  ?   ?    17.015   8.1469      ?      ? 
1 1 1   36   10    9 o   59.735   8.6851   87.476   21.398   0.0000   0.0000   87.476   21.398  ?   ?    59.735   8.6851      ?      ? 
1 1 1   36   10   10 o   91.198   7.2961  195.126   27.444   0.0000   0.0000  195.126   27.444  ?   ?    91.198   7.2961      ?      ? 
1 1 1   36   10   11 o   64.361   8.7541  103.010   23.238   0.0000   0.0000  103.010   23.238  ?   ?    64.361   8.7541      ?      ? 
1 1 1   36   10   12 o   69.897   8.4819  120.981   24.452   0.0000   0.0000  120.981   24.452  ?   ?    69.897   8.4819      ?      ? 
1 1 1   36   10   13 o   42.714   11.359   53.443   20.358   0.0000   0.0000   53.443   20.358  ?   ?    42.714   11.359      ?      ? 
1 1 1   36   11    0 o   37.727   6.4347   36.183   12.277   36.183   12.277   36.183   12.277   37.727   9.1001   37.727   9.1001 0.000000 0.000000 
1 1 1   36   11    1 o   63.430   3.9016   88.771   10.175   98.856   14.765   79.650   14.041   66.985   5.3442   59.875   5.6859 7.110226 7.803158 
1 1 1   36   11    2 o   21.862   6.4223   6.5054   8.9850   12.169   15.864   3.8306   10.902   24.652   10.001   19.071   8.0593 5.581272 12.84454 
1 1 1   36   11    3 o   62.494   4.7661   88.418   11.664   92.218   19.924   86.437   14.388   62.543   7.7236   62.444   5.5865 0.9867477E-01 9.532237 
1 1 1   36   11    4 o   18.746   5.9159  -0.1185   8.7931  -0.2257   15.474  -0.0674   10.686   20.159   9.0284   17.333   7.6471 2.825590 11.83173 
1 1 1   36   11    5 o   63.313   4.7362   90.768   11.712   94.465   20.098   88.868   14.411   63.279   7.7009   63.347   5.5158 -0.6883621E-01 9.472434 
1 1 1   36   11    6 o   22.728   6.6973   6.0441   10.738  -2.4989   14.367   16.855   16.162   18.843   8.5455   26.614   10.315 -7.771076 13.39462 
1 1 1   36   11    7 o   21.166   6.6124   1.1942   11.380  -4.8495   15.236   8.8181   17.113   18.672   8.5925   23.661   10.053 -4.988594 13.22478 
1 1 1   36   11    8 o   42.625   10.790   50.139   18.987   0.0000   0.0000   50.139   18.987  ?   ?    42.625   10.790      ?      ? 
1 1 1   36   11    9 o   41.734   11.622   50.771   20.744   0.0000   0.0000   50.771   20.744  ?   ?    41.734   11.622      ?      ? 
1 1 1   36   11   10 o   54.367   10.006   78.417   21.611   0.0000   0.0000   78.417   21.611  ?   ?    54.367   10.006      ?      ? 
1 1 1   36   11   11 o   24.353   10.330   11.273   18.020   0.0000   0.0000   11.273   18.020  ?   ?    24.353   10.330      ?      ? 
1 1 1   36   11   12 o   25.774   10.665   15.416   18.493   0.0000   0.0000   15.416   18.493  ?   ?    25.774   10.665      ?      ? 
1 1 1   36   11   13 o   37.208   11.700   42.578   20.019   0.0000   0.0000   42.578   20.019  ?   ?    37.208   11.700      ?      ? 
1 1 1   36   11   14 o   22.828   10.089   6.4954   18.677   0.0000   0.0000   6.4954   18.677  ?   ?    22.828   10.089      ?      ? 
1 1 1   36   12    0 o   11.874   5.8789 -12.4593   15.248 -12.4593   15.248 -12.4593   15.248   11.874   8.3141   11.874   8.3141 0.000000 0.000000 
1 1 1   36   12    1 o   43.122   6.2463   44.176   10.300   56.027   17.848   38.259   12.612   46.643   9.5978   39.602   7.9967 7.040684 12.49257 
1 1 1   36   12    2 o   42.031   6.4392   43.729   10.266   48.480   18.174   41.502   12.440   42.419   10.455   41.643   7.5198 0.7767715 12.87845 
1 1 1   36   12    3 o   29.739   6.8488   20.260   9.3010   33.989   16.449   13.807   11.277   35.220   10.519   24.258   8.7738 10.96216 13.69750 
1 1 1   36   12    4 o   40.413   6.3001   43.965   10.084   31.684   17.106   50.505   12.484   33.721   10.839   47.106   6.4254 -13.38532 12.60023 
1 1 1   36   12    5 o   31.916   7.3077   26.923   11.868   13.876   16.634   40.449   16.937   25.333   10.254   38.500   10.414 -13.16738 14.61537 
1 1 1   36   12    6 o   53.538   6.2988   71.901   13.524   76.318   18.765   67.127   19.510   56.227   8.0917   50.850   9.6554 5.376358 12.59768 
1 1 1   36   12    7 o   74.424   5.1832  130.235   15.877  125.077   21.627  136.265   23.382   73.018   7.1813   75.830   7.4761 -2.812416 10.36649 
1 1 1   36   12    8 o   42.549   10.927   51.094   19.276   0.0000   0.0000   51.094   19.276  ?   ?    42.549   10.927      ?      ? 
1 1 1   36   12    9 o   90.291   7.2037  192.630   26.827   0.0000   0.0000  192.630   26.827  ?   ?    90.291   7.2037      ?      ? 
1 1 1   36   12   10 o   22.547   9.8047   6.8800   17.011   0.0000   0.0000   6.8800   17.011  ?   ?    22.547   9.8047      ?      ? 
1 1 1   36   12   11 o   17.285   8.2427 -12.3947   16.316   0.0000   0.0000 -12.3947   16.316  ?   ?    17.285   8.2427      ?      ? 
1 1 1   36   12   12 f   36.070   11.597   39.965   19.581   0.0000   0.0000   39.965   19.581  ?   ?    36.070   11.597      ?      ? 
1 1 1   36   12   13 o   52.732   10.290   76.391   21.576   0.0000   0.0000   76.391   21.576  ?   ?    52.732   10.290      ?      ? 
1 1 1   36   13    0 o   23.072   8.6193   19.630   15.504   19.630   15.504   19.630   15.504   23.072   12.190   23.072   12.190 0.000000 0.000000 
1 1 1   36   13    1 o   34.561   7.5488   33.466   11.887   36.089   16.700   30.774   16.923   36.038   10.557   33.084   10.793 2.954525 15.09760 
1 1 1   36   13    2 o   58.816   5.8442   84.192   14.132   77.066   19.872   91.484   20.102   55.905   8.6184   61.727   7.8958 -5.822334 11.68846 
1 1 1   36   13    3 o   62.017   5.6348   92.253   14.321   79.739   19.646  106.445   20.921   57.122   8.3388   66.911   7.5809 -9.788895 11.26966 
1 1 1   36   13    4 o   56.947   6.0042   79.792   14.057   87.373   20.128   72.574   19.641   59.963   8.1385   53.931   8.8299 6.031876 12.00844 
1 1 1   36   13    5 o   73.502   5.1797  127.785   15.695  128.322   21.919  127.221   22.484   73.821   7.1991   73.183   7.4491 0.6379089 10.35940 
1 1 1   36   13    6 o   28.046   7.4907   20.968   11.885   18.661   16.814   23.271   16.801   27.011   10.506   29.082   10.680 -2.070324 14.98132 
1 1 1   36   13    7 o   29.681   10.795   24.769   17.107   0.0000   0.0000   24.769   17.107  ?   ?    29.681   10.795      ?      ? 
1 1 1   36   13    8 o   33.355   11.229   33.049   18.282   0.0000   0.0000   33.049   18.282  ?   ?    33.355   11.229      ?      ? 
1 1 1   36   13    9 o   60.482   8.6581   92.057   21.598   0.0000   0.0000   92.057   21.598  ?   ?    60.482   8.6581      ?      ? 
1 1 1   36   13   10 o   21.455   9.5793   3.2682   17.278   0.0000   0.0000   3.2682   17.278  ?   ?    21.455   9.5793      ?      ? 
1 1 1   36   13   11 o   19.691   9.1825  -5.4309   18.291   0.0000   0.0000  -5.4309   18.291  ?   ?    19.691   9.1825      ?      ? 
1 1 1   36   13   12 o   18.866   8.9317  -9.7856   18.480   0.0000   0.0000  -9.7856   18.480  ?   ?    18.866   8.9317      ?      ? 
1 1 1   36   14    0 o   15.930   7.1657   4.9493   14.595   4.9493   14.595   4.9493   14.595   15.930   10.134   15.930   10.134 0.000000 0.000000 
1 1 1   36   14    2 o   35.084   7.1202   34.124   11.901   50.184   16.837   18.088   16.825   43.458   9.6456   26.711   10.476 16.74617 14.24041 
1 1 1   36   14    3 o   83.714   4.9310  164.552   17.013  169.872   23.974  159.154   24.148   85.308   6.8137   82.120   7.1298 3.187988 9.862083 
1 1 1   36   14    4 o   38.822   7.3542   42.486   12.132   47.746   16.839   36.808   17.494   42.022   9.8816   35.621   10.894 6.400837 14.70838 
1 1 1   36   14    5 o   90.743   4.8306  192.529   18.067  185.729   24.993  199.971   26.146   89.117   6.7999   92.369   6.8630 -3.251801 9.661216 
1 1 1   36   14    6 o   21.051   6.4946   3.1170   10.470  -2.5459   13.409   11.964   16.760   17.953   8.1857   24.148   10.085 -6.194969 12.98928 
1 1 1   36   14    7 o   26.188   10.330   17.398   16.448   0.0000   0.0000   17.398   16.448  ?   ?    26.188   10.330      ?      ? 
1 1 1   36   14    8 o   77.823   7.4453  145.617   23.898   0.0000   0.0000  145.617   23.898  ?   ?    77.823   7.4453      ?      ? 
1 1 1   36   14    9 o   49.621   10.269   67.773   20.324   0.0000   0.0000   67.773   20.324  ?   ?    49.621   10.269      ?      ? 
1 1 1   36   14   10 o   76.556   8.0528  144.590   25.427   0.0000   0.0000  144.590   25.427  ?   ?    76.556   8.0528      ?      ? 
1 1 1   36   15    0 o   60.060   6.1090   86.111   20.116   86.111   20.116   86.111   20.116   60.060   8.6395   60.060   8.6395 0.000000 0.000000 
1 1 1   36   15    1 o   23.938   6.9440   12.080   11.079   15.636   15.309   8.1691   16.054   25.303   9.9711   22.572   9.6672 2.731138 13.88806 
1 1 1   36   15    2 o   29.768   7.5039   25.230   11.630   26.090   16.012   24.270   16.922   30.278   10.501   29.257   10.722 1.021542 15.00773 
1 1 1   36   15    3 o   20.741   6.4650   3.6065   10.793   4.9611   14.946   2.1304   15.602   21.048   9.1713   20.433   9.1144 0.6156349 12.92999 
1 1 1   36   15    4 o   31.196   7.3200   27.658   11.658   37.278   16.129   17.134   16.870   36.307   10.297   26.085   10.407 10.22234 14.63998 
1 1 1   36   15    5 o   22.668   6.7831   8.7856   11.080   12.907   15.344   4.2945   16.017   24.097   9.8136   21.239   9.3666 2.857874 13.56614 
1 1 1   36   15    6 o   58.812   8.6523   87.432   20.988   0.0000   0.0000   87.432   20.988  ?   ?    58.812   8.6523      ?      ? 
1 1 1   36   15    7 o   47.108   10.137   60.931   19.112   0.0000   0.0000   60.931   19.112  ?   ?    47.108   10.137      ?      ? 
1 1 1   36   16    0 o   38.234   8.7502   43.738   17.248   43.738   17.248   43.738   17.248   38.234   12.375   38.234   12.375 0.000000 0.000000 
1 1 1   36   16    1 f   61.482   5.5941   92.662   14.177   88.563   19.848   96.931   20.255   59.950   8.0272   63.014   7.7936 -3.064049 11.18818 
1 1 1   36   16    2 o   23.516   6.6429   8.5664   10.825  -5.8406   15.122   23.712   15.504   17.993   8.3766   29.040   10.312 -11.04739 13.28582 
1 1 1   36   16    3 o   27.165   7.1122   18.339   11.248   7.5833   15.559   30.113   16.279   22.124   9.4974   32.206   10.589 -10.08138 14.22446 
#END OF REFLECTIONS
